Cannabis sativa
Table of Contents
Details Top
Internal ID | UUID64400f2d6e78f373342603 |
Scientific name | Cannabis sativa |
Authority | L. |
First published in | Sp. Pl. : 1027 (1753) |
Description Top
Suggest a correction or write a new one!
This is a summary of Cannabis sativa, an annual herbaceous flowering plant indigenous to Eastern Asia. It has been cultivated throughout recorded history for industrial fiber, seed oil, food, recreation, religious and spiritual moods and medicine. It is a short-day flowering plant, with staminate (male) plants usually taller and less robust than pistillate (female or male) plants. The main psychoactive constituent of Cannabis is tetrahydrocannabinol (THC), but the plant is known to contain more than 500 compounds, including 113 cannabinoids. Common uses of Cannabis sativa include hempseed oil, caged-bird feed, recreational, medicinal, and spiritual purposes. It is cultivated in soil, hydroponics, and tissue culture multiplication. There are three main cultivar groups of cannabis that are cultivated today: fibre, seed, and medicinal/recreational.
Synonyms Top
Scientific name | Authority | First published in |
---|---|---|
Cannabis americana | Pharm. ex Wehmer | Pfl.-Stoffe : 157 (1911) |
Cannabis chinensis | Delile | Index Seminum (MPU, Monspeliensis) 1849: 7 (1849) |
Cannabis erratica | Siev. | Neueste Nord. Beytr. Phys. Geogr. Erd- Völkerbeschreib. 7: 174 (1796) |
Cannabis foetens | Gilib. | Exerc. Phyt. 2: 450. 1792 |
Cannabis generalis | E.H.L.Krause | Deutschl. Fl. Abbild. , ed. 2, 4: 199 (1905) |
Cannabis gigantea | Crevost | Bull. Écon. Indochine , n.s., 19: 613 (1917) |
Cannabis indica | Lam. | Encycl. 1: 695 (1785) |
Cannabis indica f. afghanica | (Vavilov) Vavilov | Agr. Afghanist. 381 1929 |
Cannabis indica var. kafiristanica | Vavilov | Agr. Afghanist. 381 1929 |
Cannabis intersita | Soják | Novit. Bot. Delect. Seminum Horti Bot. Univ. Carol. Prag. 1960: 20 (1960) |
Cannabis kafiristanica | (Vav.) Chrtek | Cas. Nár. Mus., Odd. Prír. 150: 22 (1981) |
Cannabis lupulus | (L.) Scop. | Fl. Carniol. , ed. 2, 2: 263 (1772) |
Cannabis macrosperma | Stokes | Bot. Mat. Med. 4: 539 (1812) |
Cannabis ruderalis | Janisch. | Uchen. Zap. Saratovsk. Gosud. Chernyshevskogo Univ. 2(2): 14 (1924) |
Cannabis sativa f. afghanica | Vavilov | Trudy Prikl. Bot. 16(2): 227. 1926 |
Cannabis sativa f. chinensis | (Delile) A.DC. | Prodr. 16(1): 31 1869 |
Cannabis sativa var. gigantea | (Delile ex Vilm.) Alef. | Landw. Fl. 288 1866 |
Cannabis sativa var. indica | (Lam.) Wehmer | Pfl.-Stoffe : 157 (1911) |
Cannabis sativa subsp. indica | (Lam.) E.Small & Cronquist | Taxon 25: 426 (1976) |
Cannabis sativa subsp. intersita | (Soják) Soják | Cas. Nár. Mus., Odd. Prír. 148: 77 (1979 publ. 1980) |
Cannabis sativa var. kafiristanica | (Vavilov) E.Small & Cronquist | Taxon 25: 429 (1976) |
Cannabis sativa var. kif | A.DC. | Prodr. 16(1): 30 1869 |
Cannabis sativa var. macrosperma | (Stokes) Asch. & Graebn. | Syn. Mitteleur. Fl. 4: 599 1911 |
Cannabis sativa var. monoica | Hol. | Let. Matice Slov. 1(43): 367 1873 |
Cannabis sativa f. pedemontana | A.DC. | Prodr. 16(1): 31 1869 |
Cannabis sativa var. praecox | Serebr. | Trudy Prikl. Bot. 18(1): 410 1928 |
Cannabis sativa var. ruderalis | Janisch. | Uchen. Zap. Saratovsk. Gosud. Chernyshevskogo Univ. 2(2): 14 1924 |
Cannabis sativa var. ruderalis | (Janisch.) S.Z.Liou | Fl. Liaoningica 1: 289 (1988) |
Cannabis sativa var. spontanea | Vavilov | Trudy Prikl. Bot. 13(Suppl. 23): 148 1922 |
Cannabis sativa var. vulgaris | Alef. | Landw. Fl. 288 1866 |
Cannabis intersita | Soják | Novit. Bot. Delect. Seminum Horti Bot. Univ. Carol. Prag. 1960: 20 (1960) |
Cannabis sativa var. indica | (Lam.) E.Small & Cronquist | Taxon 25(4): 426 1976 |
Polygonum viridiflorum | Poir. | Encycl. 6: 140 (1804) |
Common names Top
Add a new one! Suggest a correction!Language | Common/alternative name |
---|---|
English | marijuana |
English | hemp |
English | c. sativa |
English | indian hemp |
Spanish | cannabis |
Spanish | canamon |
Spanish | canamón |
Spanish | cañamon |
Spanish | cánnabis |
Spanish | cannabis medicinal |
Spanish | cánnabis sativa |
Spanish | gañja |
Spanish | mariguana |
Spanish | maryjuana |
Spanish | quif |
ab | Аныцә |
Amharic | እጸ ፋርስ |
Arabic | قنب مزروع |
Arabic | قنب |
Arabic | تيل |
Arabic | عناب |
Azerbaijani | Əkin çətənəsi |
Belarusian | канапель |
Belarusian | канаплі |
Belarusian | канапля |
Belarusian | каноп’е |
Belarusian | пласконне |
Belarusian | Каноплі пасяўныя |
Bulgarian | посевен коноп |
Bengali | গাঁজা |
br | kanab |
Czech | konopí seté |
Czech | marihuana |
Czech | c. sativa |
Danish | marihuana |
Danish | hamp |
Danish | almindelig hamp |
dag | vɔɣu |
German | hanf |
German | cannabis indica |
German | indischer hanf |
German | echter hanf |
Greek | Κάνναβη sativa |
Greek | Κάνναβη η ήμερη (cannabis sativa) |
Estonian | harilik kanep |
Basque | kanabis |
Basque | kannabis |
Basque | kalamu |
ext | marijuana |
Persian | شاهدانه ساتیوا |
Fulah | banngo |
Finnish | hamput |
Finnish | hamppu |
French | chanvre |
French | cannabis |
French | chènevis |
French | amale |
French | gandia |
French | zamal |
French | chanvre cultivé |
frr | manila |
Galician | mariguana |
Hausa | Ƙare aiki |
Hebrew | קנאביס סאטיבה |
Hindi | गाँजे का पौधा |
hno | پنگ |
Croatian | indijska konoplja |
Upper Sorbian | dźiwja konop |
Hungarian | termesztett kender |
Hungarian | közönséges kender |
Armenian | Մշակովի կանեփ |
Indonesian | hennep |
Icelandic | hampjurt |
Italian | indica sativa |
Japanese | カンナビス・サティヴァ |
Japanese | 大麻草 |
Japanese | 麻 |
Japanese | サティバ種 |
Japanese | 大麻 |
Japanese | アサ |
Kabyle | tifert |
Kannada | ಗಾಂಜಾಗಿಡ |
Korean | 대마 |
Korean | 야마 |
Korean | 삼 |
Cornish | kewargh |
li | hemp |
li | hennep |
li | kennep |
li | kemp |
lij | caneva |
Lithuanian | sėjamoji kanapė |
Latvian | sējas kaņepe |
Marathi | गांजा |
Malay | kanabis |
Malay | pokok kanabis |
Malay | pokok marijuana |
Malay | pokok ganja |
Nepali | गाँजा |
new | गजि |
Dutch | hennep |
Dutch | hemp |
Dutch | wietplant |
Dutch | cannabis ruderalis |
Dutch | cannabis indica |
Punjabi | ਭੰਗ |
Polish | konopie dzikie |
Polish | konopie indyjskie |
Polish | konopie przemysłowe |
Polish | pantagruelion |
Polish | cannabis ruderalis |
Polish | cannabis indica |
Polish | konopie siewne |
Punjab | پنگ |
Punjab | بھنگ |
Portuguese | cannabicultura |
Portuguese | banza |
Romanian | canabis |
Romanian | cannabis sativa ssp. indica |
Romanian | marihuana |
Romanian | cânepă indiană |
Russian | Конопля полезная |
Russian | Сатива |
Russian | Конопля обыкновенная |
Russian | конопля посевная |
scn | cànapa |
Sango | bângi |
Slovak | konope |
Slovak | konopa siata |
Slovenian | konoplja |
Slovenian | konopljina semena |
Slovenian | indijska konoplja |
Slovenian | navadna konoplja |
Albanian | kanabis |
Swedish | hampa |
Telugu | గంజాయి |
Telugu | గంజాయి మొక్క |
Thai | ต้นกัญชง |
Thai | กัญชง |
Turkish | esrar otu |
Turkish | kubar |
Turkish | hint keneviri |
udm | Кенэм |
Ukrainian | cannabis sativa var. spontanea |
Ukrainian | коноплі посівні |
Ukrainian | cannabis indica |
Ukrainian | коноплі звичайні |
Walloon | tchedîne |
Walloon | tchene |
xmf | რჩქვანელობური კიფი |
za | daihmaz |
Chinese | 野麻 |
Chinese | 火麻 |
Chinese | 胡麻 |
Chinese | 大麻 |
Chinese | 火麻仁 |
Chinese | 麻根 |
Chinese | 麻叶 |
Chinese | 线麻 |
Chinese | 大麻叶 |
Chinese | 火麻子 |
Chinese | 野大麻 |
Chinese | 麻皮 |
Chinese | 麻花 |
Chinese | 麻费 |
Chinese | 山丝苗 |
Germination/Propagation Top
Suggest a correction or add new data!
No germination or propagation data was added yet.
Distribution (via POWO/KEW) Top
Legend for the distribution data:
- Doubtful data
- Extinct
- Introduced
- Native
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Africa click to expand
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East Tropical Africa
- Kenya
- Tanzania
- Uganda
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Northeast Tropical Africa
- Chad
- Eritrea
- Ethiopia
- Sudan
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Northern Africa
- Algeria
- Morocco
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South Tropical Africa
- Angola
- Malawi
- Mozambique
- Zambia
- Zimbabwe
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Southern Africa
- Botswana
- Cape Provinces
- Free State
- Kwazulu-Natal
- Lesotho
- Northern Provinces
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West Tropical Africa
- Benin
- Gambia
- Ghana
- Guinea
- Senegal
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West-central Tropical Africa
- Cameroon
- Central African Republic
- Gulf Of Guinea Islands
- Rwanda
- Zaïre
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Western Indian Ocean
- Mauritius
- Réunion
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East Tropical Africa
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Asia-temperate click to expand
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Caucasus
- North Caucasus
- Transcaucasus
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China
- China North-central
- China South-central
- China Southeast
- Hainan
- Inner Mongolia
- Tibet
- Xinjiang
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Eastern Asia
- Korea
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Middle Asia
- Kazakhstan
- Kirgizstan
- Tadzhikistan
- Turkmenistan
- Uzbekistan
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Russian Far East
- Amur
- Kamchatka
- Khabarovsk
- Magadan
- Primorye
- Sakhalin
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Siberia
- Altay
- Buryatiya
- Chita
- Irkutsk
- Krasnoyarsk
- Tuva
- West Siberia
- Yakutskiya
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Western Asia
- Afghanistan
- Cyprus
- East Aegean Islands
- Iran
- Iraq
- Lebanon-Syria
- Turkey
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Caucasus
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Asia-tropical click to expand
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Indian Subcontinent
- Assam
- Bangladesh
- East Himalaya
- India
- Nepal
- Pakistan
- West Himalaya
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Indo-China
- Andaman Islands
- Cambodia
- Nicobar Nicobar
- Thailand
- Vietnam
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Malesia
- Jawa
- Lesser Sunda Islands
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Indian Subcontinent
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Australasia click to expand
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New Zealand
- New Zealand North
- New Zealand South
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New Zealand
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Europe click to expand
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Eastern Europe
- Belarus
- Central European Russia
- East European Russia
- Northwest European Russia
- South European Russia
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Middle Europe
- Austria
- Belgium
- Czechoslovakia
- Germany
- Hungary
- Poland
- Switzerland
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Northern Europe
- Denmark
- Finland
- Norway
- Sweden
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Southeastern Europe
- Albania
- Bulgaria
- Greece
- Italy
- Romania
- Sicilia
- Turkey-in-Europe
- Yugoslavia
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Southwestern Europe
- Corse
- France
- Sardegna
- Spain
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Eastern Europe
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Northern America click to expand
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Eastern Canada
- Ontario
- Québec
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Mexico
- Mexico Northwest
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North-central U.S.A.
- Illinois
- Iowa
- Kansas
- Minnesota
- Missouri
- Nebraska
- North Dakota
- Oklahoma
- South Dakota
- Wisconsin
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Northeastern U.S.A.
- Connecticut
- Indiana
- Maine
- Massachusetts
- Michigan
- New Hampshire
- New Jersey
- New York
- Ohio
- Pennsylvania
- Rhode Island
- Vermont
- West Virginia
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Northwestern U.S.A.
- Colorado
- Idaho
- Oregon
- Washington
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South-central U.S.A.
- New Mexico
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Southeastern U.S.A.
- Alabama
- Arkansas
- Delaware
- Kentucky
- Maryland
- Tennessee
- Virginia
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Southwestern U.S.A.
- California
- Nevada
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Eastern Canada
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Pacific click to expand
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North-central Pacific
- Hawaii
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South-central Pacific
- Marquesas
- Society Islands
- Tuamotu
- Tubuai Islands
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Southwestern Pacific
- Fiji
- Vanuatu
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North-central Pacific
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Southern America click to expand
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Caribbean
- Cuba
- Dominican Republic
- Haiti
- Jamaica
- Leeward Islands
- Puerto Rico
- Trinidad-Tobago
- Windward Islands
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Central America
- Costa Rica
- Nicaragua
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Western South America
- Bolivia
- Colombia
- Ecuador
- Peru
-
Caribbean
Links to other databases Top
Suggest others/fix!Database | ID/link to page |
---|---|
World Flora Online | wfo-0000584001 |
UNII | B5ONF538PB |
Florida Plant Atlas | 1838 |
Flora of Alabama | 1355 |
Canadensys | 4191 |
USDA Plants | CASA3 |
Tropicos | 21302042 |
INPN | 87788 |
Flora of Italy | 296 |
KEW | urn:lsid:ipni.org:names:306087-2 |
The Plant List | kew-2696480 |
Open Tree Of Life | 84004 |
Observations.org | 6520 |
NCBI Taxonomy | 3483 |
NBN Atlas | NBNSYS0000004692 |
Nature Serve | 2.131607 |
IPNI | 306087-2 |
iNaturalist | 128773 |
iNaturalist | 75997 |
GBIF | 5361880 |
Freebase | /m/03zbj_ |
WisFlora | 2864 |
EPPO | CNISA |
EOL | 594919 |
Elurikkus | 3369 |
Calflora (Californian flora) | 1471 |
USDA GRIN | 8862 |
Wikipedia | Cannabis_sativa |
CMAUP | NPO7513 |
Genomes (via NCBI) Top
Below is displayed the reference genome only!
If you wish to browse all genomes for this plant click here.
If you wish to browse all genomes for this plant click here.
Accession | Assembly | |||||
---|---|---|---|---|---|---|
Name | Level | Submitter | Released | Coverage | Size | |
GCF_029168945.1 | ASM2916894v1 | Chromosome | Kangwon National University | 2023-03-14 | 299.0x | 734.59 Mb |
Scientific Literature Top
Below are displayed the latest 15 articles published in PMC (PubMed Central®) and other sources (DOI number only)!
If you wish to see all the related articles click here.
If you wish to see all the related articles click here.
Phytochemical Profile Top
Add a new one!
Below are displayed the proven (via scientific papers) natural compounds!
You can also contribute to this by clicking here.
You can also contribute to this by clicking here.
Name | PubChem ID | Canonical SMILES | MW | Found in | Proof |
---|---|---|---|---|---|
> Alkaloids and derivatives | |||||
Isopiperine | 1548913 | Click to see C1CCN(CC1)C(=O)C=CC=CC2=CC3=C(C=C2)OCO3 | 285.34 | unknown | via CMAUP database |
Neurine | 10042 | Click to see C[N+](C)(C)C=C.[OH-] | 103.16 | unknown | via CMAUP database |
Trigonelline | 5570 | Click to see C[N+]1=CC=CC(=C1)C(=O)[O-] | 137.14 | unknown | https://doi.org/10.1021/NP50008A001 |
> Alkaloids and derivatives / Aporphines | |||||
Fetidine | 442233 | Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)OC5=C(C=CC(=C5OC)OC)CC6C7=CC(=C(C=C7CCN6C)OC)OC)O)OC | 682.80 | unknown | via CMAUP database |
> Alkaloids and derivatives / Lupin alkaloids / Sparteine, lupanine, and related alkaloids | |||||
(1S,2S,9S,10R,12S)-12-hydroxy-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-6-one | 12310674 | Click to see C1CC2C3CC(CN2C(=O)C1)C4CC(CCN4C3)O | 264.36 | unknown |
https://doi.org/10.1007/BF01951236 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ https://doi.org/10.1248/CPB.26.3641 https://doi.org/10.1039/P19820001467 https://doi.org/10.1039/P19820001455 https://doi.org/10.1016/J.TET.2011.03.062 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters / o-Hydroxybenzoic acid esters | |||||
Methyl Salicylate | 4133 | Click to see COC(=O)C1=CC=CC=C1O | 152.15 | unknown | https://doi.org/10.1021/NP50008A001 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives | |||||
2,4-Dihydroxy-3-(3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl)-6-pentylbenzoic acid | 4486399 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)O)O)C2C=C(CCC2C(=C)C)C)O | 358.50 | unknown |
https://doi.org/10.1016/J.FEBSLET.2007.05.043 https://doi.org/10.1021/NP8002673 https://doi.org/10.1002/ARDP.19582910804 |
2,4-dihydroxy-3-[[(2R,3S)-3-methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methyl]-6-pentylbenzoic acid | 163195652 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)O)O)CC2C(O2)(C)CCC=C(C)C)O | 376.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
2,4-dihydroxy-3-[[(2S,3S)-3-methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methyl]-6-pentylbenzoic acid | 162915216 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)O)O)CC2C(O2)(C)CCC=C(C)C)O | 376.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
2,4-Dihydroxy-3-[[3-methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methyl]-6-pentylbenzoic acid | 162915215 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)O)O)CC2C(O2)(C)CCC=C(C)C)O | 376.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
3-(3,7-Dimethylocta-2,6-dienyl)-2,4-dihydroxy-6-pentylbenzoic acid | 3082240 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)O)O)CC=C(C)CCC=C(C)C)O | 360.50 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ https://doi.org/10.1016/0031-9422(94)00887-Y https://doi.org/10.1021/NP8002673 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
4-Hydroxybenzoic acid | 135 | Click to see C1=CC(=CC=C1C(=O)O)O | 138.12 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1093/ACPROF:OSO/9780199662685.003.0001 |
Cannabidiolic acid | 160570 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)O)O)C2C=C(CCC2C(=C)C)C)O | 358.50 | unknown |
https://doi.org/10.1016/J.FEBSLET.2007.05.043 https://doi.org/10.1080/10826079508009265 https://doi.org/10.1074/JBC.271.29.17411 https://doi.org/10.1007/S11101-008-9094-4 https://doi.org/10.1021/NP8002673 https://doi.org/10.1021/NP50008A001 https://doi.org/10.1002/ARDP.19582910804 |
Cannabidivarinic Acid | 59444387 | Click to see CCCC1=CC(=C(C(=C1C(=O)O)O)C2C=C(CCC2C(=C)C)C)O | 330.40 | unknown | https://doi.org/10.1021/NP50008A001 |
Cannabigerolic acid | 6449999 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)O)O)CC=C(C)CCC=C(C)C)O | 360.50 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ https://doi.org/10.1021/NP8002673 https://doi.org/10.1080/10826079508009265 https://doi.org/10.1055/S-2008-1075211 https://doi.org/10.1021/NP50008A001 https://doi.org/10.1016/0031-9422(94)00887-Y https://doi.org/10.1007/S11101-008-9094-4 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
Cannabigerovarinic acid | 59444383 | Click to see CCCC1=CC(=C(C(=C1C(=O)O)O)CC=C(C)CCC=C(C)C)O | 332.40 | unknown | https://doi.org/10.1021/NP50008A001 |
Cannabinerolic acid | 9998639 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)O)O)CC=C(C)CCC=C(C)C)O | 360.50 | unknown | https://doi.org/10.1016/0031-9422(94)00887-Y |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives | |||||
Vanillic Acid | 8468 | Click to see COC1=C(C=CC(=C1)C(=O)O)O | 168.15 | unknown | https://doi.org/10.1021/NP50008A001 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / P-methoxybenzoic acids and derivatives | |||||
3-(3,7-Dimethylocta-2,6-dienyl)-2-hydroxy-4-methoxy-6-pentylbenzoic acid | 74316571 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)O)O)CC=C(C)CCC=C(C)C)OC | 374.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
Cannabigerolic acid monomethyl ether | 24739091 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)O)O)CC=C(C)CCC=C(C)C)OC | 374.50 | unknown |
https://doi.org/10.1021/NP50008A001 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Salicylic acid and derivatives | |||||
1H-4-Oxabenzo[f]cyclobut[cd]indene-7-carboxylic acid, 1a,2,3,3a,8b,8c-hexahydro-8-hydroxy-1,1,3a-trimethyl-6-pentyl-; 1a,2,3,3a,8b,8c-Hexahydro-8-hydroxy-1,1,3a-trimethyl-6-pentyl-1H-4-oxabenzo[f]cyclobut[cd]indene-7-carboxylic acid; Cannabicyclolic acid; CBLA | 71437560 | Click to see CCCCCC1=CC2=C(C3C4C(C3(C)C)CCC4(O2)C)C(=C1C(=O)O)O | 358.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Cannabichromenic acid, (+)- | 3084339 | Click to see CCCCCC1=CC2=C(C=CC(O2)(C)CCC=C(C)C)C(=C1C(=O)O)O | 358.50 | unknown |
https://doi.org/10.1016/0031-9422(94)00887-Y https://doi.org/10.1007/S11101-008-9094-4 https://doi.org/10.1021/NP970210Y https://doi.org/10.1016/S0031-9422(00)84939-0 https://doi.org/10.1021/NP50008A001 |
Cannabichromevarinic acid | 11110322 | Click to see CCCC1=CC2=C(C=CC(O2)(C)CCC=C(C)C)C(=C1C(=O)O)O | 330.40 | unknown | https://doi.org/10.1021/NP50008A001 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / p-Hydroxybenzoic acid esters / p-Hydroxybenzoic acid alkyl esters | |||||
Methylparaben | 7456 | Click to see COC(=O)C1=CC=C(C=C1)O | 152.15 | unknown | https://doi.org/10.1093/ACPROF:OSO/9780199662685.003.0001 |
> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives | |||||
4-Ethylbenzaldehyde | 20861 | Click to see CCC1=CC=C(C=C1)C=O | 134.17 | unknown | https://doi.org/10.1021/NP50008A001 |
Benzaldehyde | 240 | Click to see C1=CC=C(C=C1)C=O | 106.12 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzyloxycarbonyls | |||||
(4-Ethylphenyl)methyl acetate | 12732713 | Click to see CCC1=CC=C(C=C1)COC(=O)C | 178.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Benzyl acetate | 8785 | Click to see CC(=O)OCC1=CC=CC=C1 | 150.17 | unknown | https://doi.org/10.1021/NP50008A001 |
> Benzenoids / Benzene and substituted derivatives / Biphenyls and derivatives | |||||
5'-Methyl-4-pentylbiphenyl-2,6,2'-triol | 91488182 | Click to see CCCCCC1=CC(=C(C(=C1)O)C2=C(C=CC(=C2)C)O)O | 286.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
> Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes | |||||
Methyleugenol | 7127 | Click to see COC1=C(C=C(C=C1)CC=C)OC | 178.23 | unknown | https://doi.org/10.1021/NP50008A001 |
> Benzenoids / Benzene and substituted derivatives / Phenethylamines | |||||
Hordenine | 68313 | Click to see CN(C)CCC1=CC=C(C=C1)O | 165.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Phenethylamine | 1001 | Click to see C1=CC=C(C=C1)CCN | 121.18 | unknown | https://doi.org/10.1021/NP50008A001 |
Tyramine | 5610 | Click to see C1=CC(=CC=C1CCN)O | 137.18 | unknown | https://doi.org/10.1021/NP50008A001 |
> Benzenoids / Benzene and substituted derivatives / Phenylacetaldehydes | |||||
Phenylacetaldehyde | 998 | Click to see C1=CC=C(C=C1)CC=O | 120.15 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Phenylpropanes | |||||
2-(4-Methylphenyl)propan-2-ol | 14529 | Click to see CC1=CC=C(C=C1)C(C)(C)O | 150.22 | unknown | https://doi.org/10.1021/NP50008A001 |
2-Methyl-3-phenyl-1-propene | 18687 | Click to see CC(=C)CC1=CC=CC=C1 | 132.20 | unknown | https://doi.org/10.1021/NP50008A001 |
2,4-Di-tert-butylphenol | 7311 | Click to see CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)C | 206.32 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Phenylpropenes | |||||
1-Methyl-4-(prop-1-en-2-yl)benzene | 62385 | Click to see CC1=CC=C(C=C1)C(=C)C | 132.20 | unknown | https://doi.org/10.1021/NP50008A001 |
> Benzenoids / Benzene and substituted derivatives / Styrenes | |||||
5-[2-(4-Hydroxyphenyl)ethenyl]cyclohexa-1,3-diene-1,3-diol | 122177172 | Click to see C1C(C=C(C=C1O)O)C=CC2=CC=C(C=C2)O | 230.26 | unknown | https://doi.org/10.1021/NP50031A011 |
> Benzenoids / Indanes | |||||
(3R)-4-hydroxy-6-methoxyspiro[1,2-dihydroindene-3,4'-cyclohex-2-ene]-1'-one | 10105874 | Click to see COC1=CC2=C(C(=C1)O)C3(CCC(=O)C=C3)CC2 | 244.28 | unknown |
https://doi.org/10.1016/0040-4020(76)80149-4 https://doi.org/10.1039/P19820001467 https://doi.org/10.1021/NP50008A001 |
(3S)-4-hydroxy-6-methoxyspiro[1,2-dihydroindene-3,4'-cyclohex-2-ene]-1'-one | 134714927 | Click to see COC1=CC2=C(C(=C1)O)C3(CCC(=O)C=C3)CC2 | 244.28 | unknown | https://doi.org/10.1248/CPB.26.3641 |
4-Hydroxy-6-methoxyspiro[1,2-dihydroindene-3,4'-cyclohexa-2,5-diene]-1'-one | 90475437 | Click to see COC1=CC2=C(C(=C1)O)C3(CC2)C=CC(=O)C=C3 | 242.27 | unknown |
https://doi.org/10.1039/P19820001467 https://doi.org/10.1016/J.TET.2011.03.062 |
6-Hydroxy-4-methoxyspiro[1,2-dihydroindene-3,4'-cyclohexa-2,5-diene]-1'-one | 101802953 | Click to see COC1=CC(=CC2=C1C3(CC2)C=CC(=O)C=C3)O | 242.27 | unknown | https://doi.org/10.1016/J.TET.2011.03.062 |
Cannabispirenone A | 182364 | Click to see COC1=CC2=C(C(=C1)O)C3(CCC(=O)C=C3)CC2 | 244.28 | unknown |
https://doi.org/10.1016/0040-4020(76)80149-4 https://doi.org/10.1248/CPB.26.3641 https://doi.org/10.1039/P19820001467 |
> Benzenoids / Indanes / Indan-1-spirocyclohexanes | |||||
2',3'-Dihydrospiro[cyclohexane-1,1'-indene]-5',7'-diol | 71333767 | Click to see C1CCC2(CC1)CCC3=C2C(=CC(=C3)O)O | 218.29 | unknown | https://doi.org/10.1016/S0031-9422(00)81194-2 |
4,6-Dimethoxyspiro[1,2-dihydroindene-3,4'-cyclohexane]-1'-one | 11196250 | Click to see COC1=CC2=C(C(=C1)OC)C3(CCC(=O)CC3)CC2 | 260.33 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
5-Hydroxy-7-methoxyindan-1-spiro cyclohexane | 117952695 | Click to see COC1=CC(=CC2=C1C3(CCCCC3)CC2)O | 232.32 | unknown | https://doi.org/10.1016/S0031-9422(00)81194-2 |
7-Hydroxy-5-methoxyindan-1-spiro-cyclohexane | 117952889 | Click to see COC1=CC2=C(C(=C1)O)C3(CCCCC3)CC2 | 232.32 | unknown | https://doi.org/10.1016/S0031-9422(00)81194-2 |
Acetylcannabispirol | 25141336 | Click to see CC(=O)OC1CCC2(CC1)CCC3=C2C(=CC(=C3)OC)O | 290.40 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ https://doi.org/10.1248/CPB.26.3641 https://doi.org/10.1021/NP50008A001 |
Cannabispiran | 162936 | Click to see COC1=CC2=C(C(=C1)O)C3(CCC(=O)CC3)CC2 | 246.30 | unknown |
https://doi.org/10.1016/0040-4020(76)80149-4 https://doi.org/10.1248/CPB.26.3641 https://doi.org/10.1039/P19820001467 https://doi.org/10.1016/J.TET.2011.03.062 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ https://doi.org/10.1021/NP50008A001 https://doi.org/10.1039/C39760000580 |
Cannabispirol | 194174 | Click to see COC1=CC2=C(C(=C1)O)C3(CCC(CC3)O)CC2 | 248.32 | unknown |
https://doi.org/10.1007/BF01951236 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ https://doi.org/10.1039/P19820001467 https://doi.org/10.1248/CPB.26.3641 https://doi.org/10.1055/S-2008-1075211 https://doi.org/10.1021/NP50008A001 https://doi.org/10.1039/P19820001455 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ https://doi.org/10.1016/J.TET.2011.03.062 https://doi.org/10.1055/S-0028-1084474 |
Isocannabispiran | 154496776 | Click to see COC1=CC(=CC2=C1C3(CCC(=O)CC3)CC2)O | 246.30 | unknown | https://doi.org/10.1007/BF01945080 |
> Benzenoids / Naphthalenes | |||||
1,8-Dimethylnaphthalene | 11287 | Click to see CC1=C2C(=CC=CC2=CC=C1)C | 156.22 | unknown | via CMAUP database |
> Benzenoids / Phenanthrenes and derivatives / Hydrophenanthrenes | |||||
4-Hydroxy-2,3,6,7-tetramethoxy-9,10-dihydrophenanthrene | 25172437 | Click to see COC1=C(C=C2C(=C1)CCC3=CC(=C(C(=C32)O)OC)OC)OC | 316.30 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ |
4,5-Dihydroxy-2,3,6-trimethoxy-9,10-dihydrophenanthrene | 25141334 | Click to see COC1=C(C2=C(CCC3=CC(=C(C(=C32)O)OC)OC)C=C1)O | 302.32 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ |
4,7-Dimethoxy-9,10-dihydrophenanthrene-1,2,5-triol | 162975796 | Click to see COC1=CC2=C(C(=C1)O)C3=C(C=C(C(=C3CC2)O)O)OC | 288.29 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ |
Cannithrene 1 | 53438738 | Click to see COC1=CC2=C(C(=C1)O)C3=C(CC2)C=CC(=C3)O | 242.27 | unknown |
https://doi.org/10.1039/P19820001467 https://doi.org/10.1021/NP50008A001 |
Cannithrene 2 | 86021565 | Click to see COC1=C(C2=C(CCC3=C2C(=CC(=C3)OC)O)C=C1)O | 272.29 | unknown |
https://doi.org/10.1039/P19820001467 https://doi.org/10.1039/P19820001455 |
> Benzenoids / Phenol ethers / Anisoles | |||||
Anethole | 637563 | Click to see CC=CC1=CC=C(C=C1)OC | 148.20 | unknown | https://doi.org/10.1021/NP50008A001 |
Anethole, (Z)- | 1549040 | Click to see CC=CC1=CC=C(C=C1)OC | 148.20 | unknown | https://doi.org/10.1021/NP50008A001 |
Anisole | 7519 | Click to see COC1=CC=CC=C1 | 108.14 | unknown | via CMAUP database |
> Benzenoids / Phenols / Benzenediols / Resorcinols | |||||
1,3-Benzenediol, 5-chloro-2-[3-(dichloromethylene)hexyl]- | 11438296 | Click to see CCCC(=C(Cl)Cl)CCC1=C(C=C(C=C1O)Cl)O | 309.60 | unknown | https://doi.org/10.1039/P19820001455 |
2-[[(2R,3S)-3-methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methyl]-5-pentylbenzene-1,3-diol | 163048718 | Click to see CCCCCC1=CC(=C(C(=C1)O)CC2C(O2)(C)CCC=C(C)C)O | 332.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
2-[[(2S,3S)-3-methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methyl]-5-pentylbenzene-1,3-diol | 163048719 | Click to see CCCCCC1=CC(=C(C(=C1)O)CC2C(O2)(C)CCC=C(C)C)O | 332.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
2-[[3-Methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methyl]-5-pentylbenzene-1,3-diol | 163048717 | Click to see CCCCCC1=CC(=C(C(=C1)O)CC2C(O2)(C)CCC=C(C)C)O | 332.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
Olivetol | 10377 | Click to see CCCCCC1=CC(=CC(=C1)O)O | 180.24 | unknown | https://doi.org/10.1016/0006-2952(87)90505-3 |
> Benzenoids / Phenols / Benzenetriols and derivatives / Phloroglucinols and derivatives | |||||
Phloroglucinol | 359 | Click to see C1=C(C=C(C=C1O)O)O | 126.11 | unknown | https://doi.org/10.1016/S0031-9422(00)90352-2 |
> Benzenoids / Phenols / Halophenols / Chlorophenols / M-chlorophenols | |||||
3-Chlorophenol | 7933 | Click to see C1=CC(=CC(=C1)Cl)O | 128.55 | unknown | via CMAUP database |
> Benzenoids / Phenols / Methoxyphenols | |||||
2-Propenamide, 3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-2-[4-[3-[[2-(4-hydroxyphenyl)ethyl]amino]-3-oxo-1-propenyl]-2-methoxyphenoxy]-, (Z,E)- | 78070857 | Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)OC(=CC3=CC(=C(C=C3)O)OC)C(=O)NCCC4=CC=C(C=C4)O | 624.70 | unknown | https://doi.org/10.1016/0031-9422(94)00773-M |
Cannabistilbene II | 6439895 | Click to see COC1=C(C(=C(C=C1)C=CC2CC(=CC(=C2)OC)O)OC)O | 304.34 | unknown | https://doi.org/10.1021/NP50033A008 |
Eugenol | 3314 | Click to see COC1=C(C=CC(=C1)CC=C)O | 164.20 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1271/BBB1924.24.667 |
Isoeugenol | 853433 | Click to see CC=CC1=CC(=C(C=C1)O)OC | 164.20 | unknown | https://doi.org/10.1021/NP50008A001 |
Mequinol | 9015 | Click to see COC1=CC=C(C=C1)O | 124.14 | unknown | via CMAUP database |
N-Trans-feruloyltramine | 5280537 | Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)O | 313.30 | unknown |
https://doi.org/10.1016/S0031-9422(00)98242-6 https://doi.org/10.1016/0091-3057(91)90348-6 |
Vanillin | 1183 | Click to see COC1=C(C=CC(=C1)C=O)O | 152.15 | unknown | via CMAUP database |
> Hydrocarbons / Saturated hydrocarbons | |||||
2-Methylhentriacontane | 14923238 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C | 450.90 | unknown | https://doi.org/10.1021/NP50008A001 |
9-Methyloctacosane | 14275210 | Click to see CCCCCCCCCCCCCCCCCCCC(C)CCCCCCCC | 408.80 | unknown | https://doi.org/10.1021/NP50008A001 |
> Hydrocarbons / Saturated hydrocarbons / Alkanes | |||||
Decane | 15600 | Click to see CCCCCCCCCC | 142.28 | unknown | https://doi.org/10.1021/NP50008A001 |
Docosane | 12405 | Click to see CCCCCCCCCCCCCCCCCCCCCC | 310.60 | unknown | https://doi.org/10.1021/NP50008A001 |
Dodecane | 8182 | Click to see CCCCCCCCCCCC | 170.33 | unknown | https://doi.org/10.1021/NP50008A001 |
Dotriacontane | 11008 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 450.90 | unknown | https://doi.org/10.1021/NP50008A001 |
Eicosane | 8222 | Click to see CCCCCCCCCCCCCCCCCCCC | 282.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Heneicosane | 12403 | Click to see CCCCCCCCCCCCCCCCCCCCC | 296.60 | unknown | https://doi.org/10.1021/NP50008A001 |
Hentriacontane | 12410 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 436.80 | unknown | https://doi.org/10.1021/NP50008A001 |
Heptacosane | 11636 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCC | 380.70 | unknown | https://doi.org/10.1021/NP50008A001 |
Heptadecane | 12398 | Click to see CCCCCCCCCCCCCCCCC | 240.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Heptatriacontane | 23598 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 521.00 | unknown | https://doi.org/10.1021/NP50008A001 |
Hexacosane | 12407 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCC | 366.70 | unknown | https://doi.org/10.1021/NP50008A001 |
Hexadecane | 11006 | Click to see CCCCCCCCCCCCCCCC | 226.44 | unknown | https://doi.org/10.1021/NP50008A001 |
Hexatriacontane | 12412 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 507.00 | unknown | https://doi.org/10.1021/NP50008A001 |
Nonacosane | 12409 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 408.80 | unknown | https://doi.org/10.1021/NP50008A001 |
Nonadecane | 12401 | Click to see CCCCCCCCCCCCCCCCCCC | 268.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Nonane | 8141 | Click to see CCCCCCCCC | 128.25 | unknown | https://doi.org/10.1021/NP50008A001 |
Nonatriacontane | 114842 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 549.10 | unknown | https://doi.org/10.1021/NP50008A001 |
Octacosane | 12408 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCC | 394.80 | unknown | https://doi.org/10.1021/NP50008A001 |
Octadecane | 11635 | Click to see CCCCCCCCCCCCCCCCCC | 254.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Octatriacontane | 23599 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 535.00 | unknown | https://doi.org/10.1021/NP50008A001 |
Pentacosane | 12406 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCC | 352.70 | unknown | https://doi.org/10.1021/NP50008A001 |
Pentadecane | 12391 | Click to see CCCCCCCCCCCCCCC | 212.41 | unknown | https://doi.org/10.1021/NP50008A001 |
Pentatriacontane | 12413 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 492.90 | unknown | https://doi.org/10.1021/NP50008A001 |
Tetracosane | 12592 | Click to see CCCCCCCCCCCCCCCCCCCCCCCC | 338.70 | unknown | https://doi.org/10.1021/NP50008A001 |
Tetradecane | 12389 | Click to see CCCCCCCCCCCCCC | 198.39 | unknown | https://doi.org/10.1021/NP50008A001 |
Tetratriacontane | 26519 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 478.90 | unknown | https://doi.org/10.1021/NP50008A001 |
Triacontane | 12535 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 422.80 | unknown | https://doi.org/10.1021/NP50008A001 |
Tricosane | 12534 | Click to see CCCCCCCCCCCCCCCCCCCCCCC | 324.60 | unknown | https://doi.org/10.1021/NP50008A001 |
Tridecane | 12388 | Click to see CCCCCCCCCCCCC | 184.36 | unknown | https://doi.org/10.1021/NP50008A001 |
Tritriacontane | 12411 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 464.90 | unknown | https://doi.org/10.1021/NP50008A001 |
Undecane | 14257 | Click to see CCCCCCCCCCC | 156.31 | unknown | https://doi.org/10.1021/NP50008A001 |
> Hydrocarbons / Saturated hydrocarbons / Alkanes / Branched alkanes | |||||
2-Methyldotriacontane | 74399 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C | 464.90 | unknown | https://doi.org/10.1021/NP50008A001 |
2-Methylhexacosane | 150931 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCC(C)C | 380.70 | unknown | https://doi.org/10.1021/NP50008A001 |
2-Methyloctacosane | 519147 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C | 408.80 | unknown | https://doi.org/10.1021/NP50008A001 |
2-Methyltetracosane | 527459 | Click to see CCCCCCCCCCCCCCCCCCCCCCC(C)C | 352.70 | unknown | https://doi.org/10.1021/NP50008A001 |
3-Methylheneicosane | 522120 | Click to see CCCCCCCCCCCCCCCCCCC(C)CC | 310.60 | unknown | https://doi.org/10.1021/NP50008A001 |
3-Methylhentriacontane | 521265 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)CC | 450.90 | unknown | https://doi.org/10.1021/NP50008A001 |
3-Methylheptacosane | 85690 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCC(C)CC | 394.80 | unknown | https://doi.org/10.1021/NP50008A001 |
3-Methylpentacosane | 189001 | Click to see CCCCCCCCCCCCCCCCCCCCCCC(C)CC | 366.70 | unknown | https://doi.org/10.1021/NP50008A001 |
3-Methyltricosane | 528561 | Click to see CCCCCCCCCCCCCCCCCCCCC(C)CC | 338.70 | unknown | https://doi.org/10.1021/NP50008A001 |
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons | |||||
gamma-Terpinene | 7461 | Click to see CC1=CCC(=CC1)C(C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lignans, neolignans and related compounds | |||||
(21S)-22-methyl-22-oxido-15,29,31-trioxa-7-aza-22-azoniaoctacyclo[19.9.3.216,19.14,30.110,14.03,8.025,33.028,32]heptatriaconta-1(30),2,4(34),7,10(37),11,13,16,18,25,27,32,35-tridecaene-13,27-diol | 163187449 | Click to see C[N+]1(CCC2=CC(=C3C4=C2C1CC5=CC=C(C=C5)OC6=C(C=CC(=C6)CC7=NCCC8=CC(=C(O4)C=C87)O3)O)O)[O-] | 548.60 | unknown |
https://doi.org/10.1007/S11101-008-9094-4 https://doi.org/10.1021/NP50008A001 |
2,3-bis[(4-hydroxy-3-methoxyphenyl)methylidene]-N,N'-bis[2-(4-hydroxyphenyl)ethyl]butanediamide | 78385686 | Click to see COC1=C(C=CC(=C1)C=C(C(=CC2=CC(=C(C=C2)O)OC)C(=O)NCCC3=CC=C(C=C3)O)C(=O)NCCC4=CC=C(C=C4)O)O | 624.70 | unknown | https://doi.org/10.1016/0031-9422(94)00773-M |
3-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-2-[4-[3-[2-(4-hydroxyphenyl)ethylamino]-3-oxoprop-1-enyl]-2-methoxyphenoxy]propanamide | 76514173 | Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)OC(C(C3=CC(=C(C=C3)O)OC)O)C(=O)NCCC4=CC=C(C=C4)O | 642.70 | unknown | https://doi.org/10.1016/0031-9422(94)00773-M |
Cannabisin E | 71448966 | Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)OC(C(C3=CC(=C(C=C3)O)OC)O)C(=O)NCCC4=CC=C(C=C4)O | 642.70 | unknown | https://doi.org/10.1016/0031-9422(94)00773-M |
Cannabisin G | 10438919 | Click to see COC1=C(C=CC(=C1)C=C(C(=CC2=CC(=C(C=C2)O)OC)C(=O)NCCC3=CC=C(C=C3)O)C(=O)NCCC4=CC=C(C=C4)O)O | 624.70 | unknown | https://doi.org/10.1016/0031-9422(94)00773-M |
> Lignans, neolignans and related compounds / Arylnaphthalene lignans | |||||
Cannabisin A | 15086398 | Click to see C1=CC(=CC=C1CCNC(=O)C2=C(C(=C3C=C(C(=CC3=C2)O)O)C4=CC(=C(C=C4)O)O)C(=O)NCCC5=CC=C(C=C5)O)O | 594.60 | unknown | https://doi.org/10.1016/S0031-9422(00)98242-6 |
> Lignans, neolignans and related compounds / Aryltetralin lignans | |||||
(1R,2S)-1-(3,4-dihydroxyphenyl)-7-hydroxy-2-N,3-N-bis[2-(4-hydroxyphenyl)ethyl]-6-methoxy-1,2-dihydronaphthalene-2,3-dicarboxamide | 101631693 | Click to see COC1=C(C=C2C(C(C(=CC2=C1)C(=O)NCCC3=CC=C(C=C3)O)C(=O)NCCC4=CC=C(C=C4)O)C5=CC(=C(C=C5)O)O)O | 610.70 | unknown | https://doi.org/10.1016/0031-9422(92)83479-I |
1-(3,4-dihydroxyphenyl)-7-hydroxy-2-N,3-N-bis[2-(4-hydroxyphenyl)ethyl]-6-methoxy-1,2-dihydronaphthalene-2,3-dicarboxamide | 78070856 | Click to see COC1=C(C=C2C(C(C(=CC2=C1)C(=O)NCCC3=CC=C(C=C3)O)C(=O)NCCC4=CC=C(C=C4)O)C5=CC(=C(C=C5)O)O)O | 610.70 | unknown | https://doi.org/10.1016/0031-9422(92)83479-I |
7-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-N2,N3-bis(4-hydroxyphenethyl)-6-methoxy-1,2-dihydronaphthalene-2,3-dicarboxamide | 73022545 | Click to see COC1=C(C=CC(=C1)C2C(C(=CC3=CC(=C(C=C23)O)OC)C(=O)NCCC4=CC=C(C=C4)O)C(=O)NCCC5=CC=C(C=C5)O)O | 624.70 | unknown | https://doi.org/10.1016/0031-9422(92)83479-I |
Cannabisin B | 101631692 | Click to see C1=CC(=CC=C1CCNC(=O)C2C(C3=CC(=C(C=C3C=C2C(=O)NCCC4=CC=C(C=C4)O)O)O)C5=CC(=C(C=C5)O)O)O | 596.60 | unknown | https://doi.org/10.1016/0031-9422(92)83479-I |
Cannabisin B | 78070855 | Click to see C1=CC(=CC=C1CCNC(=O)C2C(C3=CC(=C(C=C3C=C2C(=O)NCCC4=CC=C(C=C4)O)O)O)C5=CC(=C(C=C5)O)O)O | 596.60 | unknown | https://doi.org/10.1016/0031-9422(92)83479-I |
Cannabisin D | 44584134 | Click to see COC1=C(C=CC(=C1)C2C(C(=CC3=CC(=C(C=C23)O)OC)C(=O)NCCC4=CC=C(C=C4)O)C(=O)NCCC5=CC=C(C=C5)O)O | 624.70 | unknown | https://doi.org/10.1016/0031-9422(92)83479-I |
Cannabisin-B | 71448963 | Click to see C1=CC(=CC=C1CCNC(=O)C2C(C3=CC(=C(C=C3C=C2C(=O)NCCC4=CC=C(C=C4)O)O)O)C5=CC(=C(C=C5)O)O)O | 596.60 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Eicosanoids / Prostaglandins and related compounds | |||||
Methyl 15-hydroxy-9-oxoprosta-5,10,13-trien-1-oate | 53393996 | Click to see CCCCCC(C=CC1C=CC(=O)C1CC=CCCCC(=O)OC)O | 348.50 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters | |||||
Hexyl butyrate | 17525 | Click to see CCCCCCOC(=O)CCC | 172.26 | unknown | https://doi.org/10.1021/NP50008A001 |
Hexyl hexanoate | 22873 | Click to see CCCCCCOC(=O)CCCCC | 200.32 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters | |||||
Methyl palmitate | 8181 | Click to see CCCCCCCCCCCCCCCC(=O)OC | 270.50 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
(Z)-9,10-dideuteriooctadec-9-enoic acid | 13011408 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 284.50 | unknown | via CMAUP database |
9,10,12,13-Tetrahydroxyoctadecanoic acid | 92800 | Click to see CCCCCC(C(CC(C(CCCCCCCC(=O)O)O)O)O)O | 348.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Arachidic Acid | 10467 | Click to see CCCCCCCCCCCCCCCCCCCC(=O)O | 312.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Arachidonic Acid | 444899 | Click to see CCCCCC=CCC=CCC=CCC=CCCCC(=O)O | 304.50 | unknown | via CMAUP database |
Eicosadienoic acid | 6439848 | Click to see CCCCCC=CCC=CCCCCCCCCCC(=O)O | 308.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Eicosenoic acid, (Z)- | 46234793 | Click to see CCCCCCCCCCCCCCCCCC=CC(=O)O | 310.50 | unknown | via CMAUP database |
Elaidic Acid | 637517 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 282.50 | unknown | via CMAUP database |
Gondoic Acid | 5282768 | Click to see CCCCCCCCC=CCCCCCCCCCC(=O)O | 310.50 | unknown | via CMAUP database |
Icos-2-enoic acid | 3035221 | Click to see CCCCCCCCCCCCCCCCCC=CC(=O)O | 310.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Icosa-2,4-dienoic acid | 54042050 | Click to see CCCCCCCCCCCCCCCC=CC=CC(=O)O | 308.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Myristic Acid | 11005 | Click to see CCCCCCCCCCCCCC(=O)O | 228.37 | unknown | https://doi.org/10.1021/NP50008A001 |
Oleic Acid | 445639 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 282.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Palmitic Acid | 985 | Click to see CCCCCCCCCCCCCCCC(=O)O | 256.42 | unknown | https://doi.org/10.1021/NP50008A001 |
Palmitoleic Acid | 445638 | Click to see CCCCCCC=CCCCCCCCC(=O)O | 254.41 | unknown | https://doi.org/10.1021/NP50008A001 |
Stearic Acid | 5281 | Click to see CCCCCCCCCCCCCCCCCC(=O)O | 284.50 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1093/ACPROF:OSO/9780199662685.003.0001 |
trans-11-Eicosenoic acid | 5282769 | Click to see CCCCCCCCC=CCCCCCCCCCC(=O)O | 310.50 | unknown | https://doi.org/10.1021/NP50008A001 |
trans-2-Icosenoic acid | 6438157 | Click to see CCCCCCCCCCCCCCCCCC=CC(=O)O | 310.50 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids | |||||
Azelaic Acid | 2266 | Click to see C(CCCC(=O)O)CCCC(=O)O | 188.22 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Very long-chain fatty acids | |||||
Behenic Acid | 8215 | Click to see CCCCCCCCCCCCCCCCCCCCCC(=O)O | 340.60 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters | |||||
Octyl hexanoate | 21006 | Click to see CCCCCCCCOC(=O)CCCCC | 228.37 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols | |||||
1-Octanol | 957 | Click to see CCCCCCCCO | 130.23 | unknown | https://doi.org/10.1021/NP50008A001 |
1-Octen-3-OL | 18827 | Click to see CCCCCC(C=C)O | 128.21 | unknown | https://doi.org/10.1021/NP50008A001 |
3-Octanol | 11527 | Click to see CCCCCC(CC)O | 130.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Nonan-1-ol | 8914 | Click to see CCCCCCCCCO | 144.25 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols | |||||
Cetyl Alcohol | 2682 | Click to see CCCCCCCCCCCCCCCCO | 242.44 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty aldehydes | |||||
Tridecanal | 25311 | Click to see CCCCCCCCCCCCC=O | 198.34 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty amides | |||||
Hexadecanamide | 69421 | Click to see CCCCCCCCCCCCCCCC(=O)N | 255.44 | unknown | https://doi.org/10.1111/J.2042-7158.1977.TB11266.X |
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives | |||||
(12S,13E)-12-hydroxyoctadeca-9,13,15-trienoic acid | 162913760 | Click to see CCC=CC=CC(CC=CCCCCCCCC(=O)O)O | 294.40 | unknown | https://doi.org/10.1016/J.TET.2011.03.062 |
(9Z,12S,13E,15Z)-12-hydroxyoctadeca-9,13,15-trienoic acid | 102522407 | Click to see CCC=CC=CC(CC=CCCCCCCCC(=O)O)O | 294.40 | unknown | https://doi.org/10.1016/J.TET.2011.03.062 |
(9Z,12Z,14E,16R)-16-hydroxyoctadeca-9,12,14-trienoic acid | 51533305 | Click to see CCC(C=CC=CCC=CCCCCCCCC(=O)O)O | 294.40 | unknown | https://doi.org/10.1016/J.TET.2011.03.062 |
16-Hydroxy-9,12,14-octadecatrienoic acid | 53922940 | Click to see CCC(C=CC=CCC=CCCCCCCCC(=O)O)O | 294.40 | unknown | https://doi.org/10.1016/J.TET.2011.03.062 |
6,9,12-Octadecatrienoic acid | 3453 | Click to see CCCCCC=CCC=CCC=CCCCCC(=O)O | 278.40 | unknown | via CMAUP database |
gamma-Linolenic acid | 5280933 | Click to see CCCCCC=CCC=CCC=CCCCCC(=O)O | 278.40 | unknown | via CMAUP database |
Linoleic Acid | 5280450 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)O | 280.40 | unknown | https://doi.org/10.1021/NP50008A001 |
Linolenic Acid | 5280934 | Click to see CCC=CCC=CCC=CCCCCCCCC(=O)O | 278.40 | unknown | https://doi.org/10.1021/NP50008A001 |
Methyl linoleate | 5284421 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC | 294.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Octadeca-9,12,15-trienoic acid | 5282822 | Click to see CCC=CCC=CCC=CCCCCCCCC(=O)O | 278.40 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids | |||||
(3R)-5-[(1S,4aS,6R,8aS)-6-bromo-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol | 162959704 | Click to see CC1(C2CCC(=C)C(C2(CCC1Br)C)CCC(C)(C=C)O)C | 369.40 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4885748/ https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ https://doi.org/10.1007/BF02118655 |
7-ethenyl-1,4a,7-trimethyl-3,4,6,8,8a,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid | 14239484 | Click to see CC12CCCC(C1CCC3C2=CCC(C3)(C)C=C)(C)C(=O)O | 302.50 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2866040/ https://doi.org/10.1111/J.2042-7158.1980.TB12838.X |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids | |||||
3,7,11,15-Tetramethyl-2-hexadecen-1-OL | 5366244 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C | 296.50 | unknown | https://doi.org/10.1021/NP50008A001 |
6,10,14-Trimethylpentadeca-5,9,13-trien-2-one | 61206 | Click to see CC(=CCCC(=CCCC(=CCCC(=O)C)C)C)C | 262.40 | unknown | https://doi.org/10.1021/NP50008A001 |
Farnesylacetone | 1711945 | Click to see CC(=CCCC(=CCCC(=CCCC(=O)C)C)C)C | 262.40 | unknown | https://doi.org/10.1021/NP50008A001 |
Phytol | 5280435 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C | 296.50 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids | |||||
beta-CITRONELLOL, (+/-)- | 8842 | Click to see CC(CCC=C(C)C)CCO | 156.26 | unknown | https://doi.org/10.1021/NP50008A001 |
beta-OCIMENE, (3E)- | 5281553 | Click to see CC(=CCC=C(C)C=C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
beta-Ocimene, (3Z)- | 5320250 | Click to see CC(=CCC=C(C)C=C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Geraniol | 637566 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
Geranylacetone | 1549778 | Click to see CC(=CCCC(=CCCC(=O)C)C)C | 194.31 | unknown | https://doi.org/10.1021/NP50008A001 |
Linalool, (+/-)- | 6549 | Click to see CC(=CCCC(C)(C=C)O)C | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
Myrcene | 31253 | Click to see CC(=CCCC(=C)C=C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Neral | 643779 | Click to see CC(=CCCC(=CC=O)C)C | 152.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Nerol | 643820 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids | |||||
(E)-2-(3,7-dimethylocta-2,6-dien-1-yl)-5-pentylbenzene-1,3-diol | 160109 | Click to see CCCCCC1=CC(=C(C(=C1)O)CC=C(C)CCC=C(C)C)O | 316.50 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2866040/ https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3165957/ https://doi.org/10.1021/NP8002673 https://doi.org/10.1111/J.2042-7158.1980.TB12838.X https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ |
[3-(3,7-Dimethylocta-2,6-dienyl)-4,6-dihydroxy-2-pentylphenyl] acetate | 74932475 | Click to see CCCCCC1=C(C(=CC(=C1OC(=O)C)O)O)CC=C(C)CCC=C(C)C | 374.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
1,3-Benzenediol, 2-(3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl)-5-pentyl-, (1R-trans)- | 521372 | Click to see CCCCCC1=CC(=C(C(=C1)O)C2C=C(CCC2C(=C)C)C)O | 314.50 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3165957/ https://doi.org/10.1039/JR9400000649 https://doi.org/10.1021/NP8002673 https://doi.org/10.1111/J.2042-7158.1980.TB12838.X https://doi.org/10.1016/S0040-4039(00)91014-1 https://doi.org/10.1016/0031-9422(77)80023-X |
1,3-Benzenediol, 2-[3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-5-pentyl-, (1R-trans)- | 36688143 | Click to see CCCCCC1=CC(=C(C(=C1)O)C2C=C(CCC2C(=C)C)C)O | 314.50 | unknown | https://doi.org/10.1016/S0040-4039(00)91014-1 |
2-(3-Methyl-6-prop-1-en-2-ylcyclohex-3-en-1-yl)-5-propylbenzene-1,3-diol | 162843120 | Click to see CCCC1=CC(=C(C(=C1)O)C2CC(=CCC2C(=C)C)C)O | 286.40 | unknown | https://doi.org/10.1111/J.2042-7158.1980.TB12838.X |
2-(3,7-Dimethylocta-2,6-dienyl)-3-ethoxy-5-pentylphenol | 163038928 | Click to see CCCCCC1=CC(=C(C(=C1)OCC)CC=C(C)CCC=C(C)C)O | 344.50 | unknown | https://doi.org/10.1111/J.2042-7158.1980.TB12838.X |
2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-3-en-1-yl]-5-propylbenzene-1,3-diol | 139494850 | Click to see CCCC1=CC(=C(C(=C1)O)C2CC(=CCC2C(=C)C)C)O | 286.40 | unknown | https://doi.org/10.1111/J.2042-7158.1980.TB12838.X |
2-[(1S,6S)-6-isopropenyl-3-methyl-1-cyclohex-2-enyl]-5-propyl-benzene-1,3-diol | 91158 | Click to see CCCC1=CC(=C(C(=C1)O)C2C=C(CCC2C(=C)C)C)O | 286.40 | unknown | https://doi.org/10.1111/J.2042-7158.1980.TB12838.X |
2-[(6S)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol | 9966641 | Click to see CCCCCC1=CC(=C(C(=C1)O)C2C=C(CCC2C(=C)C)C)O | 314.50 | unknown | via CMAUP database |
2-carboxy-5-hydroxy-6-[(6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-3-pentylphenolate | 54740359 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)O)[O-])C2C=C(CCC2C(=C)C)C)O | 357.50 | unknown | via CMAUP database |
4-Acetoxy-2-geranyl-5-hydroxy-3-n-pentylphenol | 44139611 | Click to see CCCCCC1=C(C(=CC(=C1OC(=O)C)O)O)CC=C(C)CCC=C(C)C | 374.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
5-Methyl-2-(3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl)benzene-1,3-diol | 20586765 | Click to see CC1=CC(C(CC1)C(=C)C)C2=C(C=C(C=C2O)C)O | 258.35 | unknown | https://doi.org/10.1021/NP50008A001 |
8,9-Dihydrocannabidiol | 11716677 | Click to see CCCCCC1=CC(=C(C(=C1)O)C2C=C(CCC2C(C)C)C)O | 316.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2866040/ |
Cannabidiol | 644019 | Click to see CCCCCC1=CC(=C(C(=C1)O)C2C=C(CCC2C(=C)C)C)O | 314.50 | unknown |
https://doi.org/10.1039/JR9400000649 https://doi.org/10.1248/YAKUSHI1947.118.9_408 https://doi.org/10.1111/J.2042-7158.1980.TB12838.X https://doi.org/10.1002/JPS.2600610139 https://doi.org/10.1520/JFS11698J https://doi.org/10.1021/NP200500P https://doi.org/10.1021/NP8002673 https://doi.org/10.1080/10826079508009265 https://doi.org/10.1021/NP50008A001 https://doi.org/10.1520/JFS14173J https://doi.org/10.1016/0031-9422(77)80023-X https://doi.org/10.1007/S11101-008-9094-4 |
Cannabidiol monomethyl ether | 164905 | Click to see CCCCCC1=CC(=C(C(=C1)OC)C2C=C(CCC2C(=C)C)C)O | 328.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Cannabidivarin | 11601669 | Click to see CCCC1=CC(=C(C(=C1)O)C2C=C(CCC2C(=C)C)C)O | 286.40 | unknown |
https://doi.org/10.1520/JFS14173J https://doi.org/10.1111/J.2042-7158.1980.TB12838.X https://doi.org/10.1021/NP50008A001 |
Cannabielsoic acid A | 59444405 | Click to see CCCCCC1=CC2=C(C3C(CCC(C3O2)(C)O)C(=C)C)C(=C1C(=O)O)O | 374.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Cannabielsoic acid B | 59444401 | Click to see CCCCCC1=CC(=C2C3C(CCC(C3OC2=C1C(=O)O)(C)O)C(=C)C)O | 374.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Cannabielsoin | 162113 | Click to see CCCCCC1=CC(=C2C3C(CCC(C3OC2=C1)(C)O)C(=C)C)O | 330.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Cannabigerol | 5315659 | Click to see CCCCCC1=CC(=C(C(=C1)O)CC=C(C)CCC=C(C)C)O | 316.50 | unknown |
https://doi.org/10.1111/J.2042-7158.1980.TB12838.X https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ https://doi.org/10.1021/NP200500P https://doi.org/10.1021/NP8002673 https://doi.org/10.1080/10826079508009265 https://doi.org/10.1055/S-2008-1075211 https://doi.org/10.1021/NP50008A001 https://doi.org/10.1016/0006-2952(87)90505-3 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2866040/ https://doi.org/10.1007/S11101-008-9094-4 https://doi.org/10.1021/NP50060A004 |
Cannabigerovarin | 59444407 | Click to see CCCC1=CC(=C(C(=C1)O)CC=C(C)CCC=C(C)C)O | 288.40 | unknown | https://doi.org/10.1021/NP50008A001 |
Carvacrol | 10364 | Click to see CC1=C(C=C(C=C1)C(C)C)O | 150.22 | unknown | https://doi.org/10.1021/NP50008A001 |
p-CYMENE | 7463 | Click to see CC1=CC=C(C=C1)C(C)C | 134.22 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1039/JR9420000188 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids | |||||
(1R)-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene | 6451618 | Click to see CC1=CCC2(C1C2)C(C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
(1R)-endo-(+)-Fenchyl alcohol | 6997371 | Click to see CC1(C2CCC(C2)(C1O)C)C | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
(2-Hydroxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl)acetic acid | 3439780 | Click to see CC1(C2CCC1(C(C2)(CC(=O)O)O)C)C | 212.28 | unknown | https://doi.org/10.1021/NP50008A001 |
(3R)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol | 42626428 | Click to see CC(C)C12CC1C(=C)C(C2)O | 152.23 | unknown | https://doi.org/10.1021/NP50008A001 |
1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol | 64685 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
3-Carene | 26049 | Click to see CC1=CCC2C(C1)C2(C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
4,7,7-Trimethylbicyclo[4.1.0]hept-2-ene | 530422 | Click to see CC1CC2C(C2(C)C)C=C1 | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
alpha-Bergamotene, (E)-(-)- | 6429302 | Click to see CC1=CCC2CC1C2(C)CCC=C(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
alpha-PINENE | 6654 | Click to see CC1=CCC2CC1C2(C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
beta-Pinene | 14896 | Click to see CC1(C2CCC(=C)C1C2)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Bicyclo[3.1.0]hex-2-ene, 2-methyl-5-(1-methylethyl)- | 17868 | Click to see CC1=CCC2(C1C2)C(C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Borneol | 6552009 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
Bornyl acetate | 6448 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | https://doi.org/10.1021/NP50008A001 |
Camphene | 6616 | Click to see CC1(C2CCC(C2)C1=C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Camphene hydrate | 101680 | Click to see CC1(C2CCC(C2)C1(C)O)C | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
Camphor | 2537 | Click to see CC1(C2CCC1(C(=O)C2)C)C | 152.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Camphor (synthetic) | 159055 | Click to see CC1(C2CCC1(C(=O)C2)C)C | 152.23 | unknown | via CMAUP database |
Fenchol | 15406 | Click to see CC1(C2CCC(C2)(C1O)C)C | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
Fenchone | 14525 | Click to see CC1(C2CCC(C2)(C1=O)C)C | 152.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Pinocarveol | 102667 | Click to see CC1(C2CC1C(=C)C(C2)O)C | 152.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Pinocarvone | 121719 | Click to see CC1(C2CC1C(=C)C(=O)C2)C | 150.22 | unknown | https://doi.org/10.1021/NP50008A001 |
Sabinen | 18818 | Click to see CC(C)C12CCC(=C)C1C2 | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
trans-Borneol | 44630107 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids | |||||
(+)-Menthol | 165675 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
4-Terpineol, (+/-)- | 11230 | Click to see CC1=CCC(CC1)(C(C)C)O | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
alpha-PHELLANDRENE | 7460 | Click to see CC1=CCC(C=C1)C(C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
alpha-Terpinene | 7462 | Click to see CC1=CC=C(CC1)C(C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Alpha-Terpineol | 17100 | Click to see CC1=CCC(CC1)C(C)(C)O | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
Beta-Phellandrene | 11142 | Click to see CC(C)C1CCC(=C)C=C1 | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
beta-Terpineol | 8748 | Click to see CC(=C)C1CCC(CC1)(C)O | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
Carvone, (-)- | 439570 | Click to see CC1=CCC(CC1=O)C(=C)C | 150.22 | unknown | https://doi.org/10.1055/S-0028-1097617 |
Carvone, (+)- | 16724 | Click to see CC1=CCC(CC1=O)C(=C)C | 150.22 | unknown | https://doi.org/10.1021/NP50008A001 |
Carvone, (+/-)- | 7439 | Click to see CC1=CCC(CC1=O)C(=C)C | 150.22 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1055/S-0028-1097617 |
Dihydrocarvone | 24473 | Click to see CC1CCC(CC1=O)C(=C)C | 152.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Isopulegone | 34645 | Click to see CC1CCC(C(=O)C1)C(=C)C | 152.23 | unknown | https://doi.org/10.1055/S-0028-1097617 |
Limonene, (+/-)- | 22311 | Click to see CC1=CCC(CC1)C(=C)C | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
p-MENTH-8-EN-3-ONE, trans- | 6432305 | Click to see CC1CCC(C(=O)C1)C(=C)C | 152.23 | unknown | https://doi.org/10.1055/S-0028-1097617 |
Piperitenone | 381152 | Click to see CC1=CC(=O)C(=C(C)C)CC1 | 150.22 | unknown | https://doi.org/10.1021/NP50008A001 |
Pulegone | 442495 | Click to see CC1CCC(=C(C)C)C(=O)C1 | 152.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Terpinolene | 11463 | Click to see CC1=CCC(=C(C)C)CC1 | 136.23 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Monocyclic monoterpenoids | |||||
(1S)-3-methyl-1-prop-1-en-2-ylcyclohex-3-en-1-ol | 162972129 | Click to see CC1=CCCC(C1)(C(=C)C)O | 152.23 | unknown | https://doi.org/10.1016/S0040-4039(01)96066-6 |
3-Methyl-1-prop-1-en-2-ylcyclohex-3-en-1-ol | 101409170 | Click to see CC1=CCCC(C1)(C(=C)C)O | 152.23 | unknown | https://doi.org/10.1016/S0040-4039(01)96066-6 |
> Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Prenylated hydroquinones | |||||
[2-(3,7-Dimethylocta-2,6-dienyl)-3,6-dihydroxy-5-pentylphenyl] acetate | 74932477 | Click to see CCCCCC1=CC(=C(C(=C1O)OC(=O)C)CC=C(C)CCC=C(C)C)O | 374.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
2-[(2E)-3,7-Dimethyl-2,6-octadienyl]-3-acetoxy-5-pentylhydroquinone | 44139615 | Click to see CCCCCC1=CC(=C(C(=C1O)OC(=O)C)CC=C(C)CCC=C(C)C)O | 374.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
> Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Prenylquinones | |||||
[2-(3,7-Dimethylocta-2,6-dienyl)-5-hexyl-3,6-dioxocyclohexa-1,4-dien-1-yl] acetate | 162903611 | Click to see CCCCCCC1=CC(=O)C(=C(C1=O)OC(=O)C)CC=C(C)CCC=C(C)C | 386.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ |
> Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Vitamin K compounds | |||||
2-Methyl-3-(3,7,11,15-tetramethylhexadec-2-enyl)-1,4-naphthoquinone | 4812 | Click to see CC1=C(C(=O)C2=CC=CC=C2C1=O)CC=C(C)CCCC(C)CCCC(C)CCCC(C)C | 450.70 | unknown | via CMAUP database |
Phytonadione | 5284607 | Click to see CC1=C(C(=O)C2=CC=CC=C2C1=O)CC=C(C)CCCC(C)CCCC(C)CCCC(C)C | 450.70 | unknown | https://doi.org/10.1021/NP50008A001 |
Vitamin K | 5280483 | Click to see CC1=C(C(=O)C2=CC=CC=C2C1=O)CC=C(C)CCCC(C)CCCC(C)CCCC(C)C | 450.70 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids | |||||
(-)-alpha-Curcumene | 442360 | Click to see CC1=CC=C(C=C1)C(C)CCC=C(C)C | 202.33 | unknown | https://doi.org/10.1021/NP50008A001 |
(-)-beta-Curcumene | 14014430 | Click to see CC1=CCC(=CC1)C(C)CCC=C(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
(+)-delta-Cadinene | 441005 | Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
(+)-gamma-Cadinene | 6432404 | Click to see CC1=CC2C(CC1)C(=C)CCC2C(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
(1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-yl) 1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate | 74336896 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC4(CCC(C5C4CCC(=C5)C)C(C)C)C)O | 562.80 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
(1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-yl) 3-(3,7-dimethylocta-2,6-dienyl)-2,4-dihydroxy-6-pentylbenzoate | 74336924 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)OC2(CCC(C3C2CCC(=C3)C)C(C)C)C)O)CC=C(C)CCC=C(C)C)O | 564.80 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
(1E,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene | 134687947 | Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
(1R,2S,7S,8S)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene | 92042749 | Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
(1S,5R,7S,10R)-4,10-dimethyl-7-propan-2-yltricyclo[4.4.0.01,5]dec-3-ene | 134779875 | Click to see CC1CCC(C2C13C2C(=CC3)C)C(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
(2R)-6-methyl-2-(4-methylcyclohex-3-en-1-yl)hept-5-en-2-ol | 6506009 | Click to see CC1=CCC(CC1)C(C)(CCC=C(C)C)O | 222.37 | unknown | https://doi.org/10.1021/NP50008A001 |
(3E,6E)-12,12,12-trideuterio-3,7-dimethyl-11-(trideuteriomethyl)dodeca-1,3,6,10-tetraene | 10330772 | Click to see CC(=CCCC(=CCC=C(C)C=C)C)C | 210.39 | unknown | via CMAUP database |
(3R,6E)-nerolidol | 11241545 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | https://doi.org/10.1021/NP50008A001 |
(4S)-4-hydroxy-4-[(E,3R)-3-hydroxybut-1-enyl]-3,3,5-trimethylcyclohexan-1-one | 15847407 | Click to see CC1CC(=O)CC(C1(C=CC(C)O)O)(C)C | 226.31 | unknown | https://doi.org/10.1021/NP50008A001 |
(E,Z)-farnesol | 1549109 | Click to see CC(=CCCC(=CCCC(=CCO)C)C)C | 222.37 | unknown | https://doi.org/10.1021/NP50008A001 |
(R)-beta-bisabolene | 68128 | Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C | 204.35 | unknown |
https://doi.org/10.1016/S0021-9673(01)90672-7 https://doi.org/10.1021/NP50008A001 |
1-Ethenyl-1,2-dimethyl-4-propan-2-ylidene-2-prop-1-en-2-ylcyclohexane | 5317024 | Click to see CC(=C1CCC(C(C1)(C)C(=C)C)(C)C=C)C | 218.38 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1016/S0021-9673(01)90672-7 |
1-Methyl-4-(6-methylhept-6-en-2-yl)cyclohexa-1,4-diene | 5316213 | Click to see CC1=CCC(=CC1)C(C)CCCC(=C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
1,4,4-Trimethyl-8-methylenecycloundeca-1,5-diene | 24798692 | Click to see CC1=CCC(C=CCC(=C)CCC1)(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
1,4,8-Cycloundecatriene, 2,6,6,9-tetramethyl-, (1E,4E,8E)- | 23204 | Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C | 204.35 | unknown | https://doi.org/10.1039/JR9420000188 |
1,6-Dimethyl-4-isopropyltetralin | 10224 | Click to see CC1CCC(C2=C1C=CC(=C2)C)C(C)C | 202.33 | unknown | https://doi.org/10.1021/NP50008A001 |
2-Isopropenyl-1-methyl-4-(1-methylethylidene)-1-vinylcyclohexane | 6432312 | Click to see CC(=C1CCC(C(C1)C(=C)C)(C)C=C)C | 204.35 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1016/S0021-9673(01)90672-7 |
2,6,6,9-Tetramethyl-cycloundeca-1,4,8-triene | 6508206 | Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C | 204.35 | unknown | https://doi.org/10.1039/JR9420000188 |
3-[[(3R,3aR,5aR,6R,7R,9aS,9bR)-3-(dimethoxymethyl)-3,3a,6,7,9a-pentamethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-cyclopenta[a]naphthalen-6-yl]methyl]-4-hydroxybenzoic acid | 162953640 | Click to see CC1CCC2(C3CCC(C3(CCC2C1(C)CC4=C(C=CC(=C4)C(=O)O)O)C)(C)C(OC)OC)C | 472.70 | unknown |
https://doi.org/10.1248/YAKUSHI1947.118.9_408 https://doi.org/10.1002/JPS.2600610139 https://doi.org/10.1520/JFS11698J https://doi.org/10.1021/NP200500P https://doi.org/10.1021/NP8002673 https://doi.org/10.1080/10826079508009265 https://doi.org/10.1021/NP50008A001 https://doi.org/10.1520/JFS14173J https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3165957/ |
4-Hydroxy-4-(3-hydroxybut-1-enyl)-3,5,5-trimethylcyclohex-2-en-1-one | 440244 | Click to see CC1=CC(=O)CC(C1(C=CC(C)O)O)(C)C | 224.30 | unknown | https://doi.org/10.1016/S0031-9422(00)94468-6 |
5-Pentyl-2-(3,7,11-trimethyldodeca-2,6,10-trienyl)benzene-1,3-diol | 76165994 | Click to see CCCCCC1=CC(=C(C(=C1)O)CC=C(C)CCC=C(C)CCC=C(C)C)O | 384.60 | unknown | https://doi.org/10.1021/NP200500P |
9-Epiblumenol B | 14135401 | Click to see CC1=CC(=O)CC(C1(CCC(C)O)O)(C)C | 226.31 | unknown | https://doi.org/10.1016/S0031-9422(00)94468-6 |
alpha-Bisabolol | 10586 | Click to see CC1=CCC(CC1)C(C)(CCC=C(C)C)O | 222.37 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1016/S0021-9673(01)90672-7 |
alpha-Cadinyl Cannabigerolate | 24862530 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)OC2(CCC(C3C2CCC(=C3)C)C(C)C)C)O)CC=C(C)CCC=C(C)C)O | 564.80 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
alpha-Cadinyl delta9-Tetrahydrocannabinolate | 24862481 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC4(CCC(C5C4CCC(=C5)C)C(C)C)C)O | 562.80 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
alpha-Cubebene | 442359 | Click to see CC1CCC(C2C13C2C(=CC3)C)C(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
alpha-Curcumene | 92139 | Click to see CC1=CC=C(C=C1)C(C)CCC=C(C)C | 202.33 | unknown | https://doi.org/10.1021/NP50008A001 |
Alpha-Farnesene | 5281516 | Click to see CC(=CCCC(=CCC=C(C)C=C)C)C | 204.35 | unknown | https://doi.org/10.1016/S0021-9673(01)90672-7 |
alpha-Guaiene | 5317844 | Click to see CC1CCC(CC2=C1CCC2C)C(=C)C | 204.35 | unknown | via CMAUP database |
beta Farnesene | 15228937 | Click to see CCC(=C)CCC=C(C)CCC=C(C)C | 206.37 | unknown | https://doi.org/10.1021/NP50008A001 |
beta-Bisabolene | 10104370 | Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C | 204.35 | unknown |
https://doi.org/10.1016/S0021-9673(01)90672-7 https://doi.org/10.1021/NP50008A001 |
beta-CARYOPHYLLENE OXIDE | 1742210 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | https://doi.org/10.1021/NP50008A001 |
beta-Farnesene | 5281517 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | https://doi.org/10.1016/S0021-9673(01)90672-7 |
beta-Farnesene, (6Z)- | 5317319 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
beta-Humulene | 5318102 | Click to see CC1=CCC(C=CCC(=C)CCC1)(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
beta-Ionone | 638014 | Click to see CC1=C(C(CCC1)(C)C)C=CC(=O)C | 192.30 | unknown | https://doi.org/10.1021/NP50008A001 |
blumenol B | 14135402 | Click to see CC1=CC(=O)CC(C1(CCC(C)O)O)(C)C | 226.31 | unknown | https://doi.org/10.1016/S0031-9422(00)94468-6 |
Cadina-1(10),4-diene | 10223 | Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
Calamenene | 6429077 | Click to see CC1CCC(C2=C1C=CC(=C2)C)C(C)C | 202.33 | unknown | https://doi.org/10.1021/NP50008A001 |
Caryophyllene | 5281515 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
Caryophyllene epoxide | 14350 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1016/S0021-9673(01)90672-7 |
CID 16396350 | 16396350 | Click to see CC1(CCCC2(C3C1C(C2=C)CC3)C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
Copaene | 19725 | Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
Corchoionol C | 137705650 | Click to see CC1=CC(=O)CC(C1(C=CC(C)O)O)(C)C | 224.30 | unknown | https://doi.org/10.1021/NP50008A001 |
Epi-beta-Santalene | 11106484 | Click to see CC(=CCCC1(C2CCC(C2)C1=C)C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
Farnesol | 3327 | Click to see CC(=CCCC(=CCCC(=CCO)C)C)C | 222.37 | unknown | https://doi.org/10.1021/NP50008A001 |
gamma-Cadinene | 15094 | Click to see CC1=CC2C(CC1)C(=C)CCC2C(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
Guaiol | 227829 | Click to see CC1CCC(CC2=C1CCC2C)C(C)(C)O | 222.37 | unknown | https://doi.org/10.1021/NP50008A001 |
Humulene | 5281520 | Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C | 204.35 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1016/S0021-9673(01)90672-7 |
Isocaryophyllene | 5281522 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
Isocaryophyllene oxide | 1742211 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
Longifolene | 289151 | Click to see CC1(CCCC2(C3C1C(C2=C)CC3)C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
Nerolidol | 8888 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | https://doi.org/10.1021/NP50008A001 |
Sesquicannabigerol | 54669855 | Click to see CCCCCC1=CC(=C(C(=C1)O)CC=C(C)CCC=C(C)CCC=C(C)C)O | 384.60 | unknown | https://doi.org/10.1021/NP200500P |
Vomifoliol | 5280462 | Click to see CC1=CC(=O)CC(C1(C=CC(C)O)O)(C)C | 224.30 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1016/S0031-9422(00)94468-6 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids | |||||
Alloaromadendren | 91746537 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
alpha-Gurjunene | 15560276 | Click to see CC1CCC2C(C2(C)C)C3=C(CCC13)C | 204.35 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1016/S0021-9673(01)90672-7 |
Ledum camphor | 22297324 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O | 222.37 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Cedrane and isocedrane sesquiterpenoids | |||||
(1S,2R,5S)-2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undec-8-ene | 442348 | Click to see CC1CCC2C13CC=C(C(C3)C2(C)C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
1,7-di-epi-alpha-Cedrene | 10878276 | Click to see CC1CCC2C13CC=C(C(C3)C2(C)C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids | |||||
2-[(2R,8S,8aR)-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-2-yl]prop-2-enoic acid | 14527136 | Click to see CC1CCC=C2C1(CC(CC2)C(=C)C(=O)O)C | 234.33 | unknown | via CMAUP database |
Tessaric acid | 14527134 | Click to see CC1CC(=O)C=C2C1(CC(CC2)C(=C)C(=O)O)C | 248.32 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids | |||||
(2R)-alpha,8-Bismethylene-4aalpha-methyl-7alpha,8aalpha-dihydroxydecalin-2alpha-acetic acid | 102065497 | Click to see CC12CCC(CC1(C(=C)C(CC2)O)O)C(=C)C(=O)O | 266.33 | unknown | via CMAUP database |
2-(4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl)propan-2-yl 1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate | 74336922 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC(C)(C)C4CCC5(CCCC(=C5C4)C)C)O | 562.80 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
2-(4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl)propan-2-yl 3-(3,7-dimethylocta-2,6-dienyl)-2,4-dihydroxy-6-pentylbenzoate | 74336923 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)OC(C)(C)C2CCC3(CCCC(=C3C2)C)C)O)CC=C(C)CCC=C(C)C)O | 564.80 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
2-[(2R,4aR,8R,8aR)-8-hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid | 11876195 | Click to see CC12CCCC(C1CC(CC2)C(=C)C(=O)O)(C)O | 252.35 | unknown | via CMAUP database |
2-[(2R,4aR)-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl]propan-2-yl (6aR,10aR)-1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate | 24862526 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC(C)(C)C4CCC5(CCCC(=C5C4)C)C)O | 562.80 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
2,4-Dihydroxy-3-[(2E)-3,7-dimethyl-2,6-octadienyl]-6-pentylbenzoic acid 1-methyl-1-[(2R)-4aalpha,8-dimethyl-1,2,3,4,4a,5,6,7-octahydronaphthalene-2alpha-yl]ethyl ester | 24862527 | Click to see CCCCCC1=CC(=C(C(=C1C(=O)OC(C)(C)C2CCC3(CCCC(=C3C2)C)C)O)CC=C(C)CCC=C(C)C)O | 564.80 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
3beta,5alpha-Dihydroxycostic acid | 13895638 | Click to see CC12CCC(CC1(C(=C)C(CC2)O)O)C(=C)C(=O)O | 266.33 | unknown | via CMAUP database |
7-epi-alpha-Selinene | 10123 | Click to see CC1=CCCC2(C1CC(CC2)C(=C)C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
alpha-Selinene | 10856614 | Click to see CC1=CCCC2(C1CC(CC2)C(=C)C)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
beta-Selinene | 442393 | Click to see CC(=C)C1CCC2(CCCC(=C)C2C1)C | 204.35 | unknown | https://doi.org/10.1021/NP50008A001 |
gamma-EUDESMOL | 6432005 | Click to see CC1=C2CC(CCC2(CCC1)C)C(C)(C)O | 222.37 | unknown | https://doi.org/10.1021/NP50008A001 |
Pterodonoic acid | 11054003 | Click to see CC1=C2CC(CCC2(CCC1=O)C)C(=C)C(=O)O | 248.32 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones | |||||
2-[(1R,2S,4S,7E,10R,12R,13R,14E,16R)-2,12-dihydroxy-4-[(2S,3R,4E,6E,8E)-3-methoxy-4,8-dimethyl-9-(2-methyl-1,3-oxazol-4-yl)nona-4,6,8-trien-2-yl]-1,13-dimethyl-6-oxo-5,17-dioxabicyclo[14.1.0]heptadeca-7,14-dien-10-yl]acetic acid | 101408704 | Click to see CC1C=CC2C(O2)(C(CC(OC(=O)C=CCC(CC1O)CC(=O)O)C(C)C(C(=CC=CC(=CC3=COC(=N3)C)C)C)OC)O)C | 627.80 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ https://doi.org/10.1248/CPB.26.3641 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Ambrosanolides and secoambrosanolides | |||||
(3aR,5R,8aR,9aS)-6-hydroxy-5,8a-dimethyl-1-methylidene-3a,4,5,8,9,9a-hexahydroazuleno[6,5-b]furan-2,7-dione | 163003102 | Click to see CC1CC2C(CC3(C1=C(C(=O)C3)O)C)C(=C)C(=O)O2 | 262.30 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Guaianolides and derivatives | |||||
(1S,2S,5S,6R,7S,10R,12S,14R)-7-hydroxy-5,14-dimethyl-9-methylidene-3,13-dioxatetracyclo[8.4.0.02,6.012,14]tetradecan-4-one | 163053022 | Click to see CC1C2C(CC(=C)C3CC4C(C3C2OC1=O)(O4)C)O | 264.32 | unknown |
https://doi.org/10.1039/P19820001467 https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
[(3S,8S,10S)-7-hydroxy-17-[(2S,5R)-2-hydroxy-5-(2-hydroxy-2-methylpropyl)oxolan-3-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,12,13,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate | 5322043 | Click to see CC(=O)OC1CCC2(C(C1(C)C)CC(C3(C2=CCC4C3(CCC4C5CC(OC5O)CC(C)(C)O)C)C)O)C | 532.80 | unknown | via CMAUP database |
Epifriedelanol | 119242 | Click to see CC1C(CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)C)C)C)C)O | 428.70 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1055/S-0028-1097617 https://doi.org/10.1093/ACPROF:OSO/9780199662685.003.0001 |
Friedelan-3-one | 244297 | Click to see CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)C)C)C)C | 426.70 | unknown | https://doi.org/10.1055/S-0028-1097617 |
Friedelanol | 101341 | Click to see CC1C(CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)C)C)C)C)O | 428.70 | unknown | https://doi.org/10.1093/ACPROF:OSO/9780199662685.003.0001 |
Friedelin | 91472 | Click to see CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)C)C)C)C | 426.70 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.1093/ACPROF:OSO/9780199662685.003.0001 https://doi.org/10.1055/S-0028-1097617 |
Friedelinol | 348029 | Click to see CC1C(CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)C)C)C)C)O | 428.70 | unknown | https://doi.org/10.1055/S-0028-1097617 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives / Hydroxy bile acids, alcohols and derivatives / Tetrahydroxy bile acids, alcohols and derivatives | |||||
Castasterone | 133534 | Click to see CC(C)C(C)C(C(C(C)C1CCC2C1(CCC3C2CC(=O)C4C3(CC(C(C4)O)O)C)C)O)O | 464.70 | unknown | https://doi.org/10.5650/JOS1996.45.871 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives / Hydroxy bile acids, alcohols and derivatives / Trihydroxy bile acids, alcohols and derivatives | |||||
(3S,5S,8S,9S,10R,13S,17R)-17-[(2S,3R,4R,5S)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one | 23724583 | Click to see CC(C)C(C)C(C(C(C)C1CCC2C1(CCC3C2CC(=O)C4C3(CCC(C4)O)C)C)O)O | 448.70 | unknown |
https://doi.org/10.5650/JOS1996.45.871 https://doi.org/10.5650/JOS1996.46.1499 |
Teasterone | 13475125 | Click to see CC(C)C(C)C(C(C(C)C1CCC2C1(CCC3C2CC(=O)C4C3(CCC(C4)O)C)C)O)O | 448.70 | unknown |
https://doi.org/10.5650/JOS1996.45.871 https://doi.org/10.5650/JOS1996.46.1499 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cholestane steroids / Cholesterols and derivatives | |||||
Cholesterol | 5997 | Click to see CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 386.70 | unknown | https://doi.org/10.5650/JOS1996.46.1499 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives | |||||
(3S,8S,9S,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 134766514 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 400.70 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.5650/JOS1996.46.1499 |
(5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 99565629 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CCC4C3(CC=C(C4)O)C)C | 400.70 | unknown | via CMAUP database |
5-Cholestene-3-ol, 24-methyl- | 312822 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 400.70 | unknown |
https://doi.org/10.5650/JOS1996.46.1499 https://doi.org/10.1021/NP50008A001 |
Campest-4-en-3-one | 11988279 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C | 398.70 | unknown | https://doi.org/10.1021/NP50008A001 |
Campestanol | 119394 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C | 402.70 | unknown | https://doi.org/10.5650/JOS1996.46.1499 |
Ergost-4-en-3-one | 14537344 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C | 398.70 | unknown | https://doi.org/10.5650/JOS1996.47.783 |
Ergosterol | 444679 | Click to see CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C | 396.60 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal alkaloids / Solanidines and derivatives | |||||
(1S,2R,5S,7S,10S,11S,14S,15R,16S,17S,18S,20S,23S)-10,14,16,20-tetramethyl-22-azahexacyclo[12.10.0.02,11.05,10.015,23.017,22]tetracosane-7,18-diol | 15558969 | Click to see CC1CC(C2C(C3C(N2C1)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)O | 415.70 | unknown | https://doi.org/10.1021/NP50008A001 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives | |||||
[(2R,3R,4S,5S,6R)-2-[[(3S,7S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-7-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] hexadecanoate | 163083099 | Click to see CCCCCCCCCCCCCCCC(=O)OC1C(C(C(OC1OC2CCC3(C4CCC5(C(C4C(C=C3C2)O)CCC5C(C)CCC(CC)C(C)C)C)C)CO)O)O | 831.30 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ |
[(2R,3S,4S,5R,6R)-6-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl acetate | 162919488 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)COC(=O)C)O)O)O)C)C)C(C)C | 618.90 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
[2-[[17-(5-ethyl-6-methylheptan-2-yl)-7-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] hexadecanoate | 163083098 | Click to see CCCCCCCCCCCCCCCC(=O)OC1C(C(C(OC1OC2CCC3(C4CCC5(C(C4C(C=C3C2)O)CCC5C(C)CCC(CC)C(C)C)C)C)CO)O)O | 831.30 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ |
[6-[[17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl acetate | 162919487 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)COC(=O)C)O)O)O)C)C)C(C)C | 618.90 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
17-(4-Ethyl-1,5-dimethyl-hex-2-enyl)-10,13,14-trimethyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-cyclopenta[a]phenanthren-3-one | 6479802 | Click to see CCC(C=CC(C)C1CCC2(C1(CCC3C2CCC4=CC(=O)CCC34C)C)C)C(C)C | 424.70 | unknown | via CMAUP database |
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol | 6743 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C | 416.70 | unknown | https://doi.org/10.5650/JOS1996.46.1499 |
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 86821 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C | 414.70 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.5650/JOS1996.46.1499 |
24-Ethylcholest-5-en-3beta-ol | 22012 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C | 414.70 | unknown |
https://doi.org/10.1021/NP50008A001 https://doi.org/10.5650/JOS1996.46.1499 https://doi.org/10.1055/S-0028-1084474 |
3-epi-beta-Sitosterol | 12303645 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C | 414.70 | unknown | via CMAUP database |
Stigmast-4-en-3-one | 5484202 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C | 412.70 | unknown | https://doi.org/10.1021/NP50008A001 |
Stigmastan-3beta-ol | 15559396 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C | 416.70 | unknown | https://doi.org/10.5650/JOS1996.46.1499 |
Stigmasterol | 5280794 | Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C | 412.70 | unknown |
https://doi.org/10.5650/JOS1996.46.1499 https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives | |||||
L-Pyroglutamic acid | 7405 | Click to see C1CC(=O)NC1C(=O)O | 129.11 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alanine and derivatives | |||||
(2S)-2-(phenylazaniumyl)propanoate | 6946449 | Click to see CC(C(=O)[O-])[NH2+]C1=CC=CC=C1 | 165.19 | unknown | https://doi.org/10.1021/NP50008A001 |
Alanine | 5950 | Click to see CC(C(=O)O)N | 89.09 | unknown | https://doi.org/10.1021/NP50008A001 |
D-alanine | 71080 | Click to see CC(C(=O)O)N | 89.09 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids / L-alpha-amino acids | |||||
Arginine | 6322 | Click to see C(CC(C(=O)O)N)CN=C(N)N | 174.20 | unknown | https://doi.org/10.1021/NP50008A001 |
Lysine | 5962 | Click to see C(CCN)CC(C(=O)O)N | 146.19 | unknown | https://doi.org/10.1021/NP50008A001 |
Threonine | 6288 | Click to see CC(C(C(=O)O)N)O | 119.12 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Aspartic acid and derivatives | |||||
Aspartic Acid | 5960 | Click to see C(C(C(=O)O)N)C(=O)O | 133.10 | unknown | https://doi.org/10.1021/NP50008A001 |
D-Aspartic acid | 83887 | Click to see C(C(C(=O)O)N)C(=O)O | 133.10 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Glutamic acid and derivatives | |||||
Glutamic Acid | 33032 | Click to see C(CC(=O)O)C(C(=O)O)N | 147.13 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Histidine and derivatives | |||||
Histidine | 6274 | Click to see C1=C(NC=N1)CC(C(=O)O)N | 155.15 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Isoleucine and derivatives | |||||
l-Isoleucine | 6306 | Click to see CCC(C)C(C(=O)O)N | 131.17 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Leucine and derivatives | |||||
Leucine | 6106 | Click to see CC(C)CC(C(=O)O)N | 131.17 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Methionine and derivatives | |||||
D-Methionine | 84815 | Click to see CSCCC(C(=O)O)N | 149.21 | unknown | https://doi.org/10.1021/NP50008A001 |
Methionine | 6137 | Click to see CSCCC(C(=O)O)N | 149.21 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Phenylalanine and derivatives | |||||
D-phenylalanine | 71567 | Click to see C1=CC=C(C=C1)CC(C(=O)O)N | 165.19 | unknown | https://doi.org/10.1021/NP50008A001 |
Phenylalanine | 6140 | Click to see C1=CC=C(C=C1)CC(C(=O)O)N | 165.19 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Proline and derivatives | |||||
Proline | 145742 | Click to see C1CC(NC1)C(=O)O | 115.13 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Serine and derivatives | |||||
Serine | 5951 | Click to see C(C(C(=O)O)N)O | 105.09 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Tyrosine and derivatives | |||||
Tyrosine | 6057 | Click to see C1=CC(=CC=C1CC(C(=O)O)N)O | 181.19 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Valine and derivatives | |||||
Valine | 6287 | Click to see CC(C)C(C(=O)O)N | 117.15 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Cysteine and derivatives | |||||
D-Cystine | 6857538 | Click to see C(C(C(=O)O)N)SSCC(C(=O)O)N | 240.30 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Cysteine and derivatives / L-cysteine-S-conjugates | |||||
Cystine | 67678 | Click to see C(C(C(=O)O)N)SSCC(C(=O)O)N | 240.30 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters | |||||
Hexyl acetate | 8908 | Click to see CCCCCCOC(=O)C | 144.21 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Dicarboxylic acids and derivatives | |||||
Malonic acid | 867 | Click to see C(C(=O)O)C(=O)O | 104.06 | unknown | https://doi.org/10.1021/NP50008A001 |
Succinic Acid | 1110 | Click to see C(CC(=O)O)C(=O)O | 118.09 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives | |||||
Citric Acid | 311 | Click to see C(C(=O)O)C(CC(=O)O)(C(=O)O)O | 192.12 | unknown | https://doi.org/10.1021/NP50008A001 |
Isocitric acid | 1198 | Click to see C(C(C(C(=O)O)O)C(=O)O)C(=O)O | 192.12 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Hydroxy acids and derivatives / Beta hydroxy acids and derivatives | |||||
Malic Acid | 525 | Click to see C(C(C(=O)O)O)C(=O)O | 134.09 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic acids and derivatives / Organic sulfuric acids and derivatives / Sulfuric acid esters / Sulfuric acid monoesters | |||||
(6-Hydroxy-2-methylheptan-3-yl) hydrogen sulfate | 5319969 | Click to see CC(C)C(CCC(C)O)OS(=O)(=O)O | 226.29 | unknown | via CMAUP database |
> Organic acids and derivatives / Peptidomimetics / Depsipeptides / Cyclic depsipeptides | |||||
N-[17-hydroxy-7,11,14,19-tetramethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]-7,9-dimethyl-1,6-dioxo-4-(9,10,13-trimethyl-2,5,8,11,14,17-hexaoxo-3-propan-2-yl-1,4,7,10,13-pentazabicyclo[13.3.0]octadecan-6-yl)-4,5-dihydro-3H-[1,4]oxazepino[6,5-a]phenoxazine-12-carboxamide | 162816007 | Click to see CC1CC(C2N1C(=O)C(NC(=O)C(C(OC(=O)C(N(C(=O)CN(C2=O)C)C)C(C)C)C)NC(=O)C3=C4C(=C(C=C3)C)OC5=C(C(=O)C6=C(C5=N4)C(=O)OCC(N6)C7C(=O)NC(C(=O)N8CC(=O)CC8C(=O)N(CC(=O)N(C(C(=O)N7)C)C)C)C(C)C)C)C(C)C)O | 1269.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ |
> Organic nitrogen compounds / Organonitrogen compounds / Amines / Alkanolamines / 1,3-aminoalcohols | |||||
(13S,17S)-17-[(1R,2S)-1,2-dihydroxyheptyl]-1,5,10-triazabicyclo[11.4.0]heptadec-15-en-11-one | 159289992 | Click to see CCCCCC(C(C1C=CCC2N1CCCNCCCCNC(=O)C2)O)O | 381.60 | unknown | https://doi.org/10.1016/S0040-4039(00)75003-9 |
> Organic nitrogen compounds / Organonitrogen compounds / Amines / Aralkylamines | |||||
1-Phenylethylamine | 7408 | Click to see CC(C1=CC=CC=C1)N | 121.18 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic nitrogen compounds / Organonitrogen compounds / Amines / Primary amines / 2-arylethylamines | |||||
Histamine | 774 | Click to see C1=C(NC=N1)CCN | 111.15 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic nitrogen compounds / Organonitrogen compounds / Amines / Primary amines / Monoalkylamines | |||||
Cadaverine | 273 | Click to see C(CCN)CCN | 102.18 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic nitrogen compounds / Organonitrogen compounds / Quaternary ammonium salts | |||||
n,n,n-Trimethylethenaminium | 10043 | Click to see C[N+](C)(C)C=C | 86.16 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic nitrogen compounds / Organonitrogen compounds / Quaternary ammonium salts / Cholines | |||||
Choline | 305 | Click to see C[N+](C)(C)CCO | 104.17 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organic oxides | |||||
beta-Cyclocitral | 9895 | Click to see CC1=C(C(CCC1)(C)C)C=O | 152.23 | unknown | https://doi.org/10.1021/NP50008A001 |
Safranal | 61041 | Click to see CC1=C(C(CC=C1)(C)C)C=O | 150.22 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols | |||||
(R)-(-)-2-Butanol | 84682 | Click to see CCC(C)O | 74.12 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols / Cyclohexanols | |||||
(4R)-6-methoxycyclohexane-1,2,3,4,5-pentol | 6708691 | Click to see COC1C(C(C(C(C1O)O)O)O)O | 194.18 | unknown | https://doi.org/10.1021/NP50008A001 |
1D-1-O-Methyl-myo-inositol | 440078 | Click to see COC1C(C(C(C(C1O)O)O)O)O | 194.18 | unknown | https://doi.org/10.1021/NP50008A001 |
Inositol | 892 | Click to see C1(C(C(C(C(C1O)O)O)O)O)O | 180.16 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols | |||||
beta-Caryophyllene alcohol | 61125 | Click to see CC1(CC2C1CCC3(CCCC2(C3)O)C)C | 222.37 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Amino sugars / Acylaminosugars | |||||
N-[(1R,3R,4S,5R,6S)-1,4,5-trihydroxy-3-(hydroxymethyl)-2-oxa-7-azabicyclo[4.1.0]heptan-6-yl]acetamide | 56955950 | Click to see CC(=O)NC12C(C(C(OC1(N2)O)CO)O)O | 234.21 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Cyanogenic glycosides | |||||
Linamarin | 11128 | Click to see CC(C)(C#N)OC1C(C(C(C(O1)CO)O)O)O | 247.24 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds | |||||
Cellobiose | 294 | Click to see C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O | 342.30 | unknown | https://doi.org/10.1021/NP50008A001 |
Gal(a1-4)a-Ido | 131632347 | Click to see C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O | 342.30 | unknown | https://doi.org/10.1021/NP50008A001 |
Sucrose | 5988 | Click to see C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O | 342.30 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides | |||||
D-(-)-Fructose | 5984 | Click to see C(C(C(C(C(=O)CO)O)O)O)O | 180.16 | unknown | https://doi.org/10.1021/NP50008A001 |
D-Fructose | 2723872 | Click to see C1C(C(C(C(O1)(CO)O)O)O)O | 180.16 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Heptoses | |||||
Sedoheptulose | 5459879 | Click to see C(C(C(C(C(C(=O)CO)O)O)O)O)O | 210.18 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Hexoses | |||||
(2R,3R,4S,5S)-2,3,4,5-tetrahydroxyhexanal | 19233 | Click to see CC(C(C(C(C=O)O)O)O)O | 164.16 | unknown | https://doi.org/10.1021/NP50008A001 |
(2R,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanal | 3037556 | Click to see C(C(C(C(C(C=O)O)O)O)O)O | 180.16 | unknown | https://doi.org/10.1021/NP50008A001 |
(2S,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanal | 161658 | Click to see C(C(C(C(C(C=O)O)O)O)O)O | 180.16 | unknown | https://doi.org/10.1021/NP50008A001 |
beta-D-glucose | 64689 | Click to see C(C1C(C(C(C(O1)O)O)O)O)O | 180.16 | unknown | https://doi.org/10.1021/NP50008A001 |
D-Galactosamine | 24154 | Click to see C(C1C(C(C(C(O1)O)N)O)O)O | 179.17 | unknown | https://doi.org/10.1021/NP50008A001 |
D-Galactose | 6036 | Click to see C(C1C(C(C(C(O1)O)O)O)O)O | 180.16 | unknown | https://doi.org/10.1021/NP50008A001 |
D-Glucosamine | 439213 | Click to see C(C1C(C(C(C(O1)O)N)O)O)O | 179.17 | unknown | https://doi.org/10.1021/NP50008A001 |
D-Mannose | 18950 | Click to see C(C1C(C(C(C(O1)O)O)O)O)O | 180.16 | unknown | https://doi.org/10.1021/NP50008A001 |
Grape sugar | 79025 | Click to see C(C1C(C(C(C(O1)O)O)O)O)O | 180.16 | unknown | https://doi.org/10.1021/NP50008A001 |
L-Rhamnose | 25310 | Click to see CC1C(C(C(C(O1)O)O)O)O | 164.16 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Pentoses | |||||
(2R,3R,4R)-2,3,4,5-tetrahydroxypentanal | 5311110 | Click to see C(C(C(C(C=O)O)O)O)O | 150.13 | unknown | https://doi.org/10.1021/NP50008A001 |
(2S,3R,4R)-2,3,4,5-tetrahydroxypentanal | 66308 | Click to see C(C(C(C(C=O)O)O)O)O | 150.13 | unknown | https://doi.org/10.1021/NP50008A001 |
[(4R)-4-hydroxy-5-methyloxolan-2-yl]methyl-trimethylazanium | 6427053 | Click to see CC1C(CC(O1)C[N+](C)(C)C)O | 174.26 | unknown | via CMAUP database |
D-Ribose | 10975657 | Click to see C1C(C(C(C(O1)O)O)O)O | 150.13 | unknown | https://doi.org/10.1021/NP50008A001 |
D-Xylose | 135191 | Click to see C1C(C(C(C(O1)O)O)O)O | 150.13 | unknown | https://doi.org/10.1021/NP50008A001 |
DL-Xylose | 644160 | Click to see C(C(C(C(C=O)O)O)O)O | 150.13 | unknown | https://doi.org/10.1021/NP50008A001 |
L-Arabinose | 439195 | Click to see C1C(C(C(C(O1)O)O)O)O | 150.13 | unknown | https://doi.org/10.1021/NP50008A001 |
Muscarine | 9308 | Click to see CC1C(CC(O1)C[N+](C)(C)C)O | 174.26 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Oligosaccharides | |||||
Raffinose | 439242 | Click to see C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3(C(C(C(O3)CO)O)O)CO)O)O)O)O)O)O)O | 504.40 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives | |||||
D-arabinonic acid | 122045 | Click to see C(C(C(C(C(=O)O)O)O)O)O | 166.13 | unknown | https://doi.org/10.1021/NP50008A001 |
Gluconic Acid | 10690 | Click to see C(C(C(C(C(C(=O)O)O)O)O)O)O | 196.16 | unknown | https://doi.org/10.1021/NP50008A001 |
Glyceric acid | 752 | Click to see C(C(C(=O)O)O)O | 106.08 | unknown | https://doi.org/10.1021/NP50008A001 |
Threonic acid | 151152 | Click to see C(C(C(C(=O)O)O)O)O | 136.10 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives / Glucuronic acid derivatives | |||||
(2S,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoic acid | 84740 | Click to see C(=O)C(C(C(C(C(=O)O)O)O)O)O | 194.14 | unknown | https://doi.org/10.1021/NP50008A001 |
D-Galacturonic Acid | 439215 | Click to see C1(C(C(OC(C1O)O)C(=O)O)O)O | 194.14 | unknown | https://doi.org/10.1021/NP50008A001 |
Glucaric acid | 33037 | Click to see C(C(C(C(=O)O)O)O)(C(C(=O)O)O)O | 210.14 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar alcohols | |||||
D-Arabinitol | 94154 | Click to see C(C(C(C(CO)O)O)O)O | 152.15 | unknown | https://doi.org/10.1021/NP50008A001 |
Erythritol | 222285 | Click to see C(C(C(CO)O)O)O | 122.12 | unknown | https://doi.org/10.1021/NP50008A001 |
Galactitol | 11850 | Click to see C(C(C(C(C(CO)O)O)O)O)O | 182.17 | unknown | https://doi.org/10.1021/NP50008A001 |
Glycerin | 753 | Click to see C(C(CO)O)O | 92.09 | unknown | https://doi.org/10.1021/NP50008A001 |
Hexitol | 453 | Click to see C(C(C(C(C(CO)O)O)O)O)O | 182.17 | unknown | https://doi.org/10.1021/NP50008A001 |
Mannitol | 6251 | Click to see C(C(C(C(C(CO)O)O)O)O)O | 182.17 | unknown | https://doi.org/10.1021/NP50008A001 |
Pentitol | 827 | Click to see C(C(C(C(CO)O)O)O)O | 152.15 | unknown | https://doi.org/10.1021/NP50008A001 |
Sorbitol | 5780 | Click to see C(C(C(C(C(CO)O)O)O)O)O | 182.17 | unknown | https://doi.org/10.1021/NP50008A001 |
Xylitol | 6912 | Click to see C(C(C(C(CO)O)O)O)O | 152.15 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Alpha-hydrogen aldehydes | |||||
Valeraldehyde | 8063 | Click to see CCCCC=O | 86.13 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes | |||||
Decanal | 8175 | Click to see CCCCCCCCCC=O | 156.26 | unknown | https://doi.org/10.1021/NP50008A001 |
Dodecanal | 8194 | Click to see CCCCCCCCCCCC=O | 184.32 | unknown | https://doi.org/10.1021/NP50008A001 |
Heptanal | 8130 | Click to see CCCCCCC=O | 114.19 | unknown | https://doi.org/10.1021/NP50008A001 |
Hexanal | 6184 | Click to see CCCCCC=O | 100.16 | unknown | https://doi.org/10.1021/NP50008A001 |
Nonanal | 31289 | Click to see CCCCCCCCC=O | 142.24 | unknown | https://doi.org/10.1021/NP50008A001 |
Octanal | 454 | Click to see CCCCCCCC=O | 128.21 | unknown | https://doi.org/10.1021/NP50008A001 |
Undecanal | 8186 | Click to see CCCCCCCCCCC=O | 170.29 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones | |||||
3-Decene-5-one | 557934 | Click to see CCCCCC(=O)C=CCC | 154.25 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aryl ketones | |||||
(1R,2S,3R,4S)-3-acetyloxy-11-diazonio-2,4,10-trihydroxy-2-methyl-9-oxo-1-propanoyloxy-3,4-dihydro-1H-benzo[b]fluoren-5-olate | 197352 | Click to see CCC(=O)OC1C2=C(C(C(C1(C)O)OC(=O)C)O)C3=C(C4=CC=CC(=O)C4=C(C3=C2[N+]#N)O)[O-] | 468.40 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ https://doi.org/10.1055/S-0028-1084474 https://doi.org/10.1039/P19820001467 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4885748/ https://doi.org/10.1007/BF02118655 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones | |||||
2-Decanone | 12741 | Click to see CCCCCCCCC(=O)C | 156.26 | unknown | https://doi.org/10.1021/NP50008A001 |
2-Dodecanone | 22556 | Click to see CCCCCCCCCCC(=O)C | 184.32 | unknown | https://doi.org/10.1021/NP50008A001 |
2-Heptanone | 8051 | Click to see CCCCCC(=O)C | 114.19 | unknown | https://doi.org/10.1021/NP50008A001 |
2-Pentadecanone | 61303 | Click to see CCCCCCCCCCCCCC(=O)C | 226.40 | unknown | https://doi.org/10.1021/NP50008A001 |
2-Undecanone | 8163 | Click to see CCCCCCCCCC(=O)C | 170.29 | unknown | https://doi.org/10.1021/NP50008A001 |
3-Octanone | 246728 | Click to see CCCCCC(=O)CC | 128.21 | unknown | https://doi.org/10.1021/NP50008A001 |
6-Methyl-5-hepten-2-one | 9862 | Click to see CC(=CCCC(=O)C)C | 126.20 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones / Beta-hydroxy ketones | |||||
Diacetone Alcohol | 31256 | Click to see CC(=O)CC(C)(C)O | 116.16 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones | |||||
4-Hydroxy-2-methylacetophenone | 70133 | Click to see CC1=C(C=CC(=C1)O)C(=O)C | 150.17 | unknown | via CMAUP database |
Paeonol | 11092 | Click to see CC(=O)C1=C(C=C(C=C1)OC)O | 166.17 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Benzofurans | |||||
4,4,7a-Trimethyl-5,6,7,7a-tetrahydrobenzofuran-2(4H)-one | 27209 | Click to see CC1(CCCC2(C1=CC(=O)O2)C)C | 180.24 | unknown | https://doi.org/10.1021/NP50008A001 |
Dihydroactinidiolide | 6432173 | Click to see CC1(CCCC2(C1=CC(=O)O2)C)C | 180.24 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organoheterocyclic compounds / Benzofurans / Dibenzofurans | |||||
12-Methyl-8-methylidene-3-pentyl-6,16-dioxatetracyclo[11.2.1.05,15.09,14]hexadeca-1(15),2,4,9(14),10,12-hexaene | 53309045 | Click to see CCCCCC1=CC2=C3C(=C1)OCC(=C)C4=C3C(=C(C=C4)C)O2 | 306.40 | unknown | https://doi.org/10.1016/J.TET.2011.03.062 |
Cannabifuran | 9966466 | Click to see CCCCCC1=CC(=C2C(=C1)OC3=C(C=CC(=C23)C(C)C)C)O | 310.40 | unknown | https://doi.org/10.1021/NP50008A001 |
Dehydrocannabifuran | 59444381 | Click to see CCCCCC1=CC(=C2C(=C1)OC3=C(C=CC(=C23)C(=C)C)C)O | 308.40 | unknown |
https://doi.org/10.1055/S-2008-1075211 https://doi.org/10.1021/NP50008A001 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4887452/ https://doi.org/10.1016/S0040-4020(01)91942-8 |
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans | |||||
(2R,3R)-2-methyl-2-(4-methylpent-3-enyl)-7-pentyl-3,4-dihydrochromene-3,5-diol | 154495909 | Click to see CCCCCC1=CC(=C2CC(C(OC2=C1)(C)CCC=C(C)C)O)O | 332.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
(2R)-2-[(3R)-3-hydroxy-4-methylpent-4-enyl]-2-methyl-7-pentylchromen-5-ol | 162848327 | Click to see CCCCCC1=CC(=C2C=CC(OC2=C1)(C)CCC(C(=C)C)O)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
(2R)-2-methyl-2-(4-methylpent-3-enyl)-7-pentyl-3,4-dihydrochromen-5-ol | 162940350 | Click to see CCCCCC1=CC(=C2CCC(OC2=C1)(C)CCC=C(C)C)O | 316.50 | unknown | https://doi.org/10.1111/J.2042-7158.1980.TB12838.X |
(2R)-2-methyl-2-(4-methylpent-3-enyl)-7-pentylchromen-5-ol | 76971722 | Click to see CCCCCC1=CC(=C2C=CC(OC2=C1)(C)CCC=C(C)C)O | 314.50 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2866040/ https://doi.org/10.1007/BF01926461 |
(2R)-2-methyl-2-(4-methylpent-3-enyl)-7-propylchromen-5-ol | 154929891 | Click to see CCCC1=CC(=C2C=CC(OC2=C1)(C)CCC=C(C)C)O | 286.40 | unknown | https://doi.org/10.1007/BF01926461 |
(2S,3R)-2-methyl-2-(4-methylpent-3-enyl)-7-pentyl-3,4-dihydrochromene-3,5-diol | 162952386 | Click to see CCCCCC1=CC(=C2CC(C(OC2=C1)(C)CCC=C(C)C)O)O | 332.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
(5R)-6,6-dimethyl-5-(3-oxobutyl)-10-pentyl-2,7-dioxatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraene-11-carboxylic acid | 44139614 | Click to see CCCCCC1=CC2=C3C(=COC3=C1C(=O)O)C(C(O2)(C)C)CCC(=O)C | 372.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
(S)-2-Methyl-2-(4-methyl-3-pentenyl)-7-pentyl-2H-1-benzopyran-5-ol | 21668219 | Click to see CCCCCC1=CC(=C2C=CC(OC2=C1)(C)CCC=C(C)C)O | 314.50 | unknown | via CMAUP database |
[(2R)-5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7-pentylchromen-8-yl] acetate | 162952316 | Click to see CCCCCC1=CC(=C2C=CC(OC2=C1OC(=O)C)(C)CCC=C(C)C)O | 372.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
2-Methyl-2-(3-hydroxy-4-methyl-4-pentenyl)-7-pentyl-2H-1-benzopyran-5-ol | 44139613 | Click to see CCCCCC1=CC(=C2C=CC(OC2=C1)(C)CCC(C(=C)C)O)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
2-Methyl-2-(4-methyl-3-pentenyl)-7-pentyl-8-acetoxy-2H-1-benzopyran-5-ol | 44139609 | Click to see CCCCCC1=CC(=C2C=CC(OC2=C1OC(=O)C)(C)CCC=C(C)C)O | 372.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
2-Methyl-2-(4-methylpent-3-enyl)-7-pentyl-3,4-dihydrochromen-5-ol | 9966705 | Click to see CCCCCC1=CC(=C2CCC(OC2=C1)(C)CCC=C(C)C)O | 316.50 | unknown | https://doi.org/10.1111/J.2042-7158.1980.TB12838.X |
2-Methyl-2-(4-methylpent-3-enyl)-7-pentyl-3,4-dihydrochromene-3,5-diol | 44139610 | Click to see CCCCCC1=CC(=C2CC(C(OC2=C1)(C)CCC=C(C)C)O)O | 332.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
6,6-Dimethyl-5-(3-oxobutyl)-10-pentyl-2,7-dioxatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraene-11-carboxylic acid | 74932476 | Click to see CCCCCC1=CC2=C3C(=COC3=C1C(=O)O)C(C(O2)(C)C)CCC(=O)C | 372.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
Cannabichromenate | 54740355 | Click to see CCCCCC1=CC2=C(C=CC(O2)(C)CCC=C(C)C)C(=C1C(=O)O)[O-] | 357.50 | unknown | via CMAUP database |
Cannabichromene | 30219 | Click to see CCCCCC1=CC(=C2C=CC(OC2=C1)(C)CCC=C(C)C)O | 314.50 | unknown |
https://doi.org/10.1248/YAKUSHI1947.118.9_408 https://doi.org/10.1520/JFS11698J https://doi.org/10.1080/10826079508009265 https://doi.org/10.1021/NP50008A001 https://doi.org/10.1520/JFS14173J https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2866040/ https://doi.org/10.1007/BF01926461 https://doi.org/10.1007/S11101-008-9094-4 https://doi.org/10.1021/NP50060A004 |
Cannabichromevarin | 6451726 | Click to see CCCC1=CC(=C2C=CC(OC2=C1)(C)CCC=C(C)C)O | 286.40 | unknown |
https://doi.org/10.1007/BF01926461 https://doi.org/10.1021/NP50008A001 |
Cannabicoumaronone | 625303 | Click to see CCCCCC1=CC2=C3C(=C1)OC(C(C3=CO2)CCC(=O)C)(C)C | 328.40 | unknown | https://doi.org/10.1021/NP50008A001 |
Cannabicyclol | 30607 | Click to see CCCCCC1=CC(=C2C3C4C(C3(C)C)CCC4(OC2=C1)C)O | 314.50 | unknown |
https://doi.org/10.1520/JFS14173J https://doi.org/10.1021/NP50008A001 |
Cannabiglendol | 156998 | Click to see CCCC1=CC(=C2C3CC(CCC3C(C)(C)O)(OC2=C1)C)O | 304.40 | unknown | https://doi.org/10.1021/NP50013A005 |
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / 2,2-dimethyl-1-benzopyrans | |||||
(1,3,3-Trimethyl-2-bicyclo[2.2.1]heptanyl) 1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate | 74336892 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC4C(C5CCC4(C5)C)(C)C)O | 494.70 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl) 1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate | 74336893 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC4CC5CCC4(C5(C)C)C)O | 494.70 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
(1R,10R,13R,15S)-9,9,13-trimethyl-5-pentyl-8,14-dioxatetracyclo[8.5.0.02,7.013,15]pentadeca-2,4,6-trien-3-ol | 122180087 | Click to see CCCCCC1=CC(=C2C3C(CCC4(C3O4)C)C(OC2=C1)(C)C)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
(1S,10S,13R,15S)-9,9,13-trimethyl-5-pentyl-8,14-dioxatetracyclo[8.5.0.02,7.013,15]pentadeca-2,4,6-trien-3-ol | 163190002 | Click to see CCCCCC1=CC(=C2C3C(CCC4(C3O4)C)C(OC2=C1)(C)C)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
(1S,10Z)-2,2,10-trimethyl-6-pentyl-3,9-dioxatricyclo[6.5.2.04,15]pentadeca-4,6,8(15),10-tetraen-14-one | 25105401 | Click to see CCCCCC1=CC2=C3C(=C1)OC(C(C3=O)CCC=C(O2)C)(C)C | 328.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2763336/ |
(3S)-5-hydroxy-3-[(1R)-1-hydroxy-4-oxopentyl]-2,2-dimethyl-7-pentyl-3H-chromen-4-one | 25105341 | Click to see CCCCCC1=CC(=C2C(=C1)OC(C(C2=O)C(CCC(=O)C)O)(C)C)O | 362.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2763336/ |
(4-Methyl-1-propan-2-ylcyclohex-3-en-1-yl) 1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate | 74336895 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC4(CCC(=CC4)C)C(C)C)O | 494.70 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
(6aR,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-1,2-diol | 162953051 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1O)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
(6aR,10aR)-9-(acetyloxymethyl)-1-hydroxy-6,6-dimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylic acid | 122180088 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)COC(=O)C)C(=C1C(=O)O)O | 416.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
(6aR,10R,10aR)-6,6-dimethyl-9-methylidene-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromene-1,10-diol | 122180086 | Click to see CCCCCC1=CC(=C2C3C(CCC(=C)C3O)C(OC2=C1)(C)C)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
(6aR,10R,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-1,10-diol | 102506267 | Click to see CCCCCC1=CC(=C2C3C(CC=C(C3O)C)C(OC2=C1)(C)C)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
(6aR,10S,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-1,10-diol | 102506268 | Click to see CCCCCC1=CC(=C2C3C(CC=C(C3O)C)C(OC2=C1)(C)C)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
(6aS,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-1,10-diol | 163186274 | Click to see CCCCCC1=CC(=C2C3C(CCC(=C3O)C)C(OC2=C1)(C)C)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
(6aS,10aS)-9-(acetyloxymethyl)-1-hydroxy-6,6-dimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylic acid | 163097650 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)COC(=O)C)C(=C1C(=O)O)O | 416.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
(6aS,10R,10aS)-6,6-dimethyl-9-methylidene-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromene-1,10-diol | 163190825 | Click to see CCCCCC1=CC(=C2C3C(CCC(=C)C3O)C(OC2=C1)(C)C)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
(6aS,8R,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-1,8-diol | 131707153 | Click to see CCCCCC1=CC(=C2C3C=C(C(CC3C(OC2=C1)(C)C)O)C)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
(6aS,9S,10S,10aS)-6,6,9-trimethyl-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromene-1,9,10-triol | 163187721 | Click to see CCCCCC1=CC(=C2C3C(CCC(C3O)(C)O)C(OC2=C1)(C)C)O | 348.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
[(1R,2S,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] (6aR,10aR)-1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate | 24862528 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC4CC5CCC4(C5(C)C)C)O | 494.70 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
[(1R,2S,4S)-1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl] (6aR,10aR)-1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate | 162906422 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC4C(C5CCC4(C5)C)(C)C)O | 494.70 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
[(1R)-4-methyl-1-propan-2-ylcyclohex-3-en-1-yl] (6aR,10aR)-1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate | 162889905 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC4(CCC(=CC4)C)C(C)C)O | 494.70 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
2-(4-Methylcyclohex-3-en-1-yl)propan-2-yl 1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate | 74336894 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC(C)(C)C4CCC(=CC4)C)O | 494.70 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
2-[(1S)-4-methylcyclohex-3-en-1-yl]propan-2-yl (6aR,10aR)-1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate | 162927868 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC(C)(C)C4CCC(=CC4)C)O | 494.70 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
2,2,10-Trimethyl-6-pentyl-3,9-dioxatricyclo[6.5.2.04,15]pentadeca-4,6,8(15),10-tetraen-14-one | 163078175 | Click to see CCCCCC1=CC2=C3C(=C1)OC(C(C3=O)CCC=C(O2)C)(C)C | 328.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2763336/ |
5-(5-hydroxy-2,2-dimethyl-4-oxo-7-pentyl-3H-chromen-3-yl)pentane-2,3-dione | 162885222 | Click to see CCCCCC1=CC(=C2C(=C1)OC(C(C2=O)CCC(=O)C(=O)C)(C)C)O | 360.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2763336/ |
5-[(3R)-5-hydroxy-2,2-dimethyl-4-oxo-7-pentyl-3H-chromen-3-yl]pentane-2,3-dione | 25105342 | Click to see CCCCCC1=CC(=C2C(=C1)OC(C(C2=O)CCC(=O)C(=O)C)(C)C)O | 360.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2763336/ |
5-hydroxy-3-(1-hydroxy-4-oxopentyl)-2,2-dimethyl-7-pentyl-3H-chromen-4-one | 162874467 | Click to see CCCCCC1=CC(=C2C(=C1)OC(C(C2=O)C(CCC(=O)C)O)(C)C)O | 362.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2763336/ |
6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-ol | 2978 | Click to see CCCCCC1=CC(=C2C3C=C(CCC3C(OC2=C1)(C)C)C)O | 314.50 | unknown |
https://doi.org/10.1111/J.2042-7158.1980.TB12838.X https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3154755/ https://doi.org/10.1021/NP8002673 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2866040/ https://doi.org/10.1021/JA01253A008 https://doi.org/10.1111/J.1360-0443.2012.03928.X https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1952348/ https://doi.org/10.1002/HUP.1196 https://doi.org/10.1074/JBC.M403693200 |
6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-1,2-diol | 162953050 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1O)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
6a,7,8,9,10,10a-Hexahydro-6,6,9-trimethyl-3-pentyl-1,9-epoxy-6H-dibenzo[b,d]pyran | 59444393 | Click to see CCCCCC1=CC2=C3C4CC(CCC4C(O2)(C)C)(OC3=C1)C | 314.50 | unknown | https://doi.org/10.1021/NP50008A001 |
8-Hydroxy-delta(9)-tetrahydrocannabinol | 169652 | Click to see CCCCCC1=CC(=C2C3C=C(C(CC3C(OC2=C1)(C)C)O)C)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
8alpha-OH-delta9-THC | 23620581 | Click to see CCCCCC1=CC(=C2C3C=C(C(CC3C(OC2=C1)(C)C)O)C)O | 330.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ |
Ajulemic acid | 3083542 | Click to see CCCCCCC(C)(C)C1=CC(=C2C3CC(=CCC3C(OC2=C1)(C)C)C(=O)O)O | 400.50 | unknown | https://doi.org/10.1016/J.LFS.2004.04.010 |
alpha-Fenchyl delta9-Tetrahydrocannabinolate | 24862529 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)OC4C(C5CCC4(C5)C)(C)C)O | 494.70 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
Cannabichromanon | 25105340 | Click to see CCCCCC1=CC(=C2C(=C1)OC(C(C2=O)CCC(=O)C)(C)C)O | 332.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2763336/ |
Cannabichromanone | 186690 | Click to see CCCCCC1=CC(=C2C(=C1)OC(C(C2=O)CCC(=O)C)(C)C)O | 332.40 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2763336/ https://doi.org/10.1021/NP50008A001 |
Cannabiripsol | 192007 | Click to see CCCCCC1=CC(=C2C3C(CCC(C3O)(C)O)C(OC2=C1)(C)C)O | 348.50 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4880513/ https://doi.org/10.1021/NP50008A001 |
Cannabitriol | 11551959 | Click to see CCCCCC1=CC(=C2C(=C1)OC(C3=C2C(C(CC3)(C)O)O)(C)C)O | 346.50 | unknown | https://doi.org/10.1021/NP50008A001 |
delta-9-Tetrahydrocannabinoic acid a | 620758 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)O)O | 358.50 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ https://doi.org/10.1021/NP8002673 |
delta5-Tetrahydrocannabinol, (1S,3R,4R)- | 10313569 | Click to see CCCCCC1=CC(=C2C3CC(C=CC3C(OC2=C1)(C)C)C)O | 314.50 | unknown | via CMAUP database |
DELTA8-Tetrahydrocannabinol | 638026 | Click to see CCCCCC1=CC(=C2C3CC(=CCC3C(OC2=C1)(C)C)C)O | 314.50 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2866040/ https://doi.org/10.1111/J.2042-7158.1980.TB12838.X |
delta9-TETRAHYDROCANNABINOIC ACID B | 46889976 | Click to see CCCCCC1=CC(=C2C3C=C(CCC3C(OC2=C1C(=O)O)(C)C)C)O | 358.50 | unknown | https://doi.org/10.1007/S11101-008-9094-4 |
delta9-Tetrahydrocannabinolic acid | 98523 | Click to see CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1C(=O)O)O | 358.50 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ https://doi.org/10.1007/S11101-008-9094-4 https://doi.org/10.1021/NP8002673 |
Dronabinol | 16078 | Click to see CCCCCC1=CC(=C2C3C=C(CCC3C(OC2=C1)(C)C)C)O | 314.50 | unknown |
https://doi.org/10.1016/B978-0-12-013320-8.50007-1 https://doi.org/10.1248/YAKUSHI1947.118.9_408 https://doi.org/10.1007/BF02907934 https://doi.org/10.1111/J.2042-7158.1980.TB12838.X https://doi.org/10.1002/JPS.2600610139 https://doi.org/10.1520/JFS11698J https://doi.org/10.1021/NP200500P https://doi.org/10.2307/2446007 https://doi.org/10.1021/NP8002673 https://doi.org/10.1080/10826079508009265 https://doi.org/10.1021/NP50008A001 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2866040/ https://doi.org/10.1021/JA01253A008 https://doi.org/10.1248/CPB.48.743 https://doi.org/10.1007/S11101-008-9094-4 https://doi.org/10.1021/NP50060A004 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
Tetrahydrocannabivarin | 93147 | Click to see CCCC1=CC(=C2C3C=C(CCC3C(OC2=C1)(C)C)C)O | 286.40 | unknown | https://doi.org/10.1520/JFS14173J |
Tetrahydrocannabivarol | 34180 | Click to see CCCC1=CC(=C2C3C=C(CCC3C(OC2=C1)(C)C)C)O | 286.40 | unknown | https://doi.org/10.1007/S11101-008-9094-4 |
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Dibenzopyrans | |||||
[(1R)-4-methyl-1-propan-2-ylcyclohex-3-en-1-yl] 1-hydroxy-6,6,9-trimethyl-3-pentylbenzo[c]chromene-2-carboxylate | 162847257 | Click to see CCCCCC1=CC2=C(C3=C(C=CC(=C3)C)C(O2)(C)C)C(=C1C(=O)OC4(CCC(=CC4)C)C(C)C)O | 490.70 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
4-Terpenyl Cannabinolate | 24850050 | Click to see CCCCCC1=CC2=C(C3=C(C=CC(=C3)C)C(O2)(C)C)C(=C1C(=O)OC4(CCC(=CC4)C)C(C)C)O | 490.70 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ |
6,6-Dimethyl-3-propylbenzo[c]chromen-1-ol | 138478339 | Click to see CCCC1=CC(=C2C3=CC=CC=C3C(OC2=C1)(C)C)O | 268.30 | unknown | https://doi.org/10.1111/J.2042-7158.1980.TB12838.X |
8-Hydroxycannabinol | 44241652 | Click to see CCCCCC1=CC(=C2C(=C1)OC(C3=C2C=C(C(=C3)O)C)(C)C)O | 326.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
8-hydroxycannabinolic acid A | 44139742 | Click to see CCCCCC1=CC2=C(C3=C(C=C(C(=C3)C)O)C(O2)(C)C)C(=C1C(=O)O)O | 370.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
Cannabinol | 2543 | Click to see CCCCCC1=CC(=C2C(=C1)OC(C3=C2C=C(C=C3)C)(C)C)O | 310.40 | unknown |
https://doi.org/10.1248/YAKUSHI1947.118.9_408 https://doi.org/10.1111/J.2042-7158.1980.TB12838.X https://doi.org/10.1002/JPS.2600610139 https://doi.org/10.1520/JFS11698J https://doi.org/10.1039/JR9310000630 https://doi.org/10.1080/10826079508009265 https://doi.org/10.1021/NP50008A001 https://doi.org/10.1520/JFS14173J https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2866040/ https://doi.org/10.1007/S11101-008-9094-4 |
Cannabinol methylether | 628150 | Click to see CCCCCC1=CC2=C(C(=C1)OC)C3=C(C=CC(=C3)C)C(O2)(C)C | 324.50 | unknown | https://doi.org/10.1021/NP50008A001 |
Cannabinolic acid | 3081990 | Click to see CCCCCC1=CC2=C(C3=C(C=CC(=C3)C)C(O2)(C)C)C(=C1C(=O)O)O | 354.40 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4883103/ https://doi.org/10.1007/S11101-008-9094-4 https://doi.org/10.1021/NP50008A001 |
Cannabiorcol | 59444404 | Click to see CC1=CC2=C(C=C1)C(OC3=CC(=CC(=C32)O)C)(C)C | 254.32 | unknown | https://doi.org/10.1021/NP50008A001 |
Cannabivarin | 622545 | Click to see CCCC1=CC(=C2C(=C1)OC(C3=C2C=C(C=C3)C)(C)C)O | 282.40 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organoheterocyclic compounds / Benzopyrans / 2-benzopyrans | |||||
3R,4S-3,8-dimethoxy-3-methylisochromane-4,6-diol | 146684159 | Click to see CC1(C(C2=C(CO1)C(=CC(=C2)O)OC)O)OC | 240.25 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ |
6,6,9-Trimethyl-3-pentyl-1,2,3,4-tetrahydrobenzo[c]chromen-1-ol | 521727 | Click to see CCCCCC1CC(C2=C(C1)OC(C3=C2C=C(C=C3)C)(C)C)O | 314.50 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Coumarans | |||||
2,3-Dihydrobenzofuran | 10329 | Click to see C1COC2=CC=CC=C21 | 120.15 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Epoxides | |||||
(4E,7E)-1,5,9,9-Tetramethyl-12-oxabicyclo[9.1.0]dodeca-4,7-diene | 22559443 | Click to see CC1=CCCC2(C(O2)CC(C=CC1)(C)C)C | 220.35 | unknown | https://doi.org/10.1021/NP50008A001 |
1,5,5,8-Tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene | 23274265 | Click to see CC1=CCC(C=CCC2(C(O2)CC1)C)(C)C | 220.35 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organoheterocyclic compounds / Heteroaromatic compounds | |||||
2-Pentylfuran | 19602 | Click to see CCCCCC1=CC=CO1 | 138.21 | unknown | via CMAUP database |
Perillene | 68316 | Click to see CC(=CCCC1=COC=C1)C | 150.22 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / 6-aminopurines / 6-alkylaminopurines | |||||
(E)-2-methyl-4-[(2-tritio-7H-purin-6-yl)amino]but-2-en-1-ol | 10585075 | Click to see CC(=CCNC1=NC=NC2=C1NC=N2)CO | 221.25 | unknown | via CMAUP database |
trans-Zeatin | 449093 | Click to see CC(=CCNC1=NC=NC2=C1NC=N2)CO | 219.24 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organoheterocyclic compounds / Indoles and derivatives / Indolines / 2,3-Cyclopentanoindolines | |||||
(7bR,10aR)-2,3,4,7b,8,9,10,10a-Octahydro-1H-cyclopenta[b][1,4]diazepino[6,7,1-hi]indole | 10130594 | Click to see C1CC2C(C1)N3CCNCC4=C3C2=CC=C4 | 214.31 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Indoles and derivatives / Indolyl carboxylic acids and derivatives | |||||
Tryptophan | 6305 | Click to see C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)N | 204.22 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organoheterocyclic compounds / Naphthopyrans / Naphthopyranones | |||||
3,4,6-Trihydroxy-5-(1-hydroxypropan-2-yl)-1,12-dimethyl-10-oxatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9(16),12-pentaene-8,11-dione | 13894318 | Click to see CC1=C2CCC3(C2=C(C(=O)C4=C3C(=C(C(=C4O)C(C)CO)O)O)OC1=O)C | 372.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
> Organoheterocyclic compounds / Oxepanes | |||||
6-Methyl-3-propan-2-ylidene-7-oxabicyclo[4.1.0]heptan-2-one | 61942 | Click to see CC(=C1CCC2(C(C1=O)O2)C)C | 166.22 | unknown | https://doi.org/10.1021/NP50008A001 |
Piperitenone oxide | 442497 | Click to see CC(=C1CCC2(C(C1=O)O2)C)C | 166.22 | unknown | https://doi.org/10.1021/NP50008A001 |
Piperitone oxide | 92998 | Click to see CC(C)C1CCC2(C(C1=O)O2)C | 168.23 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organoheterocyclic compounds / Piperidines | |||||
Piperidine | 8082 | Click to see C1CCNCC1 | 85.15 | unknown | https://doi.org/10.1021/NP50008A001 |
> Organoheterocyclic compounds / Pyrans | |||||
1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,10a-dihydro-4H-benzo[c]chromene-4a-carboxylic acid | 3082459 | Click to see CCCCCC1=CC(=C2C3C=C(C=CC3C(OC2(C1)C(=O)O)(C)C)C)O | 358.50 | unknown | https://doi.org/10.1007/S11101-008-9094-4 |
> Organoheterocyclic compounds / Pyridines and derivatives / Pyridinecarboxylic acids and derivatives / Pyridinecarboxylic acids | |||||
1-Methylpyridin-1-ium-3-carboxylate--hydrogen chloride (1/1) | 6419886 | Click to see C[N+]1=CC=CC(=C1)C(=O)[O-].Cl | 173.60 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Pyrroloazepines | |||||
Sartorymensin | 57407878 | Click to see CC(C)C12C3=C(CC(C(=O)N1)N4C2=NC5=CC=CC=C5C4=O)C6=CC=CC=C6N3 | 384.40 | unknown | https://doi.org/10.1016/0031-9422(94)00773-M |
> Organoheterocyclic compounds / Tetrahydrofurans | |||||
Linalyl oxide | 22310 | Click to see CC1(CCC(O1)C(C)(C)O)C=C | 170.25 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids | |||||
2-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-5-[(E)-3-[2-(4-hydroxyphenyl)ethylamino]-3-oxoprop-1-enyl]-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide | 5322012 | Click to see COC1=CC(=CC2=C1OC(C2C(=O)NCCC3=CC=C(C=C3)O)C4=CC(=C(C=C4)O)OC)C=CC(=O)NCCC5=CC=C(C=C5)O | 624.70 | unknown | https://doi.org/10.1016/S0031-9422(00)98242-6 |
2-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-5-[3-[2-(4-hydroxyphenyl)ethylamino]-3-oxoprop-1-enyl]-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide | 338256 | Click to see COC1=CC(=CC2=C1OC(C2C(=O)NCCC3=CC=C(C=C3)O)C4=CC(=C(C=C4)O)OC)C=CC(=O)NCCC5=CC=C(C=C5)O | 624.70 | unknown | https://doi.org/10.1016/S0031-9422(00)98242-6 |
Grossamide | 101262727 | Click to see COC1=CC(=CC2=C1OC(C2C(=O)NCCC3=CC=C(C=C3)O)C4=CC(=C(C=C4)O)OC)C=CC(=O)NCCC5=CC=C(C=C5)O | 624.70 | unknown | https://doi.org/10.1016/S0031-9422(00)98242-6 |
Tataramide B | 100916556 | Click to see COC1=CC(=CC2=C1OC(C2C(=O)NCCC3=CC=C(C=C3)O)C4=CC(=C(C=C4)O)OC)C=CC(=O)NCCC5=CC=C(C=C5)O | 624.70 | unknown | https://doi.org/10.1016/S0031-9422(00)98242-6 |
trans-scirpusin B | 21633205 | Click to see C1=CC(=C(C=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC(=C(C=C4)O)O)C5=CC(=CC(=C5)O)O)O)O | 486.50 | unknown | https://doi.org/10.1111/J.2042-7158.1980.TB12838.X |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Cinnamic acids | |||||
Cinnamic acid | 444539 | Click to see C1=CC=C(C=C1)C=CC(=O)O | 148.16 | unknown | https://doi.org/10.1021/NP50008A001 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives | |||||
3-(3,4-Dihydroxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide | 54408305 | Click to see C1=CC(=CC=C1CCNC(=O)C=CC2=CC(=C(C=C2)O)O)O | 299.32 | unknown | https://doi.org/10.1016/S0031-9422(00)98242-6 |
Cannabisin F | 71448967 | Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)OC(=CC3=CC(=C(C=C3)O)OC)C(=O)NCCC4=CC=C(C=C4)O | 624.70 | unknown | https://doi.org/10.1016/0031-9422(94)00773-M |
N-Caffeoyltyramine | 9994897 | Click to see C1=CC(=CC=C1CCNC(=O)C=CC2=CC(=C(C=C2)O)O)O | 299.32 | unknown | https://doi.org/10.1016/S0031-9422(00)98242-6 |
n-cis-Feruloyltyramine | 6440659 | Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)O | 313.30 | unknown | via CMAUP database |
N-feruloyltyramine; Moupinamide | 125213 | Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)O | 313.30 | unknown | https://doi.org/10.1016/S0031-9422(00)98242-6 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives | |||||
Cinnamamide, p-hydroxy-N-(p-hydroxyphenethyl)- | 89322 | Click to see C1=CC(=CC=C1CCNC(=O)C=CC2=CC=C(C=C2)O)O | 283.32 | unknown | https://doi.org/10.1016/S0031-9422(00)98242-6 |
Paprazine | 5372945 | Click to see C1=CC(=CC=C1CCNC(=O)C=CC2=CC=C(C=C2)O)O | 283.32 | unknown |
https://doi.org/10.1016/S0031-9422(00)98242-6 https://doi.org/10.1016/0091-3057(91)90348-6 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids | |||||
Ferulic acid | 445858 | Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O | 194.18 | unknown | https://doi.org/10.1021/NP50008A001 |
p-Coumaric acid | 637542 | Click to see C1=CC(=CC=C1C=CC(=O)O)O | 164.16 | unknown | https://doi.org/10.1021/NP50008A001 |
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones | |||||
Butin | 92775 | Click to see C1C(OC2=C(C1=O)C=CC(=C2)O)C3=CC(=C(C=C3)O)O | 272.25 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4886613/ |
> Phenylpropanoids and polyketides / Flavonoids / Flavones | |||||
Apigenin | 5280443 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O | 270.24 | unknown | via CMAUP database |
Luteolin | 5280445 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O | 286.24 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavones / 6-prenylated flavones | |||||
6-(3,7-Dimethylocta-2,6-dienyl)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one | 91544613 | Click to see CC(=CCCC(=CCC1=C(C2=C(C=C1O)OC(=CC2=O)C3=CC(=C(C=C3)O)OC)O)C)C | 436.50 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ https://doi.org/10.1039/P19820001467 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4885748/ |
6-Prenylapigenin | 10382485 | Click to see CC(=CCC1=C(C2=C(C=C1O)OC(=CC2=O)C3=CC=C(C=C3)O)O)C | 338.40 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ https://doi.org/10.1055/S-0028-1084474 |
> Phenylpropanoids and polyketides / Flavonoids / Flavones / 8-prenylated flavones | |||||
8-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one | 25141335 | Click to see CC(=CCCC(=CCC1=C2C(=C(C=C1O)O)C(=O)C=C(O2)C3=CC(=C(C=C3)O)OC)C)C | 436.50 | unknown | https://doi.org/10.1055/S-0028-1084474 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides | |||||
Flavocannabiside | 44257930 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O | 610.50 | unknown | https://doi.org/10.1002/JPS.2600660947 |
Orientin | 5281675 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O)O | 448.40 | unknown |
https://doi.org/10.1002/JPS.2600660947 https://doi.org/10.1021/NP50008A001 |
Vitexin | 5280441 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O | 432.40 | unknown | via CMAUP database |
Vitexin 2''-O-beta-D-glucoside | 5280641 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O | 594.50 | unknown |
https://doi.org/10.1002/JPS.2600660947 https://doi.org/10.1021/NP50008A001 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides | |||||
2-[3,4-dihydroxy-5-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3,5,7-trihydroxychromen-4-one | 6324879 | Click to see C1=C(C=C(C(=C1O)O)OC2C(C(C(C(O2)CO)O)O)O)C3=C(C(=O)C4=C(C=C(C=C4O3)O)O)O | 480.40 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides | |||||
Apigetrin | 5280704 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O | 432.40 | unknown | https://doi.org/10.1021/NP50008A001 |
Thalictiin | 5464455 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O | 432.40 | unknown | https://doi.org/10.1021/NP50008A001 |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 3-O-methylated flavonoids | |||||
8-(2,6-Dimethylhepta-1,5-dienyl)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one | 163092931 | Click to see CC(=CCCC(=CC1=C2C(=C(C=C1O)O)C(=O)C=C(O2)C3=CC(=C(C=C3)O)OC)C)C | 422.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ |
Chryseriol | 5280666 | Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O | 300.26 | unknown |
https://doi.org/10.1055/S-0028-1084474 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4888767/ |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 6-O-methylated flavonoids | |||||
Axillarin | 5281603 | Click to see COC1=C(C2=C(C=C1O)OC(=C(C2=O)OC)C3=CC(=C(C=C3)O)O)O | 346.30 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids | |||||
Artemetin | 5320351 | Click to see COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC)O)OC)OC | 388.40 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Macrolactams | |||||
(13S,17S)-17-[(1S,2R)-1,2-dihydroxyheptyl]-1,5,10-triazabicyclo[11.4.0]heptadec-15-en-11-one | 118701419 | Click to see CCCCCC(C(C1C=CCC2N1CCCNCCCCNC(=O)C2)O)O | 381.60 | unknown | https://doi.org/10.1021/NP50008A001 |
17-(1,2-Dihydroxyheptyl)-1,5,10-triazabicyclo[11.4.0]heptadec-15-en-11-one | 326003 | Click to see CCCCCC(C(C1C=CCC2N1CCCNCCCCNC(=O)C2)O)O | 381.60 | unknown | https://doi.org/10.1016/S0040-4039(00)75003-9 |
> Phenylpropanoids and polyketides / Neoflavonoids / Dalbergiones | |||||
9,10-Dihydro-2,3,5,6-tetramethoxyphenanthrene-1,4-dione | 129861810 | Click to see COC1=C(C2=C(CCC3=C2C(=O)C(=C(C3=O)OC)OC)C=C1)OC | 330.30 | unknown | https://doi.org/10.1007/S10600-010-9721-3 |
> Phenylpropanoids and polyketides / Phenylpropanoic acids | |||||
3-(4-ethylphenyl)propanoic Acid | 2064039 | Click to see CCC1=CC=C(C=C1)CCC(=O)O | 178.23 | unknown | https://doi.org/10.1021/NP50008A001 |
3-Phenylpropionic acid | 107 | Click to see C1=CC=C(C=C1)CCC(=O)O | 150.17 | unknown | https://doi.org/10.1021/NP50008A001 |
> Phenylpropanoids and polyketides / Stilbenes | |||||
Cannabistilbene I | 146349 | Click to see CC(=CCC1=C(C=CC(=C1)CCC2=CC(=CC(=C2)OC)O)O)C | 312.40 | unknown | https://doi.org/10.1021/NP50033A008 |
Dihydroresveratrol | 185914 | Click to see C1=CC(=CC=C1CCC2=CC(=CC(=C2)O)O)O | 230.26 | unknown | https://doi.org/10.1021/NP50031A011 |
Gigantol | 3085362 | Click to see COC1=C(C=C(C=C1)CCC2=CC(=CC(=C2)OC)O)O | 274.31 | unknown |
https://doi.org/10.1039/P19820001467 https://doi.org/10.1021/NP50008A001 |
Phenol, 3-[2-(4-hydroxyphenyl)ethyl]-5-methoxy- | 10014709 | Click to see COC1=CC(=CC(=C1)O)CCC2=CC=C(C=C2)O | 244.28 | unknown |
https://doi.org/10.1039/P19820001467 https://doi.org/10.1021/NP50008A001 |
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