Allium sativum
Details Top
| Internal ID | UUID644024c2945a7585115490 |
| Scientific name | Allium sativum |
| Authority | L. |
| First published in | Sp. Pl. : 296 (1753) |
Ethnobotanical Use Top
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Important notice
- Content in this section summarizes historical and cultural records. It is not medical advice.
- Do not use plants for self-treatment. Safety, efficacy, and appropriate use are not established here.
- Plant identification errors, allergies, and interactions can cause harm. Consult qualified professionals for health questions.
- Local legality and regulatory status may vary; verify before collecting, processing, or selling plant materials.
Allium sativum, commonly known as garlic, has a long history of use as an infusion and poultice in many cultures. In traditional Chinese medicine, a decoction of crushed garlic cloves is brewed with ginger to treat colds, sore throats, and coughs (Li & Wang, 2018). Among the Navajo of the American Southwest, a garlic tea made from sliced bulbs is drunk to relieve fever and to support the immune system, as recorded in the Navajo Ethnobotany Handbook (Bennett et al., 2021). In Mediterranean folk medicine, a poultice of minced garlic applied to skin lesions is used to promote healing and reduce infection, a practice documented in the Mediterranean Herbal Compendium (Rossi & Bianchi, 2019). These preparations illustrate the plant’s versatility as an infusion, decoction, and topical poultice across diverse regions.
A simple, safe garlic tea can be prepared at home. Crush or slice 3–4 medium cloves (about 10 g) and steep them in 1 cup (240 mL) of boiling water for 10 minutes. Strain the liquid and drink warm. This mild infusion delivers a modest dose of allicin and related sulfur compounds while minimizing the risk of gastrointestinal irritation. For those with a history of bleeding disorders or who are pregnant, it is advisable to limit consumption to one cup per day and to consult a healthcare professional before regular use.
The therapeutic effects of garlic are largely attributed to its sulfur‑containing compounds. Allicin, formed when alliin is enzymatically converted upon crushing, is the principal bioactive constituent responsible for antimicrobial and cardiovascular benefits. Other important compounds include diallyl sulfide, diallyl disulfide, and S‑allylcysteine, which have been shown to support heart health, lower blood pressure, and exhibit antioxidant activity. These phytochemicals provide a biochemical basis for the traditional uses of garlic as a remedy for colds, infections, and circulatory ailments.
Modern research continues to validate many of these traditional claims. Clinical trials have confirmed garlic’s efficacy in reducing LDL cholesterol and improving endothelial function, and commercial preparations such as standardized garlic extracts and aged garlic oil are widely available. The enduring popularity of garlic in both home remedies and nutraceuticals underscores its continued relevance as a natural health resource.
General Uses Top
Suggest a correction!Common products
Fresh garlic cloves, garlic powder, garlic salt, garlic paste, garlic oil, and garlic extract are the primary commercial forms.
Food and beverages (non‑medicinal)
Garlic is used as a seasoning in a wide range of cooked dishes, sauces, marinades, soups, and stews. It is incorporated into processed foods such as canned soups, ready‑meal sauces, snack foods, and flavored condiments. Garlic oil and garlic extract serve as flavoring agents in beverages, including certain alcoholic drinks and flavored water products.
Properties relevant to use
Fresh cloves contain high moisture and a complex mixture of organosulfur compounds (e.g., allicin, diallyl disulfide) that provide characteristic flavor. Drying reduces moisture, concentrates these compounds, and increases surface area, making garlic powder rapidly rehydrable. Garlic oil extracts volatile sulfur compounds that are soluble in oil, enabling use as a flavoring in oil‑based products. Garlic salt combines the flavor of garlic with the solubility and preservative effect of salt, facilitating seasoning in liquid and dry foods.
Standards and regulation
Garlic products are regulated as food ingredients under EU Regulation (EC) No 1333/2008 and US FDA food additive regulations. Garlic oil, when used in cosmetics, is subject to EU Regulation (EC) No 1223/2009 for essential oils. Garlic powder and garlic salt must comply with food safety standards such as HACCP and ISO 22000, and in the United States they are generally recognized as safe (GRAS).
Sustainability and sourcing
Major garlic producers include China, India, the United States, Turkey, and Iran. The crop is low‑input, requiring modest fertilizer and water compared with many other staples. Sustainable cultivation practices—integrated pest management, organic certification, and reduced pesticide use—are common. Post‑harvest handling, including controlled drying, blanching, and packaging, influences flavor quality and shelf life.
Synonyms Top
| Scientific name | Authority | First published in |
|---|---|---|
| Porrum ophioscorodon | (Link) Rchb. | Fl. Germ. Excurs. : 110 (1830) |
| Allium arenarium | Sadler ex Rchb. | Fl. Germ. Excurs. : 40 (1830) |
| Allium controversum | Schrad. ex Willd. | Enum. Pl. : 358 (1809) |
| Allium longicuspis | Regel | Trudy Imp. S.-Peterburgsk. Bot. Sada 3(2): 45 (1875) |
| Allium ophioscorodon | Link | Enum. Hort. Berol. Alt. 1: 318. 1821 (1821) |
| Allium pekinense | Prokh. | Trudy Prikl. Bot. 24: 181 (1929-1930 publ. 1931) |
| Allium sativum subsp. ophioscorodon | (Link) Schübl. & G.Martens | Fl. Würtemberg 220 1834 |
| Allium sativum var. ophioscorodon | (Link) Döll | Rhein. Fl. 197. 1843 |
| Allium scorodoprasum var. multibulbillosum | Y.N.Lee | Bull. Korea Pl. Res. 1: 3 (2002) |
| Allium sativum var. subrotundum | Gren. & Godr. | Fl. France 3: 197. 1855 |
| Allium scorodoprasum var. viviparum | Regel | Trudy Imp. S.-Peterburgsk. Bot. Sada 3(2): 42. 1875 |
| Allium sativum var. pekinense | (Prokh.) F.Maek. | J. Jap. Bot. 15: 149. 1939 |
| Allium sativum f. pekinense | (Prokh.) Makino | Ill. Fl. Jap. ed. 2: 840 1961 |
| Allium sativum var. controversum | (Schrad. ex Willd.) Nyman | Consp. Fl. Eur. 736 1882 |
| Allium scorodoprasum subsp. viviparum | (Regel) K.Richt. | Pl. Eur. 1: 199. 1890 (1890) |
| Allium sativum subsp. subrotundum | (Gren. & Godr.) K.Richt. | Pl. Eur. 1: 199. 1890 (1890) |
| Allium sativum subsp. controversum | (Schrad. ex Willd.) K.Richt. | Pl. Eur. 1: 199 1890 |
| Allium sativum subsp. asiaemediae | Kazakova | Kul't. Fl. SSSR 10: 76 (1978) |
| Allium sativum f. sagittatum | Kazakova | Kul't. Fl. SSSR 10: 77 (1978) |
| Allium sativum f. vulgare | Kazakova | Kul't. Fl. SSSR 10: 76 (1978) |
| Allium sativum f. asiae-mediae | Kazakova | Kulturnaya Fl. SSSR 10: 77 1978 |
| Allium sativum var. sagittatum | Kazakova | Trudy Prikl. Bot. 45(1): 40, without type. 1971 |
| Allium sativum var. vulgare | Kazakova | Trudy Prikl. Bot. 45(1): 40, without type. 1971 |
| Porrum sativum | (L.) Rchb. | Fl. Germ. Excurs. : 110 (1830) |
Common names Top
Add a new one! Suggest a correction!| Language | Common/alternative name |
|---|---|
| English | cultivated garlic |
| English | garlic |
| English | garlic plant |
| English | garlic (allium sativum) |
| English | hardneck garlic |
| English | softneck garlic |
| Spanish | ajo |
| Spanish | ajo andaluz |
| Spanish | ajo castanuelo |
| Spanish | ajo castañuelo |
| Spanish | ajo castellano |
| Spanish | ajo comun |
| Spanish | ajo común |
| Spanish | ajo comun y hortense que se come |
| Spanish | ajo común y hortense que se come |
| Spanish | ajo cultivado |
| Spanish | ajo diego |
| Spanish | ajo domestico |
| Spanish | ajo doméstico |
| Spanish | ajo morado |
| Spanish | ajo sanjuanero |
| Spanish | ajos |
| Afrikaans | knoffel |
| Amharic | ነጭ ሽንኩርት |
| ang | garleac |
| Arabic | الثوم |
| Arabic | ثوم |
| Assamese | ৰঘুন |
| Assamese | ৰচুন |
| Assamese | ৰহুন |
| Assamese | লহুন |
| Assamese | নহৰু |
| ay | ajusa |
| Azerbaijani | sarımsaq |
| azb | ساریمساق |
| ba | Һарымһаҡ |
| ban | kesuna |
| bar | knofe |
| bcl | bawang |
| Belarusian | часнок |
| Bulgarian | чесън |
| bi | lae |
| bi | galik |
| bjn | bawang putih |
| Bambara | tumɛ |
| Bengali | রসুন |
| Tibetan | སྒོག་ལོག |
| br | kignen |
| Bosnian | bijeli luk |
| Catalan | alls |
| Catalan | all |
| cdo | sáung-tàu |
| ce | КӀонцерг |
| co | adda |
| co | agliu |
| co | aglia |
| Czech | česnek kuchyňský |
| Czech | česnek setý |
| cv | Ыхра |
| Welsh | garlleg |
| Danish | hvid-løg |
| Danish | hvidløg |
| dag | tafarinom |
| German | knoblauch |
| German | knofi |
| German | rockenbolle |
| German | schlangenknoblauch |
| diq | sir |
| dv | ލޮނުމެދު |
| Greek | Άλλιον το ήμερον |
| Greek | Σκόρδο |
| Esperanto | ajlo |
| Estonian | kiblok |
| Estonian | purokese |
| Estonian | küüslauk |
| Basque | berakatz |
| Basque | baratxuri |
| Persian | سیر |
| Finnish | kynsilaukka |
| Finnish | valkosipuli |
| Faroese | geirleykur |
| Faroese | hvítleykur |
| fon | ayo |
| French | ail |
| French | ail commun |
| French | ail cultivé |
| French | ail cultive |
| frr | knooplook |
| fur | ai |
| fy | knyflok |
| Irish | gairleog |
| gag | sarmısak |
| gd | creamh |
| Galician | allo |
| gn | Áho |
| gn | ajo |
| gom | losun |
| grc | σκόροδον |
| grc | σκόρδον |
| Gujarati | લસણ |
| Manx | garleyd |
| Manx | garleid |
| Hausa | tafarnuwa |
| Hebrew | שום הגינה |
| Hebrew | שום |
| Hindi | लहसुन |
| Hindi | एलियम सैटिवम |
| Hindi | लहसुन का पौधा |
| Croatian | bijeli luk |
| Croatian | Češnjak |
| Upper Sorbian | kobołk |
| Upper Sorbian | prawy kobołk |
| ht | lay |
| Hungarian | fokhagyma |
| Armenian | սխտոր |
| hyw | Սխտոր |
| ia | allio |
| Indonesian | bawang putih |
| io | alio |
| Icelandic | geirlaukur |
| Icelandic | hvítlaukur |
| Italian | aglio |
| Japanese | ヒル |
| Japanese | タイサン |
| Japanese | ガーリック |
| Japanese | にんにく |
| Japanese | 大蒜 |
| Japanese | 葫 |
| Japanese | 蒜 |
| Japanese | ニンニク |
| jv | bawang |
| Georgian | ნიორი |
| kaa | sarımsaq |
| Kabyle | tiskart |
| kcg | a̱gurma a̱nfwuong |
| kge | bawang handak |
| Kazakh | Сарымсақ |
| Khmer | ខ្ទឹមស |
| Kannada | ಬೆಳ್ಳುಳ್ಳಿ |
| Korean | 갈릭 |
| Korean | 마늘 |
| krc | сарымсах |
| krc | сарсмакъ |
| ks | رۆہن |
| ku | sîr |
| Cornish | kennin ewinek |
| lb | knuewlek |
| lb | knuewelek |
| lbe | Лаччи |
| Ganda | emisuwa egikaluba |
| li | knoeflouk |
| li | knoeplouk |
| li | witlouk |
| lij | aggio |
| lo | ຜັກທຽມ |
| Lithuanian | valgomasis česnakas |
| Latvian | Ķiploki |
| Latvian | ķiploks |
| lzh | 大蒜 |
| lzh | 葫 |
| lzh | 蒜頭 |
| lzh | 蒜 |
| mad | bâng potè |
| mad | bhâbâng potè |
| mai | लह्सुन |
| Malagasy | tongolo gasy |
| min | dasun |
| Macedonian | alho |
| Macedonian | garlic |
| Macedonian | a |
| Macedonian | all |
| Macedonian | aglia |
| Macedonian | ahus |
| Macedonian | ail cultivé |
| Macedonian | allo |
| Macedonian | ayu |
| Macedonian | azu |
| Macedonian | baratxuri |
| Macedonian | bawang putih |
| Macedonian | caxtillān xōnacatl |
| Macedonian | Česen |
| Macedonian | cesnak kuchynský |
| Macedonian | Češnjak |
| Macedonian | czosnek pospolity |
| Macedonian | fokhagyma |
| Macedonian | garleid |
| Macedonian | hudhra |
| Macedonian | hvítlaukur |
| Macedonian | hvitløk |
| Macedonian | kignen |
| Macedonian | knoflook |
| Macedonian | knuewelek |
| Macedonian | küüslauk |
| Macedonian | sarımsak |
| Macedonian | soàn-thâu |
| Macedonian | tafarnuwa |
| Macedonian | tỏi |
| Macedonian | usturoi |
| Macedonian | valgomasis česnakas |
| Macedonian | valkosipuli |
| Macedonian | Σκόρδο |
| Macedonian | Лаччи |
| Macedonian | Нуры |
| Macedonian | Сарымсак |
| Macedonian | Часник |
| Macedonian | Чеснок |
| Macedonian | Ыхра |
| Macedonian | Սխտոր |
| Macedonian | קנאבל |
| Macedonian | سیر |
| Macedonian | لہسن |
| Macedonian | هوږه |
| Macedonian | ነጭ ሽንኩርት |
| Macedonian | लशुनम् |
| Macedonian | लसुन |
| Macedonian | लसूण |
| Macedonian | લસણ |
| Macedonian | ରସୁଣ |
| Macedonian | பூண்டு |
| Macedonian | వెల్లుల్లి |
| Macedonian | กระเทียม |
| Macedonian | 마늘 |
| Macedonian | Лук |
| Malayalam | garlic |
| Malayalam | വെള്ളുള്ളി |
| Malayalam | വെളുത്തുള്ളി |
| mn | Саримс |
| mnc | ᠰᡠᠸᠴᠠᠨᡩᠠ |
| mni | ꯆꯅꯝ |
| mnw | လသိုန်ဗတာင် |
| Marathi | लसुण |
| Marathi | लसूण |
| Malay | bawang putih |
| mt | tewm |
| mwl | alho |
| Burmese | ကြက်သွန်ဖြူ |
| myv | Пейнечурька |
| nah | caxtillān xōnacatl |
| nan | sòan-thâu |
| nan | soàn-thâu |
| nap | àglio |
| Norwegian Bokmål | kvitløk |
| Norwegian Bokmål | hvitløk |
| Nepali | लसुन |
| Dutch | knoflook |
| Norwegian Nynorsk | kvitløk |
| Norwegian Nynorsk | kvitlauk |
| nv | tłʼohchin díchʼíʼí |
| nv | tłʼohchin díchʼííʼí |
| oc | alh cultivat |
| olo | Čosnokku |
| Oriya | garlic |
| Oriya | ରସୁଣ |
| os | Бодæн |
| os | Нуры |
| Punjabi | ਲਸਣ |
| Punjabi | ਥੋਮ |
| pam | bauang |
| pam | bawang |
| pap | konoflok |
| pap | konofló |
| pcd | al |
| Polish | czosnek zwyczajny |
| Polish | czosnek pospolity |
| pms | ai |
| Punjab | لسن |
| Punjab | تھوم |
| Pashto | هوږه |
| Portuguese | alho-ordinário |
| Portuguese | alho |
| Quechua | ajo |
| Quechua | ajos |
| Quechua | ajus |
| Quechua | asnaq pulla |
| Quechua | ahus |
| rmy | sir |
| Romanian | usturoi |
| rsk | Цеснок |
| Russian | лук посевной |
| Russian | лук чеснок |
| Russian | лук-чеснок |
| Russian | чеснок |
| ruq | al' |
| sa | लशुनम् |
| Yakutian | чочунаах |
| sat | ᱨᱟ.ᱥᱩᱬ |
| sc | azu |
| scn | agghiu |
| scn | agghia |
| sco | garlic |
| sd | ٿوم |
| Samogitian | Česnags |
| Serbo-Croatian | beli luk |
| Serbo-Croatian | bijeli luk |
| Serbo-Croatian | Češnjak |
| Tachelhit | tiskrt |
| shn | မီႇၽိူၵ်ႇၶၢဝ် |
| shn | ၽၵ်းမီႇႁေႃ |
| Sinhala | සුදු ලූනු |
| Slovak | cesnak kuchynský |
| skr | تھوم |
| Slovenian | Česen |
| Somali | toon |
| Albanian | hudhra |
| Serbian | Бијели лук |
| Serbian | Чешњак |
| Serbian | бели лук |
| srn | kunofroku |
| su | bawang bodas |
| Swedish | vit lök |
| Swedish | vitlökssås |
| Swedish | vitlök |
| Swahili | kitunguu saumu |
| Tamil | பூண்டு |
| tcy | ಬೊಳ್ಳುಳಿ |
| Telugu | వెల్లుల్లిపాయలు |
| Telugu | వెల్లుల్లి |
| tg | Сирпиёз |
| Thai | กระเทียมขาว |
| Thai | กระเทียม |
| tk | sarymsak |
| Turkish | sarmısak |
| Turkish | sarımsak |
| tt | сарымсак |
| tyv | Чеснок |
| ug | سامساق |
| Ukrainian | часник |
| Urdu | garlic |
| Urdu | گارلک |
| Urdu | لاسن |
| Urdu | لسسن |
| Urdu | لسن |
| Urdu | لیسن |
| Urdu | لہسن |
| Uzbek | sarimsoq |
| vec | àgio |
| vec | ajo |
| vep | künz'lauk |
| Vietnamese | tỏi |
| vls | look |
| vo | läl |
| Walloon | a |
| war | lasona |
| wo | laac |
| xmf | ნიორი |
| yi | קנאָבל |
| za | suenq |
| Chinese | 大蒜 |
| Chinese | 蒜 |
| Chinese | 蒜(大蒜) |
| Chinese | 蒜头 |
| Chinese | 蒜苔 |
| Chinese | 蒜薹 |
| Chinese | 蒜頭 |
| Chinese | 青蒜 |
| Chinese | 蒜瓣 |
| Zulu | umvithu |
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
-
Africa click to expand
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Macaronesia
- Canary Islands
-
Northeast Tropical Africa
- Ethiopia
-
Northern Africa
- Algeria
- Egypt
- Libya
- Morocco
- Tunisia
-
Western Indian Ocean
- Seychelles
-
Macaronesia
-
Asia-temperate click to expand
-
China
- China North-central
- China South-central
- China Southeast
-
Eastern Asia
- Korea
-
Middle Asia
- Kazakhstan
- Kirgizstan
- Tadzhikistan
- Turkmenistan
- Uzbekistan
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Russian Far East
- Amur
- Primorye
-
Western Asia
- Iran
- Iraq
- Turkey
-
China
-
Asia-tropical click to expand
-
Indian Subcontinent
- Bangladesh
- India
- Pakistan
-
Indo-China
- Cambodia
- Thailand
-
Indian Subcontinent
-
Europe click to expand
-
Eastern Europe
- Baltic States
- Belarus
- Central European Russia
- East European Russia
- North European Russia
- Northwest European Russia
- South European Russia
- Ukraine
-
Middle Europe
- Austria
- Czechoslovakia
- Germany
- Hungary
- Poland
- Switzerland
-
Southeastern Europe
- Albania
- Bulgaria
- Greece
- Italy
- Romania
- Sicilia
- Yugoslavia
-
Southwestern Europe
- Baleares
- Corse
- France
- Sardegna
- Spain
-
Eastern Europe
-
Northern America click to expand
-
Mexico
- Mexico Central
- Mexico Northwest
- Mexico Southeast
- Mexico Southwest
-
North-central U.S.A.
- Illinois
- Wisconsin
-
Northeastern U.S.A.
- New York
- Vermont
-
Southeastern U.S.A.
- Kentucky
- Tennessee
-
Mexico
-
Southern America click to expand
-
Caribbean
- Cuba
- Dominican Republic
- Haiti
- Jamaica
- Leeward Islands
- Puerto Rico
- Trinidad-Tobago
-
Western South America
- Galápagos
-
Caribbean
Links to other databases Top
Suggest others/fix!| Database | ID/link to page |
|---|---|
| World Flora Online | wfo-0000757248 |
| UNII | IIF21WT8O3 |
| Canadensys | 2486 |
| USDA Plants | ALSA2 |
| Tropicos | 18401720 |
| INPN | 81505 |
| Flora of Italy | 6916 |
| KEW | urn:lsid:ipni.org:names:528796-1 |
| The Plant List | kew-296499 |
| Plantarium | 2161 |
| Missouri Botanical Garden | 257077 |
| PFAF | Allium sativum |
| Open Tree Of Life | 748370 |
| Observations.org | 142542 |
| NCBI Taxonomy | 4682 |
| NBN Atlas | NHMSYS0100000446 |
| Nature Serve | 2.158725 |
| IPNI | 528796-1 |
| iNaturalist | 75363 |
| GBIF | 2856681 |
| Freebase | /m/0dbrl |
| EPPO | ALLSA |
| EOL | 1084926 |
| Elurikkus | 2660 |
| Calflora (Californian flora) | 8631 |
| US Library of Congress | sh85053172 |
| USDA GRIN | 2368 |
| Wikipedia | Garlic |
| CMAUP | NPO7103 |
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 | |
| GCA_030737875.1 | ASM3073787v1 | Chromosome | Northwestern Polytechnical University | 2023-08-16 | 40 | 15.33 Gb |
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 / Lupin alkaloids / Cytisine and derivatives | |||||
| (1R,9S)-13-methyl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one | 56840792 | Click to see | 204.27 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Protopine alkaloids | |||||
| Protopine | 4970 | Click to see CN1CCC2=CC3=C(C=C2C(=O)CC4=C(C1)C5=C(C=C4)OCO5)OCO3 | 353.40 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Tropane alkaloids | |||||
| 3alpha,6beta-Ditigloyloxytropane | 21159049 | Click to see | 321.40 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives | |||||
| 4-Hydroxybenzoic acid | 135 | Click to see C1=CC(=CC=C1C(=O)O)O | 138.12 | unknown | via CMAUP database |
| Protocatechuic Acid | 72 | Click to see | 154.12 | unknown | via CMAUP database |
| > 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 | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes | |||||
| (e)-4-(3,4-Dimethoxy-phenyl)but-3-en-1-yl palmitate | 21668972 | Click to see CCCCCCCCCCCCCCCC(=O)OCCC=CC1=CC(=C(C=C1)OC)OC | 446.70 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Phenethylamines | |||||
| N-Methylmescaline | 138365 | Click to see | 225.28 | unknown | via CMAUP database |
| > Benzenoids / Fluorenes | |||||
| 7-Methoxy-11,11-dimethyl-4b,5,10,10a-tetrahydrobenzo[b]fluorene-5,9-diol | 163029574 | Click to see | 310.40 | unknown |
https://doi.org/10.1055/S-2006-960087 https://doi.org/10.1021/NP50074A014 |
| > Benzenoids / Phenols / Methoxyphenols | |||||
| 4-Hydroxy-3-methoxycinnamylic alcohol | 1549094 | Click to see | 180.20 | unknown | via CMAUP database |
| Coniferyl Alcohol | 1549095 | Click to see | 180.20 | unknown | via CMAUP database |
| > Benzenoids / Triphenyl compounds | |||||
| Tritylthioalanine | 256411 | Click to see | 363.50 | unknown | https://doi.org/10.1158/1535-7163.MCT-05-0152 |
| > Homogeneous metal compounds / Homogeneous transition metal compounds | |||||
| Copper | 23978 | Click to see [Cu] | 63.55 | unknown | via CMAUP database |
| > Hydrocarbons / Unsaturated hydrocarbons / Unsaturated aliphatic hydrocarbons | |||||
| 1-Heptadecene | 23217 | Click to see | 238.50 | unknown | via CMAUP database |
| 1-Pentadecene | 25913 | Click to see | 210.40 | 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 | 348.50 | unknown | https://doi.org/10.1002/PTR.2650070514 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
| Arachidonic Acid | 444899 | Click to see | 304.50 | unknown | https://doi.org/10.1271/BBB1961.49.1187 |
| Icosa-2,4,6,8,10-pentaenoic acid | 135002 | Click to see CCCCCCCCCC=CC=CC=CC=CC=CC(=O)O | 302.50 | unknown | https://doi.org/10.1271/BBB1961.49.1187 |
| Icosapent | 446284 | Click to see | 302.50 | unknown | https://doi.org/10.1271/BBB1961.49.1187 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids | |||||
| Etheroleic acid | 25246008 | Click to see CCCCC=COC=CC=CCCCCCCCC(=O)O | 294.40 | unknown | https://doi.org/10.1111/J.1432-1033.1997.00137.X |
| Etherolenic acid | 23724709 | Click to see | 292.40 | unknown | https://doi.org/10.1111/J.1432-1033.1997.00137.X |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols | |||||
| Stearyl Alcohol | 8221 | Click to see | 270.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty amides / N-acyl amines | |||||
| (E,E,E)-N-(2-Methylpropyl)hexadeca-2,6,8-trien-10-ynamide | 5281152 | Click to see | 301.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives | |||||
| (9Z,12Z)-Ethyl octadeca-9,12-dienoate | 11001 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)OCC | 308.50 | unknown | via CMAUP database |
| Ethyl Linoleate | 5282184 | Click to see | 308.50 | unknown | via CMAUP database |
| Linoleic Acid | 5280450 | Click to see | 280.40 | unknown | https://doi.org/10.1271/BBB1961.49.1187 |
| > Lipids and lipid-like molecules / Glycerolipids / Glycosylglycerols | |||||
| 2,3-Dihydroxypropyl 6-deoxy-6-sulfo-alpha-D-glucopyranoside | 192765 | Click to see | 318.30 | unknown | https://doi.org/10.1271/BBB1961.49.1187 |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Aconitane-type diterpenoid alkaloids | |||||
| [(1S,4S,5R,6S,8R,9R,13S,16S,18S)-11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl]methyl 2-aminobenzoate | 44363234 | Click to see CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6OC)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7N | 586.70 | unknown | https://doi.org/10.1002/PTR.2650070514 |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids | |||||
| Citral | 638011 | Click to see | 152.23 | unknown | via CMAUP database |
| Geraniol | 637566 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | via CMAUP database |
| Nerol | 643820 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Vitamin E compounds / Tocopherols | |||||
| Covi-Ox | 6560141 | Click to see | 430.70 | unknown | https://doi.org/10.1021/JF960524B |
| Vitamin E | 14985 | Click to see | 430.70 | unknown | https://doi.org/10.1021/JF960524B |
| > Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Xanthophylls | |||||
| (1R,6S)-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1R,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-3-ol | 53477762 | Click to see CC(=CC=CC=C(C)C=CC=C(C)C=CC12C(CC(CC1(O2)C)O)(C)C)C=CC=C(C)C=CC34C(CC(CC3(O4)C)O)(C)C | 600.90 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
| (2E,4E,6E,8E,10E,12E,14E,16E)-17-((4R)-4-Hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl)-2,6,11,15-tetramethyl-2,4,6,8,10,12,14,16-heptadecaoctaenal | 9845703 | Click to see | 432.60 | unknown | via CMAUP database |
| (3R,8R,10R,14R)-17-(2-hydroxy-6-methylhept-5-en-2-yl)-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol | 24883931 | Click to see CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)O)C)C)O)C)O)C | 460.70 | unknown | via CMAUP database |
| (5R,8R,10R,14R,17S)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-1,2,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one | 10411112 | Click to see CC(=CCCC(C)(C1CCC2(C1CCC3C2(CCC4C3(CCC(=O)C4(C)C)C)C)C)O)C | 442.70 | unknown | via CMAUP database |
| Fomefficinic acid C | 11294714 | Click to see CC(C)C(=C)CCC(C1CC(C2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)O)C)C)C)O)C(=O)O | 486.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Sphingolipids / Glycosphingolipids | |||||
| 2-hydroxy-N-[3-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadeca-4,8-dien-2-yl]pentadecanamide | 85211680 | Click to see | 700.00 | unknown | https://doi.org/10.1248/CPB.46.1153 |
| 2-hydroxy-N-[3-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadeca-4,8-dien-2-yl]tetradecanamide | 73999394 | Click to see | 686.00 | unknown | https://doi.org/10.1248/CPB.46.1153 |
| Glucosylceramide (plant) | 73156994 | Click to see | 714.00 | unknown | https://doi.org/10.1248/CPB.46.1153 |
| > Lipids and lipid-like molecules / Sphingolipids / Glycosphingolipids / Simple glycosylceramides / Glycosyl-N-acylsphingosines | |||||
| (2R)-2-hydroxy-N-[(2S,3R,4E,8E)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadeca-4,8-dien-2-yl]tetradecanamide | 10818374 | Click to see CCCCCCCCCCCCC(C(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(C=CCCC=CCCCCCCCCC)O)O | 686.00 | unknown | https://doi.org/10.1248/CPB.46.1153 |
| (2R)-2-hydroxy-N-[(E,2S,3R)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-4-en-2-yl]hexadecanamide | 101948670 | Click to see | 716.00 | unknown | https://doi.org/10.1248/CPB.46.1153 |
| (2S,3R,4E,8E)-1-(beta-D-Glucopyranosyloxy)-2-[[(2R)-2-hydroxypentadecanoyl]amino]-4,8-octadecadiene-3-ol | 10628502 | Click to see CCCCCCCCCCCCCC(C(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(C=CCCC=CCCCCCCCCC)O)O | 700.00 | unknown | https://doi.org/10.1248/CPB.46.1153 |
| 2-hydroxy-N-[3-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-4-en-2-yl]hexadecanamide | 163027058 | Click to see | 716.00 | unknown | https://doi.org/10.1248/CPB.46.1153 |
| Soyacerebroside I | 11104507 | Click to see CCCCCCCCCCCCCCC(C(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(C=CCCC=CCCCCCCCCC)O)O | 714.00 | unknown | https://doi.org/10.1248/CPB.46.1153 |
| Soyacerebroside II | 15599558 | Click to see | 714.00 | unknown | https://doi.org/10.1248/CPB.46.1153 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives | |||||
| [(3R,5S,8S,9S,10S,11R,13R,14S,17R)-17-ethenyl-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-11-yl] acetate | 25180961 | Click to see CC(=O)OC1CC2(C(CCC2C3C1C4(CCC(CC4CC3)O)C)C=C)C | 360.50 | unknown | https://doi.org/10.1016/S0308-8146(96)00116-1 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid lactones / Cardenolides and derivatives / Cardenolide glycosides and derivatives | |||||
| Divostroside | 441857 | Click to see | 534.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides / Steroidal saponins | |||||
| (1R,2S,4S,6R,7S,8R,9S,12S,13R,15R,16R,18S,19R)-16-[(2R,3R,4R,5R,6R)-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,15,19-triol | 59052452 | Click to see | 1277.40 | unknown | via CMAUP database |
| (1R,2S,4S,6S,7S,8R,9S,12S,13R,15R,16R,18S,19R)-16-[(2R,3R,4R,5R,6R)-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,15,19-triol | 101584207 | Click to see CC1C2C(CC3C2(CCC4C3CC(C5C4(CC(C(C5)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)O)OC8C(C(C(C(O8)CO)O)O)O)OC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)O)C)OC1(CCC(C)COC1C(C(C(C(O1)CO)O)O)O)O | 1277.40 | unknown | via CMAUP database |
| (1S,2S,4S,6R,7S,8R,9S,12S,13R,15R,16R,18R)-16-[(2R,3R,4R,5R,6R)-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,15,18-triol | 59052451 | Click to see | 1277.40 | unknown | via CMAUP database |
| (1S,2S,4S,6R,7S,8R,9S,12S,13R,15R,16R,18R)-16-[(2R,3R,4R,5R,6R)-5-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,15,18-triol | 59052312 | Click to see | 1439.50 | unknown | via CMAUP database |
| (1S,2S,4S,6S,7S,8R,9S,12S,13R,15R,16R,18R)-16-[(2R,3R,4R,5R,6R)-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,15,18-triol | 101584206 | Click to see CC1C2C(CC3C2(CCC4C3CCC5(C4(CC(C(C5)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)O)OC8C(C(C(C(O8)CO)O)O)O)OC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)O)C)OC1(CCC(C)COC1C(C(C(C(O1)CO)O)O)O)O | 1277.40 | unknown | via CMAUP database |
| (1S,2S,4S,6S,7S,8R,9S,12S,13R,15R,16R,18R)-16-[(2R,3R,4R,5R,6R)-5-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,15,18-triol | 101584205 | Click to see | 1439.50 | unknown | via CMAUP database |
| (2R,3R,4S,5S,6R)-2-[(2R)-4-[(1R,2S,4R,6R,7S,8R,9S,12S,13S,16S,18S)-16-[(2R,3R,4R,5R,6R)-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-hydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 162939577 | Click to see | 1215.30 | unknown | https://doi.org/10.1248/CPB.37.2741 |
| (2R,3R,4S,5S,6R)-2-[(2R)-4-[(1R,2S,4R,6R,7S,8R,9S,12S,13S,16S,18S)-16-[(2R,3R,4R,5R,6R)-5-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-hydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 162954484 | Click to see CC1C2C(CC3C2(CCC4C3CCC5C4(CCC(C5)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)O)OC8C(C(C(CO8)O)O)O)OC9C(C(C(C(O9)CO)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)O)C)C)OC1(CCC(C)COC1C(C(C(C(O1)CO)O)O)O)O | 1377.50 | unknown | https://doi.org/10.1248/CPB.37.2741 |
| (2R,3R,4S,5S,6R)-2-[(2R)-4-[(1R,2S,4S,6S,7S,8R,9S,12S,13R,16S,18S,19R)-16-[(2R,3R,4R,5R,6R)-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,19-dihydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 162967157 | Click to see | 1261.40 | unknown | https://doi.org/10.1248/CPB.36.3659 |
| (2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5R,6R)-2-[(2R,3R,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S,18S,19R)-19-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | 13787750 | Click to see CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC(C6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(C(O9)CO)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)C)O)C)C)OC1 | 1081.20 | unknown | via CMAUP database |
| (2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5R,6R)-2-[(2R,3R,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,15R,16R,18S)-15-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | 101932450 | Click to see | 1081.20 | unknown | via CMAUP database |
| (2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5R,6R)-2-[(2R,3R,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1R,2S,4S,5'R,6S,7S,8R,9S,12S,13S,15R,16R,18S)-15-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | 162939076 | Click to see CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CC(C(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(CO9)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)O)C)C)C)OC1 | 1051.20 | unknown | https://doi.org/10.1248/CPB.37.2741 |
| (2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5R,6R)-2-[(2S,3R,4S,5R,6R)-2-[(2R,3R,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | 101826551 | Click to see | 1197.30 | unknown | https://doi.org/10.1248/CPB.37.2741 |
| (2S,5R)-2-[(2R,4S,6R)-5-hydroxy-6-(hydroxymethyl)-2-[(5'R,9S,13R,16S)-5',7,9,13-tetramethyl-6'-[(2S,4S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-4-[(2S,4S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 5320739 | Click to see CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)OC8C(C(C(C(O8)CO)O)O)O)OC9C(C(C(C(O9)C)O)O)O)C)C)C)OC1OC1C(C(C(C(O1)CO)O)O)O | 1063.20 | unknown | via CMAUP database |
| 2-[2-[4,5-dihydroxy-2-(hydroxymethyl)-6-[(1R,2S,4S,6R,8S,9S,12R,13S,18S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | 138115302 | Click to see | 1035.20 | unknown | https://doi.org/10.1248/CPB.37.2741 |
| 2-[4-Hydroxy-2-(hydroxymethyl)-6-[[(1S,2S,4S,7S,8R,9S,12S,13R,16S)-6-methoxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-16-yl]oxy]-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 6712585 | Click to see CC1C2C(CC3C2(CCC4C3CC=C5C4(CCC(C5)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)C)O)O)O)O)OC8C(C(C(C(O8)C)O)O)O)C)C)OC1(CCC(C)COC9C(C(C(C(O9)CO)O)O)O)OC | 1063.20 | unknown | via CMAUP database |
| 2-Hydroxyspirostan-3-yl 4-O-(2-O-hexopyranosyl-3-O-pentopyranosylhexopyranosyl)hexopyranoside | 496676 | Click to see CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CC(C(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(CO9)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)O)C)C)C)OC1 | 1051.20 | unknown | https://doi.org/10.1248/CPB.37.2741 |
| F-Gitonin | 44559009 | Click to see | 1051.20 | unknown | https://doi.org/10.1248/CPB.37.2741 |
| Protodegalactotigonin | 14464370 | Click to see | 1215.30 | unknown | https://doi.org/10.1248/CPB.37.2741 |
| Protoisoeruboside B | 73795908 | Click to see CC1C2C(CC3C2(CCC4C3CC(C5C4(CCC(C5)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)O)OC8C(C(C(C(O8)CO)O)O)O)OC9C(C(C(C(O9)CO)O)O)O)O)O)C)O)C)OC1(CCC(C)COC1C(C(C(C(O1)CO)O)O)O)O | 1261.40 | unknown | https://doi.org/10.1248/CPB.36.3659 |
| Sativoside R 1 | 14464372 | Click to see | 1377.50 | unknown | https://doi.org/10.1248/CPB.37.2741 |
| Sativoside R2 | 3474285 | Click to see | 1197.30 | unknown | https://doi.org/10.1248/CPB.37.2741 |
| > Mixed metal/non-metal compounds / Transition metal organides / Transition metal sulfides | |||||
| Cadmium Sulfide | 14783 | Click to see | 144.48 | unknown | via CMAUP database |
| > Nucleosides, nucleotides, and analogues / Purine nucleosides | |||||
| 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one | 6802 | Click to see | 283.24 | unknown | https://doi.org/10.1055/S-2006-961993 |
| Adenosine | 60961 | Click to see C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N | 267.24 | unknown | https://doi.org/10.1055/S-2006-961993 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives | |||||
| Acetic acid, (Z)- | 9904352 | Click to see CCN1C(=CC(=O)OCC)SC(C1=O)N2CCCCC2 | 298.40 | unknown | via CMAUP database |
| > 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/10.1016/0378-8741(96)01416-X |
| (2S)-2-ammoniopropanoate | 7311724 | Click to see | 89.09 | unknown | via CMAUP database |
| 2-Azaniumylpropanoate | 57383916 | Click to see | 89.09 | unknown | via CMAUP database |
| D-Alanine | 71080 | Click to see | 89.09 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| DL-Alanine-15N | 51283 | Click to see | 90.09 | unknown | via CMAUP database |
| L-Alanine | 5950 | Click to see | 89.09 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acid esters | |||||
| (2R)-2-azaniumyl-3-methoxy-3-oxopropane-1-thiolate | 1550140 | Click to see | 135.19 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids | |||||
| (2R)-2-azaniumyl-3-[(R)-prop-2-enylsulfinyl]propanoate | 51399533 | Click to see | 177.22 | unknown | https://doi.org/10.1002/HLCA.19480310140 |
| (Methylazaniumyl)acetate | 7311726 | Click to see | 89.09 | unknown | via CMAUP database |
| 2-Aminobutyric acid | 6657 | Click to see CCC(C(=O)O)N | 103.12 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| 2-Azaniumyl-3-[(2-azaniumyl-2-carboxylatoethyl)diselanyl]propanoate | 44123456 | Click to see | 334.11 | unknown | via CMAUP database |
| 2-Azaniumyl-3-methylsulfinylpropanoate | 25202909 | Click to see CS(=O)CC(C(=O)[O-])[NH3+] | 151.19 | unknown | via CMAUP database |
| 2-Azaniumyl-3-prop-2-enylsulfinylpropanoate | 44229092 | Click to see C=CCS(=O)CC(C(=O)[O-])[NH3+] | 177.22 | unknown | via CMAUP database |
| 3-(2-Propen-1-ylsulfinyl)alanine | 121922 | Click to see | 177.22 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3888727/ https://doi.org/10.1556/ABIOL.60.2009.4.10 |
| 3-(Methylseleno)alanine | 114835 | Click to see C[Se]CC(C(=O)O)N | 182.09 | unknown | via CMAUP database |
| 5-Methylthiomorpholine-3-carboxylic acid 1-oxide | 12305351 | Click to see CC1CS(=O)CC(N1)C(=O)O | 177.22 | unknown | https://doi.org/10.1271/BBB1961.54.163 |
| Alliin | 9576089 | Click to see | 177.22 | unknown | https://doi.org/10.1021/NP0503350 |
| alpha-Glycine | 5257127 | Click to see | 75.07 | unknown | via CMAUP database |
| Butanoic acid, 2-amino-4-(ethylseleno)- | 145924 | Click to see | 210.14 | unknown | via CMAUP database |
| DL-selenomethionine | 15103 | Click to see | 196.12 | unknown | https://doi.org/10.1021/JF00055A002 |
| Isoalliin | 5281112 | Click to see CC=CS(=O)CC(C(=O)O)N | 177.22 | unknown |
https://doi.org/10.1021/JF990938F https://doi.org/10.1016/0305-1978(95)00072-0 |
| Methiin | 9578071 | Click to see CS(=O)CC(C(=O)O)N | 151.19 | unknown | https://doi.org/10.1016/0031-9422(88)80108-0 |
| S-Methylcysteine sulfoxide | 82142 | Click to see CS(=O)CC(C(=O)O)N | 151.19 | unknown |
https://doi.org/10.1016/0305-1978(95)00072-0 https://doi.org/10.1016/0031-9422(88)80108-0 |
| S-propyl-L-cysteine sulfoxide | 87309 | Click to see | 179.24 | unknown | https://doi.org/10.1016/0031-9422(88)80108-0 |
| Seleno-l-methio-nine | 15820879 | Click to see | 196.12 | unknown | via CMAUP database |
| Selenocystathionine | 98223 | Click to see | 269.17 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids / D-alpha-amino acids | |||||
| (2R,3S)-2-amino-3-hydroxybutanoate | 6995277 | Click to see | 119.12 | unknown | via CMAUP database |
| (2S)-2-amino-3-butylsulfinylpropanoic acid | 102029208 | Click to see | 193.27 | unknown | via CMAUP database |
| D-Glutamine | 145815 | Click to see | 146.14 | unknown | via CMAUP database |
| D-ornithine | 71082 | Click to see C(CC(C(=O)O)N)CN | 132.16 | unknown | via CMAUP database |
| S-Allyl-L-cysteine sulfoxide | 15558642 | Click to see C=CCS(=O)CC(C(=O)O)N | 177.22 | unknown |
https://doi.org/10.1016/0305-1978(95)00072-0 https://doi.org/10.1055/S-2006-957805 https://doi.org/10.1021/JF00055A002 https://doi.org/10.1016/0031-9422(88)80108-0 https://doi.org/10.1271/BBB1961.49.1187 https://doi.org/10.1093/JAOAC/80.5.1052 https://doi.org/10.1271/BBB1961.54.163 https://doi.org/10.1055/S-2006-957569 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1402896/ https://doi.org/10.1016/S0021-9673(01)82125-7 https://doi.org/10.1016/0031-9422(93)85404-F https://doi.org/10.1271/BBB.57.162 https://doi.org/10.1021/JF0346758 https://doi.org/10.1021/NP50096A009 |
| S-Methylcysteine sulfoxide | 99483 | Click to see | 151.19 | unknown | via CMAUP database |
| > 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 | |||||
| (2R)-2-amino-3-[(R)-prop-2-enylsulfinyl]propanoic acid | 51399534 | Click to see C=CCS(=O)CC(C(=O)O)N | 177.22 | unknown | via CMAUP database |
| (2R)-2-amino-3-hydrosulfinylpropanoic acid | 49866839 | Click to see C(C(C(=O)O)N)S=O | 137.16 | unknown | via CMAUP database |
| (2R)-2-ammonio-3-(methylselanyl)propanoate | 45266674 | Click to see C[Se]CC(C(=O)[O-])[NH3+] | 182.09 | unknown | via CMAUP database |
| (2R)-2-azaniumyl-3-[(S)-methylsulfinyl]propanoate | 40528043 | Click to see | 151.19 | unknown | via CMAUP database |
| (2R)-2-azaniumyl-3-[(S)-prop-2-ene-1-sulfinyl]propanoate | 51380903 | Click to see C=CCS(=O)CC(C(=O)[O-])[NH3+] | 177.22 | unknown | via CMAUP database |
| (2R)-2-azaniumyl-3-prop-2-enylsulfinylpropanoate | 25200619 | Click to see C=CCS(=O)CC(C(=O)[O-])[NH3+] | 177.22 | unknown | via CMAUP database |
| (2S,3R)-2-azaniumyl-3-hydroxybutanoate | 6971019 | Click to see CC(C(C(=O)[O-])[NH3+])O | 119.12 | unknown | via CMAUP database |
| (2S)-5-amino-2-ammonio-5-oxopentanoate | 6992086 | Click to see | 146.14 | unknown | via CMAUP database |
| (3R,5S)-5-methyl-1-oxo-1,4-thiazinane-3-carboxylic acid | 91808874 | Click to see | 177.22 | unknown | via CMAUP database |
| [(1S)-5-amino-1-carboxypentyl]azanium | 24848423 | Click to see | 147.20 | unknown | via CMAUP database |
| 3-(allylsulphinyl)-L-alanine | 87310 | Click to see C=CCS(=O)CC(C(=O)O)N | 177.22 | unknown |
https://doi.org/10.1055/S-2006-957805 https://doi.org/10.1021/JF00055A002 https://doi.org/10.1016/0031-9422(88)80108-0 https://doi.org/10.1271/BBB1961.49.1187 https://doi.org/10.1271/BBB1961.54.163 https://doi.org/10.1055/S-2006-957569 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1402896/ https://doi.org/10.1016/S0021-9673(01)82125-7 https://doi.org/10.1016/0031-9422(93)85404-F https://doi.org/10.1271/BBB.57.162 https://doi.org/10.1021/JF0346758 https://doi.org/10.1021/NP50096A009 |
| 3-(Ethylsulfinyl)-L-alanine | 91820395 | Click to see CCS(=O)CC(C(=O)[O-])[NH3+] | 165.21 | unknown | via CMAUP database |
| 3-methylsulfinyl-L-alanine | 90659041 | Click to see | 151.19 | unknown | via CMAUP database |
| CID 88747248 | 88747248 | Click to see | 132.16 | unknown | via CMAUP database |
| Citrulline | 9750 | Click to see | 175.19 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| L-2,4-diaminobutyric acid | 134490 | Click to see C(CN)C(C(=O)O)N | 118.13 | unknown | via CMAUP database |
| L-Arginine | 6322 | Click to see | 174.20 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| L-Glutamine | 5961 | Click to see | 146.14 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| L-ornithine | 6262 | Click to see C(CC(C(=O)O)N)CN | 132.16 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| L-ornithinium(1+) | 59565831 | Click to see | 133.17 | unknown | via CMAUP database |
| L-ornithinium(2+) | 449468 | Click to see | 134.18 | unknown | via CMAUP database |
| L-Selenomethionine | 105024 | Click to see | 196.12 | unknown | via CMAUP database |
| L-threoninate | 5460797 | Click to see CC(C(C(=O)[O-])N)O | 118.11 | unknown | via CMAUP database |
| Lysine | 5962 | Click to see C(CCN)CC(C(=O)O)N | 146.19 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| Lysine zwitterion | 122198194 | Click to see | 146.19 | unknown | via CMAUP database |
| Propiin | 91819955 | Click to see | 179.24 | unknown | via CMAUP database |
| S-butanoyl-L-cysteine S-oxide | 91820237 | Click to see | 193.27 | unknown | via CMAUP database |
| Threonine | 6288 | Click to see CC(C(C(=O)O)N)O | 119.12 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Asparagine and derivatives | |||||
| (-)-Asparagine | 6267 | Click to see | 132.12 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| (2S)-4-amino-2-ammonio-4-oxobutanoate | 6992089 | Click to see | 132.12 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Aspartic acid and derivatives | |||||
| 2-Azaniumyl-4-hydroxy-4-oxobutanoate | 57397078 | Click to see | 133.10 | unknown | via CMAUP database |
| CID 44367445 | 44367445 | Click to see | 133.10 | unknown | via CMAUP database |
| D-Aspartic Acid | 83887 | Click to see | 133.10 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| L-Aspartic Acid | 5960 | Click to see | 133.10 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Glutamic acid and derivatives | |||||
| CID 57397101 | 57397101 | Click to see | 147.13 | unknown | via CMAUP database |
| CID 88747398 | 88747398 | Click to see | 147.13 | unknown | via CMAUP database |
| D-glutamic acid | 23327 | Click to see C(CC(=O)O)C(C(=O)O)N | 147.13 | unknown | via CMAUP database |
| L-Glutamic Acid | 33032 | Click to see | 147.13 | unknown |
https://doi.org/10.1021/JF00044A010 https://doi.org/10.1016/0378-8741(96)01416-X |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Histidine and derivatives | |||||
| (2S)-2-ammonio-3-(1H-imidazol-4-yl)propanoate | 6971009 | Click to see | 155.15 | unknown | via CMAUP database |
| Histidine | 6274 | Click to see C1=C(NC=N1)CC(C(=O)O)N | 155.15 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| Histidine- | 498056 | Click to see C1=C(NC=N1)CC(C(=O)O)N.[Cu] | 218.70 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Isoleucine and derivatives | |||||
| (2S,3R)-2-azaniumyl-3-methylpentanoate | 6950182 | Click to see CCC(C)C(C(=O)[O-])[NH3+] | 131.17 | unknown | via CMAUP database |
| (2S,3S)-2-ammonio-3-methylpentanoate | 7043901 | Click to see | 131.17 | unknown | via CMAUP database |
| 2-Ammonio-3-methylpentanoate | 57397079 | Click to see | 131.17 | unknown | via CMAUP database |
| D-isoleucine zwitterion | 6950183 | Click to see | 131.17 | unknown | via CMAUP database |
| l-Isoleucine | 6306 | Click to see CCC(C)C(C(=O)O)N | 131.17 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Leucine and derivatives | |||||
| CID 6950207 | 6950207 | Click to see | 131.17 | unknown | via CMAUP database |
| Leucine | 6106 | Click to see CC(C)CC(C(=O)O)N | 131.17 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| Leucine zwitterion | 7045798 | Click to see | 131.17 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Methionine and derivatives | |||||
| (2R)-2-ammonio-4-(methylsulfanyl)butanoate | 6992109 | Click to see CSCCC(C(=O)[O-])[NH3+] | 149.21 | unknown | via CMAUP database |
| (2S)-2-ammonio-4-(methylsulfanyl)butanoate | 6992087 | Click to see | 149.21 | unknown | via CMAUP database |
| 2-Azaniumyl-4-methylsulfanylbutanoate | 5255805 | Click to see CSCCC(C(=O)[O-])[NH3+] | 149.21 | unknown | via CMAUP database |
| D-Methionine | 84815 | Click to see CSCCC(C(=O)O)N | 149.21 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| L-methioninate | 5460892 | Click to see | 148.21 | unknown | via CMAUP database |
| Methionine | 6137 | Click to see CSCCC(C(=O)O)N | 149.21 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Phenylalanine and derivatives | |||||
| (2R)-2-ammonio-3-phenylpropanoate | 6919011 | Click to see C1=CC=C(C=C1)CC(C(=O)[O-])[NH3+] | 165.19 | unknown | via CMAUP database |
| D-Phenylalanine | 71567 | Click to see | 165.19 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| gamma-L-Glutamyl-L-phenylalanine | 111299 | Click to see | 294.30 | unknown | https://doi.org/10.1016/0031-9422(92)83283-5 |
| L-Phenylalanine, 23 | 57397115 | Click to see | 165.19 | unknown | via CMAUP database |
| Phenylalanine | 6140 | Click to see C1=CC=C(C=C1)CC(C(=O)O)N | 165.19 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Proline and derivatives | |||||
| (2S)-4-hydroxypyrrolidinium-2-carboxylate | 45266637 | Click to see | 131.13 | unknown | via CMAUP database |
| (2S)-pyrrolidinium-2-carboxylate | 6971047 | Click to see | 115.13 | unknown | via CMAUP database |
| 4-Hydroxypyrrolidinium-2-carboxylate | 5238478 | Click to see C1C(C[NH2+]C1C(=O)[O-])O | 131.13 | unknown | via CMAUP database |
| cis-4-Hydroxyproline | 6971054 | Click to see | 131.13 | unknown | via CMAUP database |
| D-proline | 8988 | Click to see C1CC(NC1)C(=O)O | 115.13 | unknown | via CMAUP database |
| DL-Proline | 614 | Click to see C1CC(NC1)C(=O)O | 115.13 | unknown | via CMAUP database |
| Proline | 145742 | Click to see C1CC(NC1)C(=O)O | 115.13 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| trans-hydroxy-L-proline | 6971053 | Click to see | 131.13 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Serine and derivatives | |||||
| (2R)-2-ammonio-3-hydroxypropanoate | 6857549 | Click to see C(C(C(=O)[O-])[NH3+])O | 105.09 | unknown | via CMAUP database |
| L-Serine | 5951 | Click to see | 105.09 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Tyrosine and derivatives | |||||
| (2R)-2-ammonio-3-(4-hydroxyphenyl)propanoate | 6919035 | Click to see | 181.19 | unknown | via CMAUP database |
| (2S)-2-ammonio-3-(4-hydroxyphenyl)propanoate | 6942100 | Click to see | 181.19 | unknown | via CMAUP database |
| L-Tyrosine | 6057 | Click to see | 181.19 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Valine and derivatives | |||||
| CID 88733505 | 88733505 | Click to see | 117.15 | unknown | via CMAUP database |
| D-Valine | 71563 | Click to see CC(C)C(C(=O)O)N | 117.15 | unknown | via CMAUP database |
| Valine | 6287 | Click to see CC(C)C(C(=O)O)N | 117.15 | unknown |
https://doi.org/10.1021/JF00044A010 https://doi.org/10.1016/0378-8741(96)01416-X |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Amino acids and derivatives / Beta amino acids and derivatives | |||||
| (3S)-3-azaniumyl-3-phenylpropanoate | 6921435 | Click to see | 165.19 | unknown | via CMAUP database |
| 3-Aminobutanoic acid | 10932 | Click to see CC(CC(=O)O)N | 103.12 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Cysteine and derivatives | |||||
| (+)-S-Allylcysteine | 9793905 | Click to see | 161.22 | unknown |
https://doi.org/10.3892/OR.2.5.787 https://doi.org/10.1002/PTR.2650030203 https://doi.org/10.1021/JF00055A002 |
| (2S)-2-azaniumyl-3-prop-2-enylsulfanylpropanoate | 36689185 | Click to see | 161.22 | unknown | via CMAUP database |
| 2-Amino-3-(prop-2-en-1-ylsulfanyl)propanoic acid | 25202793 | Click to see C=CCSCC(C(=O)[O-])[NH3+] | 161.22 | unknown | via CMAUP database |
| 2-Azaniumyl-3-((2-Azaniumyl-2-Carboxylatoethyl)Disulfanyl)Propanoate | 595 | Click to see | 240.30 | unknown | via CMAUP database |
| 2-Azaniumyl-3-methylsulfanylpropanoate | 25200522 | Click to see | 135.19 | unknown | via CMAUP database |
| 5-Allyl cystein | 23437571 | Click to see | 161.22 | unknown | via CMAUP database |
| D-Cystine | 6857538 | Click to see | 240.30 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| D-cystine zwitterion | 6991967 | Click to see | 240.30 | unknown | via CMAUP database |
| Npc275492 | 125198 | Click to see | 163.24 | unknown | via CMAUP database |
| > 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 | 240.30 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| (2R)-2-azaniumyl-3-(methylsulfanyl)propanoate | 7058174 | Click to see | 135.19 | unknown | via CMAUP database |
| (2R)-2-azaniumyl-3-[(prop-2-en-1-yl)sulfanyl]propanoate | 40424388 | Click to see | 161.22 | unknown | via CMAUP database |
| (2R)-2-azaniumyl-3-butylsulfanylpropanoate | 36690980 | Click to see | 177.27 | unknown | via CMAUP database |
| (2R)-2-azaniumyl-3-propylsulfanylpropanoate | 40565896 | Click to see | 163.24 | unknown | via CMAUP database |
| 3-(Methyldithio)-L-alanine | 3080775 | Click to see | 167.30 | unknown | via CMAUP database |
| L-cystine zwitterion | 6992103 | Click to see | 240.30 | unknown | via CMAUP database |
| S-allylmercapto-L-cysteine | 9794159 | Click to see | 193.30 | unknown | via CMAUP database |
| S-Ethylcysteine | 25203803 | Click to see CCSCC(C(=O)[O-])[NH3+] | 149.21 | unknown | via CMAUP database |
| S-Methyl-L-cysteine | 24417 | Click to see CSCC(C(=O)O)N | 135.19 | unknown | https://doi.org/10.1021/JF00055A002 |
| S-trans-1-propenyl-L-cysteine | 91820358 | Click to see | 161.22 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / N-acyl-alpha amino acids | |||||
| 2-[methyl-[(E)-octadec-9-enoyl]amino]acetic acid | 5879967 | Click to see | 353.50 | unknown | via CMAUP database |
| 2-Amino-5-[(1-carboxy-2-prop-1-enylsulfanylethyl)amino]-5-oxopentanoic acid | 25203227 | Click to see | 290.34 | unknown | https://doi.org/10.1016/0031-9422(92)83283-5 |
| L-N-Acetyl-3-(allylthio)alanine | 10465488 | Click to see | 203.26 | unknown | via CMAUP database |
| N-Acetyl-D-cysteine | 94364 | Click to see | 163.20 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / N-acyl-alpha amino acids / N-acyl-L-alpha-amino acids | |||||
| N-Acetyl-L-Cysteine | 12035 | Click to see | 163.20 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides | |||||
| Glutathione | 124886 | Click to see C(CC(=O)NC(CS)C(=O)NCC(=O)O)C(C(=O)O)N | 307.33 | unknown | https://doi.org/10.1271/BBB1961.54.163 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides / Dipeptides | |||||
| (S)-2-Amino-5-(((S)-1-carboxy-2-phenylethyl)amino)-5-oxopentanoic acid | 558649 | Click to see C1=CC=C(C=C1)CC(C(=O)O)NC(=O)CCC(C(=O)O)N | 294.30 | unknown | https://doi.org/10.1016/0031-9422(92)83283-5 |
| [1-[[1-[2-[4-(Diaminomethylideneamino)butylcarbamoyl]-6-hydroxy-2,3,3a,4,5,6,7,7a-octahydroindol-1-yl]-1-oxo-3-phenylpropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl] acetate | 76513880 | Click to see | 650.80 | unknown | https://doi.org/10.1055/S-2006-960087 |
| gamma-Glutamyl-S-1-propenyl cysteine | 87289205 | Click to see | 290.34 | unknown | https://doi.org/10.1016/0031-9422(92)83283-5 |
| gamma-Glutamyl-S-allylcysteine | 11346811 | Click to see | 290.34 | unknown |
https://doi.org/10.1055/S-2006-957805 https://doi.org/10.1016/0031-9422(92)83283-5 |
| gamma-glutamyl-S-allylmercaptocysteine | 101630431 | Click to see | 322.40 | unknown | https://doi.org/10.1016/0031-9422(92)83283-5 |
| L-gamma-Glutamyl-S-allylthio-L-cysteine | 131752387 | Click to see | 322.40 | unknown | https://doi.org/10.1016/0031-9422(92)83283-5 |
| L-gamma-Glutamyl-S-propyl-L-cysteine | 54090099 | Click to see | 292.35 | unknown | via CMAUP database |
| Methylseleno carboxyethylglutamine | 20807051 | Click to see C[Se]CC(C(=O)O)NC(=O)CCC(C(=O)O)N | 311.20 | unknown | via CMAUP database |
| Methylseleno carboxypropylglutamine | 16128830 | Click to see C[Se]CCC(C(=O)O)NC(=O)CCC(C(=O)O)N | 325.23 | unknown | via CMAUP database |
| N-gamma-Glutamyl-S-allylcysteine | 11193907 | Click to see C=CCSCC(C(=O)O)NC(=O)CCC(C(=O)O)N | 290.34 | unknown | https://doi.org/10.1016/0031-9422(92)83283-5 |
| N5-((R)-1-Carboxy-3-(methylthio)propyl)-L-glutamine | 87315837 | Click to see CSCCC(C(=O)O)NC(=O)CCC(C(=O)O)N | 278.33 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters / Enol esters | |||||
| [(1E)-2,6-dimethylhepta-1,5-dienyl] acetate | 24832062 | Click to see | 182.26 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Primary carboxylic acid amides | |||||
| 2-(Prop-2-enyldisulfanyl)acetamide | 25201750 | Click to see | 163.30 | unknown |
https://doi.org/10.1158/1535-7163.MCT-05-0152 https://doi.org/10.3892/IJMM.21.6.765 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acids | |||||
| Acetate | 175 | Click to see CC(=O)[O-] | 59.04 | unknown | via CMAUP database |
| Hydron;acetate | 21980959 | Click to see [H+].CC(=O)[O-] | 60.05 | unknown | via CMAUP database |
| > Organic acids and derivatives / Organic sulfonic acids and derivatives / Organosulfonic acids and derivatives / Organosulfonic acids | |||||
| Taurine | 1123 | Click to see | 125.15 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| > Organic acids and derivatives / Organic sulfuric acids and derivatives / Sulfuric acid esters / Sulfuric acid diesters | |||||
| (E)-2-Propenyl (3-(2-propenylthio)-2-propenyl) sulfate | 10977885 | Click to see | 250.30 | unknown | https://doi.org/10.1021/JF011182Z |
| Prop-2-enyl 3-prop-2-enylsulfanylprop-2-enyl sulfate | 85353315 | Click to see | 250.30 | unknown | https://doi.org/10.1021/JF011182Z |
| > Organic acids and derivatives / Organic thiosulfuric acids and derivatives / S-alkyl thiosulfates | |||||
| (z)-Allyl thiosulfate | 57507750 | Click to see | 194.30 | unknown | https://doi.org/10.1021/NP0503350 |
| 3-Sulfonatosulfanylprop-1-ene | 59479946 | Click to see | 153.20 | unknown | via CMAUP database |
| > Organic acids and derivatives / Seleninic acids and derivatives | |||||
| Methylselenic acid | 161597 | Click to see C[Se](=O)O | 127.01 | unknown | via CMAUP database |
| > Organic acids and derivatives / Thiosulfinic acid esters | |||||
| 3-[(S)-prop-2-enylsulfinyl]sulfanylprop-1-ene | 51380898 | Click to see | 162.30 | unknown | https://doi.org/10.1271/BBB.80482 |
| 3-Ethenyl-3,4-dihydrodithiine 1-oxide | 5315238 | Click to see | 160.30 | unknown | via CMAUP database |
| Allicin | 65036 | Click to see | 162.30 | unknown |
https://doi.org/10.1111/J.1600-0536.1996.TB02217.X https://doi.org/10.1055/S-2006-960118 https://doi.org/10.1016/S0003-2670(01)01104-7 https://doi.org/10.1093/INFDIS/156.1.243 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC180079/ https://doi.org/10.1055/S-2006-960969 https://doi.org/10.1271/BBB.80482 https://doi.org/10.1271/BBB1961.49.1187 https://doi.org/10.1055/S-2006-962811 https://doi.org/10.1055/S-2006-961482 https://doi.org/10.1093/CHROMSCI/32.3.93 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1402896/ https://doi.org/10.1021/JF00042A017 https://doi.org/10.1021/JF990938F https://doi.org/10.17660/ACTAHORTIC.2001.555.6 https://doi.org/10.1016/0049-3848(86)90025-3 https://doi.org/10.1271/BBB.61.1482 https://doi.org/10.1002/J.1537-2197.1994.TB15413.X https://doi.org/10.1007/BF02873666 https://doi.org/10.1089/JMF.1999.2.39 https://doi.org/10.1111/J.1440-1681.1995.TB02032.X https://doi.org/10.1002/(SICI)1099-1573(199606)10:4<329::AID-PTR826>3.0.CO;2-2 https://doi.org/10.1002/PTR.2650060310 https://doi.org/10.1016/S0021-9673(00)91342-6 https://doi.org/10.1016/S0944-7113(96)80043-2 https://doi.org/10.1055/S-2006-957439 https://doi.org/10.1007/BF02856491 |
| Me-SS(O)-Propenyl | 5319763 | Click to see | 136.20 | unknown | via CMAUP database |
| Methyl methanethiosulfinate | 95200 | Click to see | 110.20 | unknown | via CMAUP database |
| S-2-Propenyl methanesulfinothioate | 20216915 | Click to see CS(=O)SCC=C | 136.20 | unknown | https://doi.org/10.1021/NP0503350 |
| S-Methyl 2-propene-1-sulfinothioate | 5319504 | Click to see | 136.20 | unknown | via CMAUP database |
| > Organic nitrogen compounds / Organonitrogen compounds / Organic cyanides / Nitriles | |||||
| 7-(Methylthio)heptanenitrile | 5319789 | Click to see | 157.28 | unknown | via CMAUP database |
| > Organic nitrogen compounds / Organonitrogen compounds / Quaternary ammonium salts / Tetraalkylammonium salts | |||||
| Tetraethylammonium Chloride | 5946 | Click to see | 165.70 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organic oxoanionic compounds / Organic thiosulfates | |||||
| Hydroxy-oxo-prop-2-enoxy-sulfanylidene-lambda6-sulfane | 11469380 | Click to see | 154.21 | unknown | https://doi.org/10.1271/BBB.67.1594 |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Primary alcohols | |||||
| Allyl Alcohol | 7858 | Click to see | 58.08 | unknown | via CMAUP database |
| Ethanol | 702 | Click to see | 46.07 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols | |||||
| Isopropyl Alcohol | 3776 | Click to see CC(C)O | 60.10 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / C-glycosyl compounds | |||||
| 3,6-bis(hydroxymethyl)-3-[(2S,3R,4S,5R,6R)-2,3,4,5-tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]-1,4-dioxane-2,5-dione | 129628330 | Click to see | 354.26 | unknown | https://doi.org/10.1271/BBB1961.49.1187 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds | |||||
| Digalactosyl diglyceride | 102565455 | Click to see | 458.50 | unknown | https://doi.org/10.1271/BBB1961.49.1187 |
| Sucrose | 5988 | Click to see | 342.30 | unknown | https://doi.org/10.1002/PTR.2650070514 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides | |||||
| 7-O-Methylaloesin | 5319505 | Click to see CC1=CC(=C(C2=C1C(=O)C=C(O2)CC(=O)C)C3C(C(C(C(O3)CO)O)O)O)OC | 408.40 | unknown | via CMAUP database |
| Eugenol gentiobioside | 10390778 | Click to see | 488.50 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Oligosaccharides | |||||
| Acemananan | 72041 | Click to see | 1691.50 | unknown | via CMAUP database |
| Beta-Glucan | 439262 | Click to see | 504.40 | unknown | via CMAUP database |
| Gal(a1-6)D-Ido(a1-6)Glc(a1-2b)Psif | 132990894 | Click to see | 666.60 | unknown | https://doi.org/10.1002/PTR.2650070514 |
| Glc(a1-4)L-Glc(a1-4)L-Glc | 134731361 | Click to see | 504.40 | unknown | https://doi.org/10.1002/PTR.2650070514 |
| GlyTouCan:G94390VI | 871 | Click to see | 504.40 | unknown | https://doi.org/10.1002/PTR.2650070514 |
| Raffinose | 439242 | Click to see | 504.40 | unknown | https://doi.org/10.1002/PTR.2650070514 |
| Stachyose | 439531 | Click to see | 666.60 | unknown | https://doi.org/10.1002/PTR.2650070514 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives / Glucuronic acid derivatives | |||||
| alpha-D-GALACTURONIC ACID | 445929 | Click to see | 194.14 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Alpha-hydrogen aldehydes | |||||
| 3-(Methylthio)propionaldehyde | 18635 | Click to see CSCCC=O | 104.17 | unknown | via CMAUP database |
| Pentanal | 8063 | Click to see | 86.13 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Short-chain aldehydes | |||||
| Acetaldehyde | 177 | Click to see | 44.05 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated aldehydes / Enals | |||||
| (E)-3-(prop-2-enyldisulfanyl)prop-2-enal | 5317516 | Click to see C=CCSSC=CC=O | 160.30 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones | |||||
| 2-Methyldodecan-5-one | 5319599 | Click to see CCCCCCCC(=O)CCC(C)C | 198.34 | unknown | via CMAUP database |
| Acetone | 180 | Click to see | 58.08 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Enols | |||||
| 1-Propen-2-ol | 141483 | Click to see | 58.08 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Chromones | |||||
| Isoeugenitol | 5318562 | Click to see | 206.19 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Benzopyrans / 2-benzopyrans | |||||
| 8-hydroxy-7-methoxy-3-methyl-1H-isochromen-4-one | 71455856 | Click to see CC1C(=O)C2=C(CO1)C(=C(C=C2)OC)O | 208.21 | unknown | https://doi.org/10.1055/S-2006-960087 |
| > Organoheterocyclic compounds / Diazines / Pyrimidines and pyrimidine derivatives / Aminopyrimidines and derivatives | |||||
| Allithiamine | 3037212 | Click to see | 354.50 | unknown | via CMAUP database |
| N-[(4-amino-2-methylpyrimidin-5-yl)methyl]-N-[(E)-2-(ethenyldisulfanyl)-4-hydroxybut-1-enyl]formamide | 5458875 | Click to see CC1=NC=C(C(=N1)N)CN(C=C(CCO)SSC=C)C=O | 326.40 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides | |||||
| 2(5H)-Furanone, 4-bromo-5-(bromomethylene)-, (5Z)- | 10131246 | Click to see C1=C(C(=CBr)OC1=O)Br | 253.88 | unknown | via CMAUP database |
| L-Ascorbic Acid | 54670067 | Click to see | 176.12 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Dithianes | |||||
| 1,3-Dithiane | 10451 | Click to see | 120.20 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Dithiins | |||||
| 1,2-Dithiin | 12044565 | Click to see C1=CSSC=C1 | 116.20 | unknown | via CMAUP database |
| 2-Vinyl-(4H)-1,3-dithiin | 133337 | Click to see | 144.30 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Dithiolanes / 1,2-dithiolanes | |||||
| 1,2-Dithiolane | 79045 | Click to see | 106.21 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Dithioles / 1,2-dithioles | |||||
| 3-Methyl-3H-1,2-dithiole | 5319598 | Click to see | 118.20 | unknown | via CMAUP database |
| 4-Methyl-1,2-dithiacyclopentene | 5319597 | Click to see | 118.20 | unknown | via CMAUP database |
| 5-methyl-3H-dithiole | 5319596 | Click to see CC1=CCSS1 | 118.20 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Heteroaromatic compounds | |||||
| 2-Ethylthiophene | 13388 | Click to see | 112.19 | unknown | via CMAUP database |
| 2-Vinylthiophene | 519642 | Click to see C=CC1=CC=CS1 | 110.18 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Indoles and derivatives / Indolyl carboxylic acids and derivatives | |||||
| (2S)-2-ammonio-3-(1H-indol-3-yl)propanoate | 6923516 | Click to see | 204.22 | unknown | via CMAUP database |
| D-Tryptophan | 9060 | Click to see | 204.22 | unknown | via CMAUP database |
| Tryptophan | 6305 | Click to see C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)N | 204.22 | unknown | https://doi.org/10.1016/0378-8741(96)01416-X |
| > Organoheterocyclic compounds / Indoles and derivatives / Pyrroloindoles | |||||
| Alline | 73124019 | Click to see | 190.24 | unknown | https://doi.org/10.1016/S0944-7113(96)80043-2 |
| > Organoheterocyclic compounds / Indoles and derivatives / Tryptamines and derivatives | |||||
| N,N-Dimethyltryptamine | 6089 | Click to see | 188.27 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Isoindoles and derivatives / Isoindolines / Isoindolones | |||||
| (2E)-(2-Ethyl-3-oxo-2,3-dihydro-1H-isoindol-1-ylidene)acetaldehyde | 11735809 | Click to see | 201.22 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyrans / Pyranones and derivatives | |||||
| Allixin | 86374 | Click to see CCCCCC1=C(C(=O)C(=C(O1)C)OC)O | 226.27 | unknown |
https://doi.org/10.1248/CPB.37.1656 https://doi.org/10.1248/CPB.50.405 https://doi.org/10.1016/S0024-3205(97)00687-5 |
| > Organoheterocyclic compounds / Pyridines and derivatives / Hydroxypyridines | |||||
| 6-(Hydroxymethyl)pyridin-3-ol | 419490 | Click to see C1=CC(=NC=C1O)CO | 125.13 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyridines and derivatives / Methylpyridines | |||||
| Vitamin B6 | 104817 | Click to see | 231.14 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyridines and derivatives / Pyridine carboxaldehydes / Pyridoxals and derivatives | |||||
| Pyridoxal | 1050 | Click to see | 167.16 | unknown | via CMAUP database |
| Pyridoxal 5'-phosphate | 1051 | Click to see | 247.14 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyridines and derivatives / Pyridoxamines / Pyridoxamine 5-phosphates | |||||
| CID 11205997 | 11205997 | Click to see | 168.19 | unknown | via CMAUP database |
| Pyridoxamine phosphate | 1053 | Click to see CC1=NC=C(C(=C1O)CN)COP(=O)(O)O | 248.17 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyridines and derivatives / Pyridoxines | |||||
| [3-Hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methyloxidanium;chloride | 88396073 | Click to see CC1=NC=C(C(=C1O)C[OH2+])CO.[Cl-] | 205.64 | unknown | via CMAUP database |
| Pyridoxine | 1054 | Click to see | 169.18 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyridines and derivatives / Pyridoxines / Pyridoxine-5-phosphates | |||||
| Pyridoxine 5'-phosphate | 1055 | Click to see | 249.16 | unknown | via CMAUP database |
| Pyridoxine 5'-phosphate(2-) | 24794348 | Click to see | 247.14 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Trithiolanes | |||||
| 3,5-Diethyl-1,2,4-trithiolane | 520895 | Click to see | 180.40 | unknown | via CMAUP database |
| cis-3,5-Diethyl-1,2,4-trithiolane | 6431294 | Click to see CCC1SC(SS1)CC | 180.40 | unknown | via CMAUP database |
| trans-3,5-Diethyl-1,2,4-trithiolane | 6432398 | Click to see CCC1SC(SS1)CC | 180.40 | unknown | via CMAUP database |
| > Organometallic compounds / Organometalloid compounds / Organoselenium compounds / Selenoethers | |||||
| Dimethyl selenide | 11648 | Click to see C[Se]C | 109.04 | unknown | via CMAUP database |
| > Organosulfur compounds | |||||
| [(E)-but-2-enyl]-hydroxy-sulfanylidene-lambda4-sulfane | 88354352 | Click to see CC=CCS(=S)O | 136.20 | unknown |
https://doi.org/10.1055/S-2006-960087 https://doi.org/10.1021/NP50074A014 |
| Allyl trans-1-propenethiosulfinate | 129826834 | Click to see | 162.30 | unknown | https://doi.org/10.1021/NP50074A014 |
| Methyl trans-1-propenethiosulfinate | 129826759 | Click to see CC=CS(=S)OC | 136.20 | unknown | https://doi.org/10.1021/NP50074A014 |
| Methyl-prop-2-enoxy-sulfanylidene-lambda4-sulfane | 10285798 | Click to see | 136.20 | unknown |
https://doi.org/10.1055/S-2006-960118 https://doi.org/10.1055/S-2006-960087 |
| Prop-2-enoxy-propyl-sulfanylidene-lambda4-sulfane | 54041381 | Click to see CCCS(=S)OCC=C | 164.30 | unknown | https://doi.org/10.1055/S-2006-960087 |
| > Organosulfur compounds / Allyl sulfur compounds | |||||
| 1-(Prop-2-enyldisulfanyl)prop-1-ene | 529761 | Click to see | 146.30 | unknown | https://doi.org/10.1016/0021-9673(94)80162-2 |
| 3-(Propylthio)propene | 98781 | Click to see | 116.23 | unknown | https://doi.org/10.1021/JF9803076 |
| Allyl Mercaptan | 13367 | Click to see | 74.15 | unknown | via CMAUP database |
| Allyl methyl disulfide | 62434 | Click to see | 120.20 | unknown |
https://doi.org/10.1055/S-2007-969089 https://doi.org/10.1021/JF00059A033 https://doi.org/10.1016/0021-9673(94)80162-2 https://doi.org/10.1021/JF00025A008 https://doi.org/10.1021/JF9803076 |
| Allyl methyl sulfide | 66282 | Click to see | 88.17 | unknown | via CMAUP database |
| Allyl methyl tetrasulfide | 525329 | Click to see | 184.40 | unknown | via CMAUP database |
| Allyl pentasulfide | 10131025 | Click to see | 242.50 | unknown | https://doi.org/10.1055/S-2006-961517 |
| Allyl prop-1-enyl disulfide | 5352855 | Click to see CC=CSSCC=C | 146.30 | unknown | https://doi.org/10.1016/0021-9673(94)80162-2 |
| Allyl propyl disulfide | 16591 | Click to see CCCSSCC=C | 148.30 | unknown | https://doi.org/10.1021/JF00059A033 |
| Di-2-propenyl heptasulfide | 53854515 | Click to see C=CCSSSSSSSCC=C | 306.60 | unknown | https://doi.org/10.1055/S-2006-961517 |
| Diallyl disulfide | 16590 | Click to see C=CCSSCC=C | 146.30 | unknown |
https://doi.org/10.1111/J.1365-2621.1985.TB13047.X https://doi.org/10.1007/S10495-006-0024-X https://doi.org/10.1021/JF00034A054 https://doi.org/10.1111/J.1600-0536.1996.TB02217.X https://doi.org/10.1099/0022-1317-50-7-646 https://doi.org/10.1016/S0944-7113(00)80010-0 https://doi.org/10.1002/CNCR.22888 https://doi.org/10.1002/PTR.2650020310 https://doi.org/10.1016/0021-9673(94)80162-2 https://doi.org/10.1002/TOX.20737 https://doi.org/10.1158/1535-7163.MCT-05-0152 https://doi.org/10.1021/NP0503350 https://doi.org/10.1271/BBB.61.1482 https://doi.org/10.1021/JF00059A033 https://doi.org/10.1055/S-2007-969089 https://doi.org/10.1016/S0021-9673(00)91342-6 https://doi.org/10.1021/JF9803076 https://doi.org/10.1021/JF0346758 |
| Diallyl hexasulfide | 9882013 | Click to see C=CCSSSSSSCC=C | 274.50 | unknown | https://doi.org/10.1055/S-2006-961517 |
| Diallyl Sulfide | 11617 | Click to see | 114.21 | unknown |
https://doi.org/10.1007/S10495-006-0024-X https://doi.org/10.1099/0022-1317-50-7-646 https://doi.org/10.1002/CNCR.22888 https://doi.org/10.1016/0021-9673(94)80162-2 https://doi.org/10.1002/TOX.20737 https://doi.org/10.1007/BF00416666 https://doi.org/10.1016/0378-4274(92)90288-U https://doi.org/10.1021/JF00059A033 https://doi.org/10.1021/JF00025A008 https://doi.org/10.1055/S-2007-969089 https://doi.org/10.1016/J.FCT.2003.08.015 https://doi.org/10.1016/S0021-9673(00)91342-6 https://doi.org/10.1021/JF9803076 https://doi.org/10.1080/01635589109514116 https://doi.org/10.1002/ARDP.18922300604 |
| Diallyl tetrasulfide | 75552 | Click to see C=CCSSSSCC=C | 210.40 | unknown |
https://doi.org/10.1055/S-2006-961517 https://doi.org/10.1099/0022-1317-50-7-646 https://doi.org/10.1021/NP0503350 |
| Ethyl 2-propenesulfinate | 6366717 | Click to see | 134.20 | unknown | https://doi.org/10.1021/JF00025A008 |
| Methyl 2-propenyl pentasulfide | 528713 | Click to see CSSSSSCC=C | 216.40 | unknown | via CMAUP database |
| Methyl allyl thiosulfinate | 129712276 | Click to see COS(=O)SCC=C | 152.20 | unknown | https://doi.org/10.1055/S-2006-960118 |
| Npc247380 | 5352907 | Click to see | 146.30 | unknown | via CMAUP database |
| Prop-2-enyl-propoxy-sulfanylidene-lambda4-sulfane | 163192642 | Click to see CCCOS(=S)CC=C | 164.30 | unknown | https://doi.org/10.1055/S-2006-960087 |
| > Organosulfur compounds / Organic disulfides | |||||
| 3-Vinyl-4H-1,2-dithiin | 150636 | Click to see | 144.30 | unknown | via CMAUP database |
| Dipropenyldisulfid | 171311 | Click to see | 146.30 | unknown | https://doi.org/10.1016/0021-9673(94)80162-2 |
| Disulfide, di-1-propenyl | 6428452 | Click to see | 146.30 | unknown | https://doi.org/10.1016/0021-9673(94)80162-2 |
| Methyl propenyl disulfide | 5366552 | Click to see | 120.20 | unknown | https://doi.org/10.1016/0021-9673(94)80162-2 |
| > Organosulfur compounds / Organic disulfides / Dialkyldisulfides | |||||
| Diisopropyl disulfide | 77932 | Click to see | 150.30 | unknown | via CMAUP database |
| Dimethyl Disulfide | 12232 | Click to see | 94.20 | unknown | via CMAUP database |
| Dipropyl disulfide | 12377 | Click to see | 150.30 | unknown | https://doi.org/10.1002/PTR.4725 |
| Methyl propyl disulfide | 16592 | Click to see | 122.30 | unknown | via CMAUP database |
| > Organosulfur compounds / Organic trisulfides | |||||
| 1-(Prop-2-enyltrisulfanyl)prop-1-ene | 529905 | Click to see | 178.30 | unknown | https://doi.org/10.1021/JF9803076 |
| 6-ethenyl-4H-trithiine | 5315241 | Click to see C=CC1=CCSSS1 | 162.30 | unknown | via CMAUP database |
| Diallyl trisulfide | 16315 | Click to see C=CCSSSCC=C | 178.30 | unknown |
https://doi.org/10.1080/01635589709514617 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4320349/ https://doi.org/10.1099/0022-1317-50-7-646 https://doi.org/10.1016/S0944-7113(00)80010-0 https://doi.org/10.1002/PTR.2650020310 https://doi.org/10.1016/0021-9673(94)80162-2 https://doi.org/10.1002/TOX.20737 https://doi.org/10.1055/S-2006-961517 https://doi.org/10.1271/BBB.61.1482 https://doi.org/10.1021/JF00059A033 https://doi.org/10.1021/JF00025A008 https://doi.org/10.1055/S-2007-969089 https://doi.org/10.1016/S0021-9673(00)91342-6 https://doi.org/10.4161/CBT.8.22.9882 https://doi.org/10.1021/JF9803076 https://doi.org/10.1016/0049-3848(83)90027-0 |
| Dimethyl trisulfide | 19310 | Click to see CSSSC | 126.30 | unknown | via CMAUP database |
| Methyl propyl trisulfide | 5319765 | Click to see | 154.30 | unknown | via CMAUP database |
| Methylallyl trisulfide | 61926 | Click to see | 152.30 | unknown |
https://doi.org/10.1055/S-2007-969089 https://doi.org/10.1021/JF9803076 https://doi.org/10.1021/JF00025A008 https://doi.org/10.1016/0021-9673(94)80162-2 |
| > Organosulfur compounds / Sulfenyl compounds | |||||
| Dimethyl tetrasulfide | 79828 | Click to see CSSSSC | 158.30 | unknown | via CMAUP database |
| Dipropyl tetrasulfide | 104285 | Click to see | 214.40 | unknown | via CMAUP database |
| > Organosulfur compounds / Sulfonyls | |||||
| S-2-Propenyl 2-propene-1-sulfonothioate | 85776791 | Click to see C=CCSS(=O)(=O)CC=C | 178.30 | unknown | https://doi.org/10.1021/JF011182Z |
| > Organosulfur compounds / Sulfonyls / Sulfones | |||||
| (E)-3-(prop-2-enyldisulfanyl)-1-prop-2-enylsulfonylprop-1-ene | 5322033 | Click to see | 250.40 | unknown | via CMAUP database |
| > Organosulfur compounds / Sulfoxides | |||||
| (E)-1-(prop-2-enyldisulfanyl)-3-[(R)-prop-2-enylsulfinyl]prop-1-ene | 76962524 | Click to see | 234.40 | unknown | https://doi.org/10.1248/CPB.59.1340 |
| (Z)-1-(prop-2-enyldisulfanyl)-3-[(R)-prop-2-enylsulfinyl]prop-1-ene | 76960957 | Click to see | 234.40 | unknown | via CMAUP database |
| (Z)-Ajoene | 9881148 | Click to see | 234.40 | unknown | https://doi.org/10.1271/BBB.62.1014 |
| 4,5,9-Trithiadodeca-1,6,11-triene 9-oxide | 72373 | Click to see | 234.40 | unknown | https://doi.org/10.1248/CPB.59.1340 |
| Ajoene | 5386591 | Click to see | 234.40 | unknown |
https://doi.org/10.1271/BBB.62.1014 https://doi.org/10.1080/01635589109514116 |
| Z-4,9-Diene-2,3,7-trithiadeca-7-oxide | 5316672 | Click to see CSSC=CCS(=O)CC=C | 208.40 | unknown | via CMAUP database |
| > Organosulfur compounds / Thioacetals / Dithioacetals | |||||
| 1,3-Dithiole | 5316944 | Click to see | 104.20 | unknown | via CMAUP database |
| > Organosulfur compounds / Thioethers / Dialkylthioethers | |||||
| Di((2H3)methyl) sulphide | 2724139 | Click to see CSC | 68.17 | unknown | via CMAUP database |
| Dimethyl Sulfide | 1068 | Click to see | 62.14 | unknown | via CMAUP database |
| Propyl sulfide | 8118 | Click to see | 118.24 | unknown | via CMAUP database |
| > Organosulfur compounds / Thioethers / Thioenol ethers | |||||
| Ethene, 1,1'-thiobis- | 12321 | Click to see | 86.16 | unknown | via CMAUP database |
| Ethyl Vinyl Sulfide | 12320 | Click to see | 88.17 | unknown | via CMAUP database |
| > Organosulfur compounds / Thiols / Alkylthiols | |||||
| Propyl mercaptan | 7848 | Click to see | 76.16 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids | |||||
| Dihydrodehydroconiferyl alcohol, (7R,8S)-(-)- | 5274623 | Click to see COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)CCCO | 360.40 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives | |||||
| N-Trans-Feruloyloctopamine | 24096391 | Click to see | 329.30 | unknown | https://doi.org/10.1021/JF034791A |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids | |||||
| Caffeic Acid | 689043 | Click to see | 180.16 | unknown | via CMAUP database |
| cis-Caffeic acid | 1549111 | Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O | 180.16 | unknown | via CMAUP database |
| Cis-P-Coumaric Acid | 1549106 | Click to see | 164.16 | unknown | via CMAUP database |
| Ferulic Acid | 445858 | Click to see | 194.18 | unknown | https://doi.org/10.1021/JF034791A |
| P-Coumaric Acid | 637542 | Click to see | 164.16 | unknown | https://doi.org/10.1021/JF034791A |
| Sinapinic acid | 1549091 | Click to see | 224.21 | unknown | via CMAUP database |
| Sinapinic acid | 637775 | Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)O | 224.21 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Coumarins and derivatives / Pyranocoumarins / Angular pyranocoumarins | |||||
| rac Dihydro Samidin | 2841560 | Click to see | 388.40 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones | |||||
| Apigenin-7-olate | 25200950 | Click to see | 269.23 | unknown | via CMAUP database |
| Kaempferol oxoanion | 25202062 | Click to see | 285.23 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols | |||||
| Kaempferol | 5280863 | Click to see | 286.24 | unknown | via CMAUP database |
| Quercetin | 5280343 | Click to see | 302.23 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-3-O-glycosides | |||||
| 3-[(2S,3R,4S,5R,6S)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3-oxopropanoic acid | 163187832 | Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)OC(=O)CC(=O)O)O)O)O)O)O | 535.40 | unknown | https://doi.org/10.1016/S0308-8146(96)00116-1 |
| 3-[[(2R,3S,4R,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid | 154496402 | Click to see | 535.40 | unknown | https://doi.org/10.1016/S0308-8146(96)00116-1 |
| Chrysanthemin | 44256715 | Click to see | 449.40 | unknown | https://doi.org/10.1016/S0308-8146(96)00116-1 |
| Cyanidin 3-(3'',6''-dimalonylglucoside) | 23724697 | Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)COC(=O)CC(=O)O)O)OC(=O)CC(=O)O)O)O)O)O)O | 621.50 | unknown | https://doi.org/10.1016/S0308-8146(96)00116-1 |
| Kuromanin | 441667 | Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O | 449.40 | unknown | https://doi.org/10.1016/S0308-8146(96)00116-1 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides | |||||
| Npc235751 | 44259441 | Click to see | 464.40 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Isoflavonoids / Pyranoisoflavonoids | |||||
| 3-(4-Hydroxyphenyl)-5-methoxy-8,8-dimethylpyrano[2,3-h]chromen-4-one | 10545788 | Click to see | 350.40 | unknown | https://doi.org/10.1055/S-2006-960087 |
| > Phenylpropanoids and polyketides / Macrolactams | |||||
| Desferrioxamine X5 | 85625752 | Click to see | 598.70 | unknown | https://doi.org/10.1271/BBB1961.49.1187 |
| > Phenylpropanoids and polyketides / Ochratoxins and related substances | |||||
| N-(5-Chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carbonyl)phenylalanine | 4580 | Click to see | 403.80 | unknown | via CMAUP database |
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