Ziziphus jujuba
Details Top
| Internal ID | UUID643ffbeeda9a1756381525 |
| Scientific name | Ziziphus jujuba |
| Authority | Mill. |
| First published in | Gard. Dict. ed. 8 : n.º 1 (1768) |
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.
Ziziphus jujuba, commonly called jujube, has a long history of use as an infusion and decoction in East Asian traditional medicine. In China, the dried fruit is steeped to produce a calming tea that is said to nourish the spleen and calm the mind; this practice is documented in the Chinese Pharmacopoeia (2020) and in Li et al. (2015). Korean herbalists prepare a decoction of the fruit and seeds to treat insomnia and digestive upset, a method described in the Korean Traditional Medicine Journal (2018). In Japan, the fruit is macerated in alcohol to make a tincture used for its mild sedative and anti‑inflammatory properties, as reported by Nakamura and colleagues (2019). In addition, the leaves of the plant are ground into a poultice for external application to reduce swelling and promote wound healing, a technique noted in the ethnobotanical survey of the Hakka people of southern China (Wang et al., 2017).
A simple, safe recipe for a jujube tea is as follows: take 5 g of dried, sliced fruit and place it in a cup. Pour 200 ml of hot water (not boiling, about 90 °C) over the fruit and let steep for 10 minutes. Strain and drink the tea once or twice daily. This preparation is suitable for most adults, but pregnant women should avoid large quantities because the fruit contains compounds that may stimulate uterine contractions; consult a healthcare provider before use. The tea can be sweetened with a small amount of honey or stevia if desired.
The therapeutic effects of jujube are largely attributed to its well‑characterized phytochemical profile. The fruit contains saponins, flavonoids (such as quercetin and kaempferol), polysaccharides, and triterpenoids, all of which have been shown to possess antioxidant, anti‑inflammatory, and neuroprotective activities. Vitamin C and potassium are also present in appreciable amounts, contributing to the fruit’s nutritional value. These constituents provide a plausible biochemical basis for the calming, digestive, and wound‑healing properties reported in traditional use.
Modern research continues to explore jujube’s potential. Recent in‑vitro and animal studies confirm its antioxidant capacity and suggest benefits for sleep quality and metabolic health. Commercially, jujube extracts and dried fruit are available as dietary supplements and functional foods in many countries, and the plant remains a staple in contemporary herbal practice across East Asia.
General Uses Top
Suggest a correction!Common products:
- Dried jujube fruit (jujube), sold as a snack, used in confectionery, dried fruit blends, and as a natural sweetener in baked goods.
- Jujube fruit juice, used in beverages, jujube tea, jujube wine, jujube syrup, and as a flavoring in sauces.
- Jujube seed oil, extracted from seeds, used in cosmetics as a moisturizing agent, in hair care products, and as a base oil in fragrance formulations.
Food and beverages (non‑medicinal):
- Dried jujube fruit is consumed as a snack, incorporated into Chinese pastries, jujube candy, jujube jam, and jujube flour for baking and noodle production.
- Fresh jujube fruit juice is used in jujube tea, jujube wine, jujube syrup, and as a natural sweetener in fruit preserves and jujube jelly.
- Jujube pulp and seeds are used in fruit preserves, jujube jam, jujube jelly, and jujube‑based confectionery.
Fragrance and cosmetics:
- Jujube seed oil, rich in oleic, linoleic, and palmitic acids, and tocopherols, is used in skin‑care products, moisturizers, hair conditioners, and fragrance formulations as an emollient base oil.
Properties relevant to use:
- The fruit contains high levels of reducing sugars (glucose, fructose) and organic acids (citric, malic), providing natural sweetness and preservative properties for food products.
- The seed oil has a high unsaturated fatty acid content and a saponification value of ~200 mg KOH g⁻¹, making it suitable for emulsification in cosmetic formulations.
- Dried fruit has a moisture content below 10 %, high dietary fiber, and a low water activity, enabling shelf‑stable snack production.
- The oil’s tocopherol content confers antioxidant stability, extending the shelf life of cosmetic products.
Standards and regulation:
- Food products containing jujube fruit or derivatives must comply with national food safety regulations (e.g., FDA, EFSA) and labeling requirements for fruit and fruit products.
- Cosmetic ingredients derived from jujube seed oil must meet the EU Cosmetics Regulation 1223/2009, including safety assessment and ingredient labeling.
- Seed oil used in food or cosmetics must be certified as food‑grade or cosmetic‑grade, respectively, and meet purity standards set by relevant authorities.
Sustainability and sourcing:
- Ziziphus jujuba is cultivated in temperate regions such as China, Korea, Japan, Turkey, and the United States, with practices that include integrated pest management and minimal pesticide use.
- Harvesting of fruit and seeds can be performed without damaging the trees, allowing for continuous production and reducing the need for replanting.
- Dried fruit production often employs low‑energy drying methods (solar, mechanical) and efficient packaging to reduce the carbon footprint.
- Seed oil extraction uses cold‑press or solvent‑free techniques, preserving the oil’s natural composition and minimizing environmental impact.
Synonyms Top
| Scientific name | Authority | First published in |
|---|---|---|
| Jububa mediterranea | Bubani | Fl. Pyren. 1: 376 (1897) |
| Ziziphus sativa | Gaertn. | Fruct. Sem. Pl. 1: 202 (1788) |
| Ziziphus officinarum | Medik. | Bot. Beob. 1782 : 333 (1783) |
| Ziziphus nitida | Roxb. | Fl. Ind. 2: 358 (1824) |
| Ziziphus poiretii | G.Don | Gen. Hist. 2: 26. 1832 [Oct 1832] |
| Ziziphus melanogona | Bojer | Hortus Maurit. : 69 (1837) |
| Ziziphus trinervia | Roth | Nov. Pl. Sp. 168. 1821 [Apr 1821] |
| Ziziphus sinensis | Lam. | Encycl. 3: 317 (1789) |
| Ziziphus soporifera | (Lour.) Stokes | Bot. Mat. Med. 1: 433 (1812) |
| Ziziphus sororia | Roem. & Schult. | Syst. Veg., ed. 15 bis 5: 337 (1819) |
| Zizyphon jujubum | St.-Lag. | Ann. Soc. Bot. Lyon 7: 70 (1880) |
| Ziziphus vulgaris | Lam. | Encycl. 3: 316 (1789) |
| Ziziphus zizyphus | (L.) H.Karst. | Deut. Fl. : 870 (1882) |
| Ziziphus chinensis | Spreng. | Syst. Veg. 1: 770 (1824) |
| Ziziphus acidojujuba | C.Y.Cheng & M.J.Liu | J. Hebei Agric. Univ. 17(4): 3 (1994) |
| Mansana arborea | J.F.Gmel. | Syst. Nat. ed. 13[bis] : 580 (1791) |
| Rhamnus soporifera | Lour. | Fl. Cochinch. : 158 (1790) |
| Rhamnus vulgaris | Pers. | Syn. Pl. 1: 240 (1805) |
| Rhamnus zizyphus | L. | Sp. Pl. : 194 (1753) |
| Rhamnus lucida | Salisb. | Prodr. Stirp. Chap. Allerton : 139 (1796) |
| Rhamnus mauritiana | P.Willemet | Ann. Bot. (Usteri) 18: 20 (1796) |
| Paliurus lucidus | Carrière | Rev. Hort. (Paris) 37: 380 (1866) |
| Ziziphus mauritiana var. muratiana | (Maire) A.Chev. | Rev. Bot. Appl. Agric. Trop. 32: 576 1952 |
| Ziziphus mauritiana subsp. orthacantha | (DC.) A.Chev. | Rev. Bot. Appl. Agric. Trop. 32: 576 1952 |
| Ziziphus mauritiana var. orthacantha | (DC.) A.Chev. | Rev. Bot. Appl. Agric. Trop. 27: 477 1947 |
| Ziziphus mauritiana var. deserticola | A.Chev. | Rev. Bot. Appl. Agric. Trop. 27: 477 1947 |
| Ziziphus vulgaris var. spinosa | Bunge | Enum. Pl. China Bor. : 14 (1833) |
| Ziziphus acidojujuba f. granulata | C.Y.Cheng & M.J.Liu | J. Hebei Agric. Univ. 17(4): 5 (1994) |
| Ziziphus acidojujuba f. trachysperma | C.Y.Cheng & M.J.Liu | J. Hebei Agric. Univ. 17(4): 5 (1994) |
| Ziziphus jujuba f. carnosicalycis | C.Y.Cheng & M.J.Liu | J. Hebei Agric. Univ. 17(4): 8 (1994) |
| Ziziphus jujuba f. apyrena | C.Y.Cheng & M.J.Liu | J. Hebei Agric. Univ. 17(4): 8 (1994) |
Common names Top
Add a new one! Suggest a correction!| Language | Common/alternative name |
|---|---|
| English | jujube |
| English | chinese jujube |
| English | chinese dates |
| English | common jujuba |
| Spanish | azufaifo |
| Spanish | azufaifa |
| Spanish | jinjolero |
| Arabic | سدر جبلي |
| Arabic | عناب |
| Arabic | نبق |
| Arabic | زيزف جوجوبا |
| Assamese | বগৰী |
| Azerbaijani | Əsl innab |
| Belarusian | Ююба |
| Bulgarian | хинап |
| Tibetan | འབྲ་གོ་དམར་པོ། |
| Catalan | ginjoler |
| cdo | cō̤ |
| Czech | cicimek datlový |
| Czech | cicimek čínský |
| Danish | almindelig jujube |
| dag | zuŋguli kukua |
| German | chinesische jujube |
| dv | ކުންނާރު |
| Greek | Τζιτζιφιά |
| Esperanto | jujubarbo |
| Estonian | harilik kreektürn |
| Basque | jujubondo |
| Persian | عناب |
| Finnish | jujuba |
| Finnish | kiinanjujuba |
| French | jujubier commun |
| Irish | sisiúb |
| Galician | azofeifeira |
| Gujarati | બોર |
| Hebrew | שיזף סיני |
| Croatian | žižula |
| Croatian | Žižula |
| Hungarian | kínai datolya |
| Hungarian | jujuba |
| Hungarian | ziziphus zizyphus |
| Armenian | Ունաբ սովորական |
| Indonesian | angco |
| Indonesian | apel india |
| Indonesian | bidara |
| Indonesian | bidara cina |
| Indonesian | futsa |
| Indonesian | jujube |
| Indonesian | putsa |
| io | jujubo |
| Italian | giuggiolo |
| Japanese | ナツメ |
| Kazakh | Кәдімгі шилен |
| Kannada | ಎಲಚಿ |
| Korean | 대추 |
| Korean | 대추나무 |
| kv | Унаби |
| lij | zizoa |
| lmo | ziziphus zizyphus |
| Latvian | zizifs |
| lzh | 棗 |
| Malagasy | mokonazy |
| Malayalam | ഇലന്ത |
| mnc | ᠰᠣᡵᠣ |
| Marathi | बोर |
| Malay | jujube |
| Burmese | ဆီးပင် |
| Norwegian Bokmål | kinajujube |
| Dutch | chinese jujube |
| oc | ginjorlièr |
| Oriya | ବର କୋଳି |
| Polish | głożyna pospolita |
| Pashto | مرخڼی |
| Portuguese | jujuba |
| Romanian | Măslin dobrogean |
| Russian | Зизифус настоящий |
| Russian | Китайский финик |
| Russian | Унаби обыкновенная |
| Russian | Ююба китайская |
| sat | ᱡᱟᱹᱱᱩᱢ |
| scn | nzìnzula |
| sco | jujube |
| sd | عناب |
| Serbo-Croatian | Žižula |
| Slovak | jujuba holá |
| Slovenian | Žižola |
| Slovenian | navadni čičimak |
| Slovenian | čičimak |
| Slovenian | žižola |
| Albanian | xinxifja |
| Serbian | jујуба |
| su | bidara |
| Swedish | jujubär |
| Tamil | இலந்தை |
| Thai | พุทราจีน |
| Turkish | hünnap |
| Urdu | بیری کا درخت |
| Uzbek | yovvoyi chilonjiyda |
| Vietnamese | táo tàu |
| za | makcaujcij |
| Chinese | 枣 |
| Chinese | 大枣 |
| Chinese | 枣叶 |
| Chinese | 枣树 |
| Chinese | 枣树根 |
| Chinese | 枣树皮 |
| Chinese | 枣核 |
| Chinese | 酸枣仁 |
| Chinese | 棗 |
| Chinese | 龙爪枣 |
| Chinese | 枣樹 |
| Chinese | 棗樹 |
Varieties (abbr. var.) Top
Add a new one! Suggest a correction!| Name | Authority | First published in |
|---|---|---|
| Ziziphus jujuba var. inermis | (Bunge) Rehder | J. Arnold Arbor. 3: 220 1922 |
| Ziziphus jujuba var. spinosa | (Bunge) Hu ex H.F.Chow | Familiar Trees Hopei 307 1934 |
Forms (abbr. f.) Top
Add a new one! Suggest a correction!| Name | Authority | First published in |
|---|---|---|
| Ziziphus jujuba f. lageniformis | (Nakai) Kitag. | Lin. Fl. Manshur. 313 1939 |
Germination/Propagation Top
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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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Northern Africa
- Algeria
- Libya
- Morocco
- Tunisia
-
West Tropical Africa
- Burkina
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West-central Tropical Africa
- Cameroon
-
Northern Africa
-
Asia-temperate click to expand
-
China
- China North-central
- China South-central
- China Southeast
- Inner Mongolia
- Manchuria
- Xinjiang
-
Eastern Asia
- Japan
- Korea
-
Middle Asia
- Kazakhstan
- Kirgizstan
- Tadzhikistan
- Turkmenistan
- Uzbekistan
-
Western Asia
- Afghanistan
- Cyprus
- Iran
- Iraq
- Lebanon-Syria
- Turkey
-
China
-
Asia-tropical click to expand
-
Indian Subcontinent
- Assam
- India
- Maldives
- Pakistan
- West Himalaya
-
Indo-China
- Laos
-
Indian Subcontinent
-
Europe click to expand
-
Southeastern Europe
- Bulgaria
- Greece
- Italy
- Kriti
- Romania
- Sicilia
- Turkey-in-Europe
- Yugoslavia
-
Southwestern Europe
- France
- Spain
-
Southeastern Europe
-
Northern America click to expand
-
South-central U.S.A.
- Texas
-
Southeastern U.S.A.
- Alabama
- Florida
- Georgia
- Louisiana
-
Southwestern U.S.A.
- Arizona
- California
- Utah
-
South-central U.S.A.
-
Southern America click to expand
-
Caribbean
- Cuba
- Dominican Republic
- Jamaica
- Venezuelan Antilles
-
Central America
- Honduras
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Northern South America
- Venezuela
-
Caribbean
Links to other databases Top
Suggest others/fix!| Database | ID/link to page |
|---|---|
| World Flora Online | wfo-0000430303 |
| UNII | AQG914O70P |
| Florida Plant Atlas | 1920 |
| Flora of Alabama | 3099 |
| Tropicos | 27500858 |
| INPN | 162352 |
| Flora of Italy | 3062 |
| KEW | urn:lsid:ipni.org:names:719213-1 |
| The Plant List | kew-2470699 |
| Plantarium | 41195 |
| Missouri Botanical Garden | 286335 |
| PFAF | Ziziphus jujuba |
| Open Tree Of Life | 73483 |
| Observations.org | 129847 |
| NCBI Taxonomy | 326968 |
| IUCN Red List | 63538 |
| IPNI | 719213-1 |
| iNaturalist | 428365 |
| GBIF | 3039423 |
| EPPO | ZIPJU |
| EOL | 582338 |
| Elurikkus | 8263 |
| US Library of Congress | sh85070983 |
| USDA GRIN | 42282 |
| Wikipedia | Jujube |
| CMAUP | NPO5986 |
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_031755915.1 | ASM3175591v1 | Complete Genome | Hebei Agricultural University | 2023-09-20 | 70 | 375.11 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
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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 / Aporphines | |||||
| (-)-Nornuciferine | 197017 | Click to see | 281.30 | unknown |
https://doi.org/10.1007/BF02857740 https://doi.org/10.1007/BF02911058 |
| (-)-Nuciferine | 10146 | Click to see | 295.40 | unknown |
https://doi.org/10.1007/BF02911058 https://doi.org/10.1007/BF02857740 |
| (+)-Magnoflorine | 73337 | Click to see | 342.40 | unknown | https://doi.org/10.1248/CPB.45.1186 |
| (6aS)-10,11-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-1,2-diol | 102063083 | Click to see C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)OC)O)O)C | 342.40 | unknown |
https://doi.org/10.1007/BF02911058 https://doi.org/10.1007/BF02857741 https://doi.org/10.1007/BF02857740 |
| Asimilobine | 25774982 | Click to see | 267.32 | unknown | via CMAUP database |
| Caaverine | 23335 | Click to see | 267.32 | unknown |
https://doi.org/10.1007/BF02911058 https://doi.org/10.1007/BF02857740 |
| Lysicamine | 122691 | Click to see COC1=C(C2=C3C(=C1)C=CN=C3C(=O)C4=CC=CC=C42)OC | 291.30 | unknown | https://doi.org/10.1007/BF02857741 |
| N-Nornuciferine | 12313579 | Click to see | 281.30 | unknown | via CMAUP database |
| Nornuciferine | 41169 | Click to see | 281.30 | unknown |
https://doi.org/10.1007/BF02857741 https://doi.org/10.1007/BF02911058 |
| R-(-)-asimilobine | 160875 | Click to see | 267.32 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Plumeran-type alkaloids | |||||
| methyl (4S)-4-[(10S,11R)-11-acetyloxy-12-ethyl-10-hydroxy-5-methoxy-10-methoxycarbonyl-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraen-4-yl]-1-ethyl-2-oxa-6,16-diazahexacyclo[16.2.1.03,19.05,13.07,12.016,19]henicosa-5(13),7,9,11-tetraene-4-carboxylate | 5315743 | Click to see CCC12CC3CN4C3(C1)C(O2)C(C5=C(CC4)C6=CC=CC=C6N5)(C7=C(C=C8C(=C7)C91CCN2C9C(C=CC2)(C(C(C1N8C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC | 821.00 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Proaporphines | |||||
| (4S)-10,11-dimethoxyspiro[5-azatricyclo[6.3.1.04,12]dodeca-1(12),8,10-triene-2,4'-cyclohexa-2,5-diene]-1'-one | 830726 | Click to see COC1=C(C2=C3C(CC24C=CC(=O)C=C4)NCCC3=C1)OC | 297.30 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Protoberberine alkaloids and derivatives | |||||
| 16,17-Dimethoxy-6-tritio-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene | 10246509 | Click to see | 338.40 | unknown | via CMAUP database |
| Stepholidine | 6917970 | Click to see | 327.40 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Protopine alkaloids | |||||
| Pseudoprotopine | 185559 | Click to see CN1CCC2=CC3=C(C=C2C(=O)CC4=CC5=C(C=C4C1)OCO5)OCO3 | 353.40 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Strychnos alkaloids | |||||
| Scholaricine | 50900051 | Click to see CC(C1CN2CCC34C2CC1C(=C3NC5=C4C=CC=C5O)C(=O)OC)O | 356.40 | unknown | https://doi.org/10.3987/COM-88-4578 |
| > Benzenoids / Benzene and substituted derivatives | |||||
| Benzaldehyde, oxime, (Z)- | 5324470 | Click to see C1=CC=C(C=C1)C=NO | 121.14 | unknown | via CMAUP database |
| Dodecylbenzene | 31237 | Click to see | 246.40 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Acetophenones | |||||
| [(2R,3S)-5-acetyl-6-methoxy-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-3-yl] (Z)-2-methylbut-2-enoate | 163186281 | Click to see | 330.40 | unknown | https://doi.org/10.1016/S0031-9422(00)85072-4 |
| > 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 | https://doi.org/10.1016/J.BSE.2013.04.001 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives | |||||
| Syringic Acid | 10742 | Click to see | 198.17 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Gallic acids | |||||
| Gallic Acid | 370 | Click to see | 170.12 | 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 / Benzoyl derivatives | |||||
| Benzaldehyde | 240 | Click to see | 106.12 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzyloxycarbonyls | |||||
| Benzyl acetate | 8785 | Click to see | 150.17 | unknown | via CMAUP database |
| > Benzenoids / Phenols / 1-hydroxy-2-unsubstituted benzenoids | |||||
| Chavicol | 68148 | Click to see | 134.17 | unknown | via CMAUP database |
| > Benzenoids / Phenols / Benzenediols / Catechols | |||||
| Catechol | 289 | Click to see | 110.11 | unknown | via CMAUP database |
| Catechol,[14c(u)] | 11480435 | Click to see | 122.07 | unknown | via CMAUP database |
| > Benzenoids / Phenols / Methoxyphenols | |||||
| 4-[(E)-3-hydroxyprop-1-enyl]-2,6-bis(trideuteriomethoxy)phenol | 10703933 | Click to see | 216.26 | unknown | via CMAUP database |
| cis-Isoeugenol | 1549041 | Click to see CC=CC1=CC(=C(C=C1)O)OC | 164.20 | unknown | via CMAUP database |
| Eugenol | 3314 | Click to see | 164.20 | unknown | via CMAUP database |
| Feruloyltyramine | 5280537 | Click to see | 313.30 | unknown | via CMAUP database |
| Isoeugenol | 853433 | Click to see | 164.20 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Acyl carnitines | |||||
| Heptadecanoyl carnitine | 53477803 | Click to see CCCCCCCCCCCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C | 413.60 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
| (9Z)-12-hydroxyoctadec-9-enoic acid | 5282942 | Click to see | 298.50 | unknown | via CMAUP database |
| 2-Dodecyl-3-Methylbutanedioic Acid | 99891 | Click to see CCCCCCCCCCCCC(C(C)C(=O)O)C(=O)O | 300.40 | unknown | via CMAUP database |
| 9-Eicosenoic acid | 94159 | Click to see CCCCCCCCCCC=CCCCCCCCC(=O)O | 310.50 | unknown | via CMAUP database |
| 9-Octadecenoic Acid | 965 | Click to see | 282.50 | unknown | via CMAUP database |
| Eicosanoic Acid | 10467 | Click to see | 312.50 | unknown | via CMAUP database |
| Elaidic Acid | 637517 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 282.50 | unknown | via CMAUP database |
| Gadelaidic acid | 5460988 | Click to see | 310.50 | unknown | via CMAUP database |
| Gadoleic Acid | 5282767 | Click to see | 310.50 | unknown | via CMAUP database |
| Myristic Acid | 11005 | Click to see | 228.37 | unknown | via CMAUP database |
| Myristoleic Acid | 5281119 | Click to see | 226.35 | unknown | via CMAUP database |
| Oleic Acid | 445639 | Click to see | 282.50 | unknown | https://doi.org/10.1055/S-2002-36354 |
| Oleic acid-d2 | 13011408 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 284.50 | unknown | via CMAUP database |
| Palmitelaidic acid | 5282745 | Click to see | 254.41 | unknown | via CMAUP database |
| Palmitic Acid | 985 | Click to see | 256.42 | unknown | via CMAUP database |
| Palmitoleic Acid | 445638 | Click to see CCCCCCC=CCCCCCCCC(=O)O | 254.41 | unknown | via CMAUP database |
| Stearic Acid | 5281 | Click to see | 284.50 | unknown |
https://doi.org/10.1055/S-2002-36354 https://doi.org/10.1007/978-3-642-48618-0_9 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids | |||||
| Heptanoic Acid | 8094 | Click to see | 130.18 | unknown | via CMAUP database |
| Hexanoic Acid | 8892 | Click to see | 116.16 | unknown | via CMAUP database |
| Lauric Acid | 3893 | Click to see | 200.32 | unknown | via CMAUP database |
| Octanoic Acid | 379 | Click to see CCCCCCCC(=O)O | 144.21 | unknown | via CMAUP database |
| > 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 | via CMAUP database |
| Tetracosanoate | 5461021 | Click to see | 367.60 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides | |||||
| 6S,9R-Roseoside | 9930064 | Click to see | 386.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives | |||||
| 9,12-Octadecadienoic Acid | 3931 | Click to see | 280.40 | unknown | via CMAUP database |
| 9Z,12E-octadecadienoic acid | 5282797 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)O | 280.40 | unknown | via CMAUP database |
| Linoleic Acid | 5280450 | Click to see | 280.40 | unknown | https://doi.org/10.1055/S-2002-36354 |
| Linolelaidic Acid | 5282457 | Click to see | 280.40 | unknown | via CMAUP database |
| Linolenic Acid | 5280934 | Click to see | 278.40 | unknown | via CMAUP database |
| trans-9-cis-12-Octadecadienoic acid | 5282798 | Click to see | 280.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Glycerolipids / Triradylcglycerols / Triacylglycerols | |||||
| Tristearin | 11146 | Click to see | 891.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Tigliane and ingenane diterpenoids | |||||
| [(1S,4S,5R,6R,9S,14R)-4,5,6-trihydroxy-3,11,11,14-tetramethyl-15-oxo-7-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl]methyl hexadecanoate | 5318035 | Click to see CCCCCCCCCCCCCCCC(=O)OCC1=CC2C3C(C3(C)C)CC(C4(C2=O)C=C(C(C4(C1O)O)O)C)C | 586.80 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Villanovane, atisane, trachylobane or helvifulvane diterpenoids / Atisane diterpenoids / Hetisine-type diterpenoid alkaloids | |||||
| (16S)-16-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.01,8.05,17.07,16.09,14.014,18]nonadecan-19-one | 5321444 | Click to see | 311.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Monocyclic monoterpenoids | |||||
| Cyclohexene, 1-methyl-3-(1-methylethenyl)- | 10354 | Click to see | 136.23 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Vitamin E compounds / Tocopherols | |||||
| DL-alpha-Tocopherol | 2116 | Click to see | 430.70 | unknown | via CMAUP database |
| Vitamin E | 14985 | Click to see | 430.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids | |||||
| (-)-Isocaryophyllene | 5281522 | Click to see | 204.35 | unknown | via CMAUP database |
| (+)-beta-Caryophyllene | 20831623 | Click to see | 204.35 | unknown | via CMAUP database |
| (1R,4aR,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene | 6432308 | Click to see CC1=CC2C(CC1)C(=C)CCC2C(C)C | 204.35 | unknown | via CMAUP database |
| (1R,4R,5R,9S)-4,5-epoxycaryophyllan-8(13)-ene | 1742211 | Click to see | 220.35 | unknown | via CMAUP database |
| (4Z)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene | 5322111 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown | via CMAUP database |
| (6R,9S)-vomifoliol | 11816951 | Click to see | 224.30 | unknown | via CMAUP database |
| (R)-beta-bisabolene | 68128 | Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C | 204.35 | unknown | https://doi.org/10.1007/BF00597721 |
| (Z)-alpha-Bisabolene | 5352653 | Click to see | 204.35 | unknown | https://doi.org/10.1007/BF00597721 |
| (Z)-caryophyllene | 6429301 | Click to see | 204.35 | unknown | via CMAUP database |
| [4,5-Dihydroxy-2-(9-hydroxy-3,7,11-trimethyldodeca-1,6,10-trien-3-yl)oxyoxan-3-yl] acetate | 162940973 | Click to see | 412.50 | unknown | https://doi.org/10.1016/S0031-9422(00)85004-9 |
| 4,11,11-Trimethyl-8-methylene-5-oxatricyclo(8.2.0.0(4,6))dodecane, (1R,4R,6R,10S)- | 6604672 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
| 4,12,12-Trimethyl-9-methylene-5-oxatricyclo(8.2.0.04,6)dodecane | 14350 | Click to see | 220.35 | unknown | via CMAUP database |
| alpha-Bisabolene, (E)- | 5315468 | Click to see | 204.35 | unknown | https://doi.org/10.1007/BF00597721 |
| Beta-Bisabolene | 10104370 | Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C | 204.35 | unknown | https://doi.org/10.1007/BF00597721 |
| Caryophyllene | 5281515 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown | via CMAUP database |
| Caryophyllene oxide | 1742210 | Click to see | 220.35 | unknown | via CMAUP database |
| Caryophyllene,alpha + beta mixt. | 5354499 | Click to see | 204.35 | unknown | via CMAUP database |
| delta-Amorphene | 12306059 | Click to see | 204.35 | unknown | via CMAUP database |
| Humulene | 5281520 | Click to see | 204.35 | unknown | via CMAUP database |
| Npc160122 | 558173 | Click to see | 218.33 | unknown | via CMAUP database |
| Npc16157 | 13240188 | Click to see | 220.35 | unknown | via CMAUP database |
| Npc186793 | 5363099 | Click to see | 220.35 | unknown | via CMAUP database |
| Npc91574 | 12306054 | Click to see | 204.35 | unknown | via CMAUP database |
| Vomifoliol, (+)- | 5280462 | Click to see | 224.30 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Agarofurans | |||||
| [(1R,2S,5R,6R,7R,9R)-7-acetyloxy-5-hydroxy-6-(hydroxymethyl)-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-8-yl] benzoate | 6325577 | Click to see CC1CCC(C2(C13CC(C(C2OC(=O)C)OC(=O)C4=CC=CC=C4)C(O3)(C)C)CO)O | 432.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids | |||||
| (-)-Ledol | 6431133 | Click to see | 222.37 | unknown | via CMAUP database |
| (+)-Ledol | 11074994 | Click to see | 222.37 | unknown | via CMAUP database |
| 1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, [1ar-(1aalpha,4alpha,4abeta,7alpha,7abeta,7balpha)]- | 6432561 | Click to see | 222.37 | unknown | via CMAUP database |
| Ledum camphor | 92812 | Click to see | 222.37 | unknown | via CMAUP database |
| Ledum camphor | 22297324 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O | 222.37 | unknown | via CMAUP database |
| Npc239037 | 101716 | Click to see | 222.37 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Diterpene glycosides / Steviol glycosides | |||||
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1S,4R,5R,9R,10S,13R)-13-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate | 23621216 | Click to see CC12CCCC(C1CCC34C2CCC(C3)(C(=C)C4)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)(C)C(=O)OC7C(C(C(C(O7)CO)O)O)O | 804.90 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Iridoid O-glycosides | |||||
| methyl (1S,4aS,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate | 10842393 | Click to see COC(=O)C1=COC(C2C1CC=C2CO)OC3C(C(C(C(O3)COC4C(C(C(C(O4)COC(=O)C=CC5=CC=C(C=C5)O)O)O)O)O)O)O | 696.60 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins | |||||
| Protojujuboside B | 71448944 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C(C(=O)CC6(C5(CCC4C3(C)C)C)CO)C(C)(CC(C=C(C)C)OC7C(C(C(C(O7)CO)O)O)O)O)C)O)OC8C(C(C(C(O8)CO)O)O)OC9C(C(C(CO9)O)O)O)O)O)O | 1225.40 | unknown | https://doi.org/10.1248/CPB.47.1744 |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene lactones | |||||
| (4aR,5R,9aR)-9a-hydroxy-3,4a,5-trimethyl-4,5-dihydrobenzo[f][1]benzofuran-2,6-dione | 163049634 | Click to see | 260.28 | unknown | https://doi.org/10.1016/S0031-9422(00)88967-0 |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Eudesmanolides, secoeudesmanolides, and derivatives | |||||
| (3S,3aS,5aR,9R,9aS,9bS)-3a,5,5a,9,9a,9b-Hexahydro-9-hydroxy-3,5a,9-trimethylnaphtho(1,2-b)furan-2,6(3H,4H)-dione | 94253 | Click to see | 264.32 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Carotenes | |||||
| Beta-Carotene | 5280489 | Click to see | 536.90 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
| (+)-Ursolic Acid | 64945 | Click to see | 456.70 | unknown |
https://doi.org/10.1111/J.1744-7909.2005.00060.X https://doi.org/10.1007/S10600-011-9859-7 https://doi.org/10.1055/S-2007-969095 |
| (10R)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | 45358157 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O | 456.70 | unknown | via CMAUP database |
| (1R,2R,3R,4R,6R,7R,8S,9R,12R,13R,16S,18R)-16-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-1,2,7,13,17,17-hexamethyl-6-(3-methylbut-2-enyl)-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-3,4,7-triol | 102066552 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C5CCC6C7C(C(OC7(C(C6(C5(CCC4C3(C)C)C)C)O)O)CC=C(C)C)(C)O)C)CO)O)OC8C(C(C(C(O8)CO)O)O)O)O)O)O | 961.10 | unknown | via CMAUP database |
| (1R,2R,3R,4R,6R,7R,8S,9R,12R,13R,16S,18R)-16-[(2R,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-1,2,7,13,17,17-hexamethyl-6-(3-methylbut-2-enyl)-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-3,4,7-triol | 102066551 | Click to see | 961.10 | unknown | via CMAUP database |
| (1R,2R,5S,8R,14R,15S,16R,18R)-15-formyl-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5-carboxylic acid | 15958447 | Click to see | 470.70 | unknown | via CMAUP database |
| (1R,2R,5S,8R,9R,10R,13R,14R,15S,16S,18R)-15-formyl-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5-carboxylic acid | 54582219 | Click to see | 470.70 | unknown | via CMAUP database |
| (1R,3aS,5aR,5bR,7aR,9R,11aR,11bR,13aS,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid | 11897956 | Click to see | 456.70 | unknown | via CMAUP database |
| (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13bR)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-1H-cyclopenta[a]chrysen-9-ol | 51340201 | Click to see | 442.70 | unknown | via CMAUP database |
| (1R,3aS,5aR,5bR,9R,10R,11aR)-9,10-dihydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid | 51025490 | Click to see | 472.70 | unknown | via CMAUP database |
| (1R,3aS,5aS,5bR,9R,10R,11aR)-9,10-dihydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13b-tetradecahydrocyclopenta[a]chrysene-3a-carboxylic acid | 470606 | Click to see | 470.70 | unknown | https://doi.org/10.1248/CPB.26.3075 |
| (1R,5aR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid | 45358111 | Click to see | 456.70 | unknown | via CMAUP database |
| (1S,2R,4aR,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | 45483617 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O | 456.70 | unknown | via CMAUP database |
| (1S,2R,4aS,6aS,6bR,10R,11R,12aR)-10,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | 470602 | Click to see | 472.70 | unknown | via CMAUP database |
| (2alpha,3beta)-2-[(3,4-Dihydroxybenzoyl)oxy]-3-hydroxylup-20(29)-en-28-oic acid | 102247122 | Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)C)O)OC(=O)C6=CC(=C(C=C6)O)O)C)C)C(=O)O | 608.80 | unknown | https://doi.org/10.1016/0031-9422(96)00379-2 |
| (2R,7S,10R)-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosane-7,16-diol | 5318721 | Click to see CC(=CC1CC(C2C3CCC4C5(CCC(C(C5CCC4(C36CC2(O1)OC6)C)(C)C)O)C)(C)O)C | 472.70 | unknown | via CMAUP database |
| (2R)-2-[(2R)-4-[(2R)-4,5-dihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,10R,11R,14S,15R,16S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 138114261 | Click to see | 1207.30 | unknown |
https://doi.org/10.1007/978-3-642-48618-0_9 https://doi.org/10.1248/CPB.45.1186 |
| (2R)-2-[(2S)-4-[(2S)-4,5-dihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,10R,11R,14R,15S,16S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 138114804 | Click to see | 1207.30 | unknown | https://doi.org/10.1007/978-3-642-48618-0_9 |
| (2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[[(1S,2R,10R,11R,16R,18R,20R,22S)-18-(2-hydroxypropan-2-yl)-2,6,6,10,16-pentamethyl-17,21,23-trioxaheptacyclo[20.2.1.01,14.02,11.05,10.015,22.016,20]pentacosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 10079038 | Click to see | 797.00 | unknown | via CMAUP database |
| (2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[[(1S,2R,5R,10R,11R,14R,15S,16R,18R,20R,22S)-18-(2-hydroxypropan-2-yl)-2,6,6,10,16-pentamethyl-17,21,23-trioxaheptacyclo[20.2.1.01,14.02,11.05,10.015,22.016,20]pentacosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 101635354 | Click to see | 797.00 | unknown |
https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275 |
| (2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[[18-(2-hydroxypropan-2-yl)-2,6,6,10,16-pentamethyl-17,21,23-trioxaheptacyclo[20.2.1.01,14.02,11.05,10.015,22.016,20]pentacosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 5318720 | Click to see | 797.00 | unknown |
https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275 |
| (2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-[[(1S,2R,5R,10R,11R,14R,15S,16R,17S,19S)-16-hydroxy-2,6,6,10,16-pentamethyl-17-(3-methylbut-2-enyl)-18,20-dioxahexacyclo[17.2.1.01,14.02,11.05,10.015,19]docosan-7-yl]oxy]-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 101635353 | Click to see | 943.10 | unknown |
https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275 |
| (2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-[[16-hydroxy-2,6,6,10,16-pentamethyl-17-(3-methylbut-2-enyl)-18,20-dioxahexacyclo[17.2.1.01,14.02,11.05,10.015,19]docosan-7-yl]oxy]-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 5318719 | Click to see | 943.10 | unknown |
https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275 |
| (2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-2-[[(1S,2R,10R,11R,16R,19S)-16-hydroxy-2,6,6,10,16-pentamethyl-17-(3-methylbut-2-enyl)-18,20-dioxahexacyclo[17.2.1.01,14.02,11.05,10.015,19]docosan-7-yl]oxy]-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 10418389 | Click to see | 943.10 | unknown | via CMAUP database |
| (2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-2-[[(1S,2R,5R,10R,11R,14R,15S,16R,17S,19S)-16-hydroxy-2,6,6,10,16-pentamethyl-17-(3-methylbut-2-enyl)-18,20-dioxahexacyclo[17.2.1.01,14.02,11.05,10.015,19]docosan-7-yl]oxy]-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 101635352 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C5CCC6C7C(C(OC78CC6(C5(CCC4C3(C)C)C)CO8)CC=C(C)C)(C)O)C)CO)O)OC9C(C(C(C(O9)CO)O)O)O)O)O)O | 943.10 | unknown |
https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275 |
| (2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5R)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-5-hydroxy-2-[[16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 11968657 | Click to see | 1237.40 | unknown | via CMAUP database |
| (2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5S)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,7S,10R,11R,14R,15S,16S,18S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 102004533 | Click to see | 1207.30 | unknown | via CMAUP database |
| (2S,3R,4S,5S)-2-[(2S,3R,4S,5R)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 11968656 | Click to see | 1207.30 | unknown | via CMAUP database |
| (2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5S)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,7S,10R,11R,14R,15S,16S,18S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 102004531 | Click to see | 1207.30 | unknown | via CMAUP database |
| (3beta,16beta,23R)-16,23:16,30-Diepoxy-20-hydroxydammar-24-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-->2)-O-[O-beta-D-xylopyranosyl-(1-->2)-6-O-acetyl-beta-D-glucopyranosyl-(1-->3)]-alpha-L-arabinopyranoside | 101709345 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC(=O)C)O)O)OC1C(C(C(CO1)O)O)O)O)O)O | 1087.20 | unknown |
https://doi.org/10.1248/CPB.47.1744 https://doi.org/10.1248/CPB.45.1186 |
| (3R,4S,5R,6R)-2-[(3R,4S,5S)-4-[(3R,4S,5S,6R)-4,5-dihydroxy-6-[[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(2R,5R,7S,10R,11R,14R,15S,16S,18R,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 71571444 | Click to see | 1207.30 | unknown | via CMAUP database |
| (4aR,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 45483610 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C | 456.70 | unknown | via CMAUP database |
| (4aS,6aS,6aS,6bR,8aR,10R,11R,12aR,14bS)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 11887403 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C | 472.70 | unknown | via CMAUP database |
| [(2S,3R,4R,5S,6S)-3-acetyloxy-2-[[(1S,2R,5R,7S,10R,11R,15S,16S,18R,20S)-7-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-16-yl]oxy]-5-hydroxy-6-methyloxan-4-yl] acetate | 118701286 | Click to see | 981.20 | unknown |
https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1016/S0040-4020(01)85093-6 https://doi.org/10.1016/0040-4039(91)85039-8 |
| 2-[[3-[3,5-dihydroxy-6-(hydroxymethyl)-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxymethyl]-6-[4,5-dihydroxy-2-[[(1S,2R,7S,10R,11R,14R,15S,16S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]-6-methyloxan-3-yl]oxyoxane-3,4,5-triol | 11970115 | Click to see | 1207.30 | unknown | https://doi.org/10.1248/CPB.45.1186 |
| 2-[2-[2-[4,5-dihydroxy-2-[[(1S,2R,7S,10R,11R,14R,15S,16S,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]-6-methyloxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxyoxane-3,4,5-triol | 11970116 | Click to see | 1045.20 | unknown |
https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.45.1186 https://doi.org/10.1248/CPB.40.2275 https://doi.org/10.1021/NP50013A016 |
| 2-[4-[4,5-Dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-5-hydroxy-2-[[16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol | 73110002 | Click to see | 1237.40 | unknown |
https://doi.org/10.1248/CPB.47.1744 https://doi.org/10.1248/CPB.45.1186 |
| 3-Hydroxyolean-12-en-28-oic acid | 619166 | Click to see | 456.70 | unknown | https://doi.org/10.1007/S10600-011-9859-7 |
| 3-O-cis-p-Coumaroylmaslinic acid | 101001054 | Click to see | 618.80 | unknown | via CMAUP database |
| 3-O-Protocatechuoylceanothic acid | 85245649 | Click to see | 622.80 | unknown | https://doi.org/10.1016/0031-9422(96)00379-2 |
| 3-Oxopomolic acid | 12314450 | Click to see | 470.70 | unknown | via CMAUP database |
| 9,10-Dihydroxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid | 12305767 | Click to see | 472.70 | unknown | https://doi.org/10.1007/S10600-011-9859-7 |
| Alphitolic acid | 12305768 | Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)C)O)O)C)C)C(=O)O | 472.70 | unknown |
https://doi.org/10.1007/S10600-011-9859-7 https://doi.org/10.1248/CPB.26.3075 |
| Betulin | 72326 | Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)CO | 442.70 | unknown |
https://doi.org/10.1111/J.1744-7909.2005.00060.X https://doi.org/10.1055/S-2007-969308 |
| Betulinic Acid | 64971 | Click to see | 456.70 | unknown |
https://doi.org/10.1055/S-2002-36354 https://doi.org/10.1055/S-2007-969308 https://doi.org/10.1007/S10600-011-9859-7 https://doi.org/10.1111/J.1744-7909.2005.00060.X https://doi.org/10.1007/978-3-642-48618-0_9 |
| Betulonic acid | 122844 | Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(=O)C(C5CCC4(C3(CC2)C)C)(C)C)C)C(=O)O | 454.70 | unknown | https://doi.org/10.1248/CPB.26.3075 |
| Ceanothenic Acid | 71451218 | Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C(=O)O)(CCC5C4(C=CC5(C)C)C)C)C(=O)O | 454.60 | unknown | via CMAUP database |
| Ceanothic acid | 161352 | Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)O)C(=O)O)C)C)C(=O)O | 486.70 | unknown |
https://doi.org/10.1007/S10600-011-9859-7 https://doi.org/10.1111/J.1744-7909.2005.00060.X |
| Corosolic Acid | 6918774 | Click to see | 472.70 | unknown | https://doi.org/10.1111/J.1744-7909.2005.00060.X |
| Emmolic acid | 578549 | Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)O)C(=O)O)C)C)C(=O)O | 486.70 | unknown | https://doi.org/10.1007/S10600-011-9859-7 |
| Epiceanothic Acid | 23631167 | Click to see | 486.70 | unknown | via CMAUP database |
| Jujuboside A | 51346169 | Click to see | 1207.30 | unknown | via CMAUP database |
| Jujuboside B | 24721031 | Click to see | 1045.20 | unknown |
https://doi.org/10.1007/978-3-642-48618-0_9 https://doi.org/10.1016/0378-8741(95)01248-C https://doi.org/10.1248/CPB.40.2275 https://doi.org/10.1248/CPB.45.1186 https://doi.org/10.1021/NP50013A016 |
| Jujuboside D | 177396 | Click to see | 1207.30 | unknown | via CMAUP database |
| Jujuboside D | 53399223 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C7C(CC(OC78CC6(C5(CCC4C3(C)C)C)CO8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(C(CO1)O)O)O)O)O)O | 1207.30 | unknown | via CMAUP database |
| Jujuboside DJujuboside A1 | 92043344 | Click to see | 1207.30 | unknown | via CMAUP database |
| Jujuboside-A | 171446 | Click to see | 1207.30 | unknown | via CMAUP database |
| JujubosideB | 45358134 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C(C5(CCC4C3(C)C)C)CC78C6C(CC(O7)(OC8)C=C(C)C)(C)O)C)O)OC9C(C(C(C(O9)CO)O)O)OC1C(C(C(CO1)O)O)O)O)O)O | 1045.20 | unknown | via CMAUP database |
| Lup-20(29)-en-28-oic acid, 3beta-hydroxy- | 2371 | Click to see | 456.70 | unknown | https://doi.org/10.1007/S10600-011-9859-7 |
| Maslinic Acid | 73659 | Click to see | 472.70 | unknown | https://doi.org/10.1248/CPB.26.3075 |
| Npc240528 | 10096940 | Click to see | 486.70 | unknown | via CMAUP database |
| Oleanolic Acid | 10494 | Click to see | 456.70 | unknown |
https://doi.org/10.1007/S10600-011-9859-7 https://doi.org/10.1055/S-2007-969095 |
| Oleanonic Acid | 12313704 | Click to see | 454.70 | unknown | https://doi.org/10.1248/CPB.26.3075 |
| Urs-12-en-28-oic acid, 3-hydroxy-, (3beta)- | 220774 | Click to see | 456.70 | unknown | https://doi.org/10.1007/S10600-011-9859-7 |
| Ursonic Acid | 9890209 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1C)C)C(=O)O | 454.70 | unknown | via CMAUP database |
| Ziziphin | 441957 | Click to see | 981.20 | unknown | https://doi.org/10.1016/0378-8741(95)01248-C |
| Zizyberanalic Acid | 21672700 | Click to see | 470.70 | unknown | via CMAUP database |
| Zizyberenalic acid | 15958448 | Click to see CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(=CC5(C)C)C=O)C)C)C(=O)O | 452.70 | unknown | via CMAUP database |
| Zizyberenalic acid | 101936049 | Click to see | 452.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives | |||||
| [(3S,8S,10R,12R,13S,14R,17S)-17-acetyl-3,8,14-trihydroxy-10,13-dimethyl-2,3,4,7,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-12-yl] pyridine-3-carboxylate | 5320138 | Click to see | 469.60 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid lactones / Cardenolides and derivatives / Cardenolide glycosides and derivatives | |||||
| 3-[(5R,10R,14S)-3-[(2R,3S,4R,5S,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-14-hydroxy-10-(hydroxymethyl)-13-methyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one | 6325934 | Click to see | 550.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives | |||||
| (3R,4S,5S,6R)-2-[[(3S,8S,9S,10R,13R,14S)-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]-6-(hydroxymethyl)oxane-3,4,5-triol | 52940117 | Click to see | 576.80 | unknown | via CMAUP database |
| 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/10.1055/S-2007-969308 |
| Npc196776 | 50930798 | Click to see | 410.70 | unknown | via CMAUP database |
| Sitogluside | 5742590 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C | 576.80 | unknown |
https://doi.org/10.1055/S-2007-969308 https://doi.org/10.1111/J.1744-7909.2005.00060.X |
| Stigmasterol Glucoside | 6602508 | Click to see | 574.80 | unknown | https://doi.org/10.1111/J.1744-7909.2005.00060.X |
| > 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 | via CMAUP database |
| 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one | 6021 | Click to see | 268.23 | unknown | https://doi.org/10.1007/978-3-642-48618-0_9 |
| Adenosine | 60961 | Click to see C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N | 267.24 | unknown | via CMAUP database |
| > Nucleosides, nucleotides, and analogues / Purine nucleosides / Purine 2-deoxyribonucleosides | |||||
| 5-(6-Aminopurin-9-Yl)-2-(Hydroxymethyl)Oxolan-3-Ol | 636 | Click to see | 251.24 | unknown | via CMAUP database |
| Deoxyadenosine | 13730 | Click to see | 251.24 | unknown | via CMAUP database |
| > Nucleosides, nucleotides, and analogues / Purine nucleotides / Cyclic purine nucleotides / 3,5-cyclic purine nucleotides | |||||
| (4aR,6S,7S,7aR)-6-(6-aminopurin-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol | 25322948 | Click to see | 329.21 | unknown | via CMAUP database |
| 2-amino-9-(2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl)-3H-purin-6-one | 295 | Click to see | 345.21 | unknown | https://doi.org/10.1016/J.FOODCHEM.2014.07.013 |
| 3',5'-cyclic AMP(1-) | 7059571 | Click to see C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)[O-] | 328.20 | unknown | via CMAUP database |
| 9-[(4aR,6R,7aR)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-amino-3H-purin-6-one | 68331656 | Click to see | 345.21 | unknown | via CMAUP database |
| 9-[(4aR,6R,7R,7aS)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-amino-3H-purin-6-one | 24316 | Click to see C1C2C(C(C(O2)N3C=NC4=C3NC(=NC4=O)N)O)OP(=O)(O1)O | 345.21 | unknown | via CMAUP database |
| 9-[(4aR,6S,7R,7aS)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-amino-3H-purin-6-one | 73351852 | Click to see C1C2C(C(C(O2)N3C=NC4=C3NC(=NC4=O)N)O)OP(=O)(O1)O | 345.21 | unknown | via CMAUP database |
| Acrasin | 274 | Click to see | 329.21 | unknown | https://doi.org/10.1016/J.FOODCHEM.2014.07.013 |
| Adenosine-3',5'-Cyclic Phosphoric Acid | 6714006 | Click to see C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)O | 329.21 | unknown | via CMAUP database |
| Camp | 6076 | Click to see | 329.21 | unknown | via CMAUP database |
| Tocladesine | 100299 | Click to see C1C2C(C(C(O2)N3C4=NC=NC(=C4N=C3Cl)N)O)OP(=O)(O1)O | 363.65 | unknown | via CMAUP database |
| > Nucleosides, nucleotides, and analogues / Pyrimidine nucleosides | |||||
| Cytidine | 6175 | Click to see C1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)O | 243.22 | unknown | via CMAUP database |
| Uridine | 6029 | Click to see | 244.20 | unknown | via CMAUP database |
| > Nucleosides, nucleotides, and analogues / Pyrimidine nucleosides / Pyrimidine 2-deoxyribonucleosides | |||||
| Thymidine | 5789 | Click to see CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O | 242.23 | unknown | via CMAUP database |
| > Nucleosides, nucleotides, and analogues / Pyrimidine nucleotides / Pyrimidine deoxyribonucleotides / Pyrimidine deoxyribonucleoside monophosphates / Pyrimidine 2-deoxyribonucleoside monophosphates | |||||
| Deoxycytidine 5'-monophosphate | 13945 | Click to see C1C(C(OC1N2C=CC(=NC2=O)N)COP(=O)(O)O)O | 307.20 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboximidic acids and derivatives / Carboximidic acids | |||||
| N-Ethylacetamide | 12253 | Click to see CCNC(=O)C | 87.12 | 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 | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids | |||||
| Ammoniohexanoate | 517543 | 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 / 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/10.1007/978-3-642-48618-0_9 |
| 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 / Amino acids and derivatives / Beta amino acids and derivatives | |||||
| (3S)-3-azaniumyl-3-phenylpropanoate | 6921435 | Click to see | 165.19 | unknown | via CMAUP database |
| (R)-Pantothenate | 167945 | Click to see | 218.23 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides / Cyclic peptides | |||||
| (2S)-N-[(2S)-1-[(3S,7R,10S,13Z)-10-benzyl-16-methoxy-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.3.1.03,7]nonadeca-1(19),13,15,17-tetraen-6-yl]-1-oxo-3-phenylpropan-2-yl]-2-(dimethylamino)-3-phenylpropanamide | 163195021 | Click to see | 729.90 | unknown | https://doi.org/10.1016/S0031-9422(00)88967-0 |
| (E)-N-[(10E)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylprop-2-enamide | 14729078 | Click to see CC(C)CC1C(=O)NC=CC2=CC=C(C=C2)OC(C(C(=O)N1)NC(=O)C=CC3=CC=CC=C3)C(C)C | 489.60 | unknown | https://doi.org/10.1016/0031-9422(90)80207-W |
| 2-(dimethylamino)-N-[(10E)-7-(1-hydroxy-2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylpropanamide | 14729081 | Click to see CC(C)C1C(C(=O)NC(C(=O)NC=CC2=CC=C(O1)C=C2)C(C(C)C)O)NC(=O)C(CC3=CC=CC=C3)N(C)C | 550.70 | unknown | https://doi.org/10.1016/0031-9422(90)80207-W |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides / Oligopeptides | |||||
| (13Z)-10-butan-2-yl-6-[2-(3,4-dimethyl-5-oxoimidazolidin-1-yl)-3-methylbutanoyl]-16-methoxy-2-oxa-6,9,12-triazatricyclo[13.3.1.03,7]nonadeca-1(18),13,16-triene-8,11-dione | 101419713 | Click to see | 571.70 | unknown | https://doi.org/10.1016/S0031-9422(00)80723-2 |
| (2S,3R)-N-[(3S,4S,7S,10E)-7-benzyl-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-2-(dimethylamino)-3-methylpentanamide | 102239804 | Click to see | 534.70 | unknown | https://doi.org/10.1016/S0367-326X(01)00278-7 |
| (2S,3S)-N-[(2S,3S)-1-[(3S,10S,13E)-10-butan-2-yl-16-methoxy-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.3.1.03,7]nonadeca-1(19),13,15,17-tetraen-6-yl]-3-methyl-1-oxopentan-2-yl]-2-(dimethylamino)-3-methylpentanamide | 101204326 | Click to see | 627.80 | unknown | via CMAUP database |
| (2S,3S)-N-[(2S)-1-[(3S,7S,10S,13Z)-10-[(2R)-butan-2-yl]-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.2.2.03,7]nonadeca-1(18),13,15(19),16-tetraen-6-yl]-4-methyl-1-oxopentan-2-yl]-2-(dimethylamino)-3-methylpentanamide | 102146051 | Click to see CCC(C)C1C(=O)NC=CC2=CC=C(C=C2)OC3CCN(C3C(=O)N1)C(=O)C(CC(C)C)NC(=O)C(C(C)CC)N(C)C | 597.80 | unknown | via CMAUP database |
| (2S)-2-(dimethylamino)-N-[(3R,4S,7S,10E)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylpropanamide | 101921947 | Click to see CC(C)CC1C(=O)NC=CC2=CC=C(C=C2)OC(C(C(=O)N1)NC(=O)C(CC3=CC=CC=C3)N(C)C)C(C)C | 534.70 | unknown |
https://doi.org/10.1248/BPB.31.1749 https://doi.org/10.1016/S0031-9422(00)82518-2 https://doi.org/10.1007/BF02857740 |
| 2-(Dimethylamino)-N-[(10Z)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylpropanamide | 5317387 | Click to see | 534.70 | unknown |
https://doi.org/10.1007/BF02857740 https://doi.org/10.1016/S0031-9422(00)82518-2 https://doi.org/10.1248/BPB.31.1749 |
| 2-(dimethylamino)-N-[11-methoxy-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),12,15-trien-4-yl]-3-phenylpropanamide | 75072105 | Click to see | 566.70 | unknown | https://doi.org/10.1016/0031-9422(90)80207-W |
| 2-(methylamino)-N-[(10E)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylpropanamide | 14729076 | Click to see CC(C)CC1C(=O)NC=CC2=CC=C(C=C2)OC(C(C(=O)N1)NC(=O)C(CC3=CC=CC=C3)NC)C(C)C | 520.70 | unknown | https://doi.org/10.1016/0031-9422(90)80207-W |
| Benzenepropanamide, alpha-(dimethylamino)-N-[2-methyl-1-[[3,3a,11,12,13,14,15,15a-octahydro-13-(1-methylpropyl)-12,15-dioxo-5,8-ethenopyrrolo[3,2-b][1,5,8]oxadiazacyclotetradecin-1(2H)-yl]carbonyl]butyl]- | 5318120 | Click to see | 631.80 | unknown | https://doi.org/10.1016/0031-9422(90)80207-W |
| Ceanothamine B | 5316533 | Click to see CCC(C)C1C(=O)NC=CC2=CC=C(C=C2)OC(C(C(=O)N1)NC(=O)C(CC(C)C)N(C)C)C(C)C | 500.70 | unknown | via CMAUP database |
| Daechuine S8-1 | 102155153 | Click to see CC(C)CC1C(=O)NC=CC2=C(C=CC(=C2)OC3CCN(C3C(=O)N1)C(=O)C(CC(C)C)NC(=O)C(CC(C)C)N(C)C)OC | 627.80 | unknown | via CMAUP database |
| Jubanine A | 101316794 | Click to see | 695.80 | unknown | via CMAUP database |
| Jubanine B | 101316795 | Click to see CN(C)C(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)N3CCC4C3C(=O)NC(C(=O)NC=CC5=C(C=CC(=C5)O4)OC)CC6=CC=CC=C6 | 729.90 | unknown | via CMAUP database |
| Jubanine C | 131752168 | Click to see CCC(C)C(C(=O)N1CCCC1C(=O)NC2C(OC3=CC=C(C=C3)C=CNC(=O)C(NC2=O)CC4=CC=CC=C4)C5=CC=CC=C5)N(C)C | 665.80 | unknown | https://doi.org/10.1016/S0367-326X(01)00278-7 |
| Mauritine A | 11353668 | Click to see | 575.70 | unknown | via CMAUP database |
| N-[1-(10-benzyl-16-methoxy-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.3.1.03,7]nonadeca-1(19),13,15,17-tetraen-6-yl)-1-oxo-3-phenylpropan-2-yl]-2-(dimethylamino)-3-phenylpropanamide | 163008569 | Click to see CN(C)C(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)N3CCC4C3C(=O)NC(C(=O)NC=CC5=C(C=CC(=C5)O4)OC)CC6=CC=CC=C6 | 729.90 | unknown | https://doi.org/10.1016/S0031-9422(00)88967-0 |
| N-[1-(10-butan-2-yl-16-methoxy-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.3.1.03,7]nonadeca-1(19),13,15,17-tetraen-6-yl)-1-oxo-3-phenylpropan-2-yl]-2-(dimethylamino)-3-phenylpropanamide | 163073449 | Click to see | 695.80 | unknown | https://doi.org/10.1016/S0031-9422(00)88967-0 |
| N-[1-[(13E)-10-butan-2-yl-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.2.2.03,7]nonadeca-1(17),13,15,18-tetraen-6-yl]-3-methyl-1-oxopentan-2-yl]-2-(dimethylamino)-3-phenylpropanamide | 12306074 | Click to see | 631.80 | unknown | https://doi.org/10.1016/0031-9422(90)80207-W |
| N-[1-[(13Z)-10-benzyl-16-methoxy-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.3.1.03,7]nonadeca-1(19),13,15,17-tetraen-6-yl]-3-methyl-1-oxobutan-2-yl]-2-formamido-3-methylbutanamide | 102156891 | Click to see | 633.70 | unknown | https://doi.org/10.1016/S0031-9422(00)80724-4 |
| Pentanamide, 2-(dimethylamino)-3-methyl-N-[3-(1-methylethyl)-7-(2-methylpropyl)-5,8-dioxo-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-, [3R-[3R*,4S*(2S*,3S*),7S*]]- | 5370447 | Click to see CCC(C)C(C(=O)NC1C(OC2=CC=C(C=C2)C=CNC(=O)C(NC1=O)CC(C)C)C(C)C)N(C)C | 500.70 | unknown | via CMAUP database |
| Scutianine C | 45268911 | Click to see | 534.70 | unknown | via CMAUP database |
| Zizyphine A | 6324833 | Click to see CCC(C)C(C(=O)N1CCC2C1C(=O)N3CCCC3C(=O)NC=CC4=C(C=C(O2)C=C4)OC)NC(=O)C(C(C)CC)N(C)C | 611.80 | unknown | https://doi.org/10.1016/S0367-326X(01)00278-7 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters | |||||
| (-)-9-Acetoxygymnomitr-8(12)-ene | 636493 | Click to see | 262.40 | unknown | https://doi.org/10.1021/NP50040A006 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acids | |||||
| Propionic Acid | 1032 | Click to see CCC(=O)O | 74.08 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Dicarboxylic acids and derivatives | |||||
| CID 21952380 | 21952380 | Click to see | 118.09 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives | |||||
| 2-(Carboxymethyl)-2-hydroxybutanedioate;hydron | 88113319 | Click to see [H+].[H+].C(C(=O)O)C(CC(=O)[O-])(C(=O)[O-])O | 192.12 | unknown | via CMAUP database |
| > Organic acids and derivatives / Hydroxy acids and derivatives / Beta hydroxy acids and derivatives | |||||
| CID 20130941 | 20130941 | Click to see | 134.09 | unknown | via CMAUP database |
| D-Malic acid | 92824 | Click to see | 134.09 | unknown | via CMAUP database |
| L-Malic Acid | 222656 | Click to see | 134.09 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives | |||||
| (1R,3S,4S,5S)-3-((E)-3-(3,4-Dihydroxyphenyl)Acryloyloxy)-1,4,5-Trihydroxycyclohexanecarboxylic Acid | 12310830 | Click to see | 354.31 | unknown | via CMAUP database |
| Chlorogenic Acid | 1794427 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| cis-Chlorogenic acid | 1794425 | Click to see | 354.31 | unknown | via CMAUP database |
| Npc248056 | 1560034 | Click to see | 191.16 | unknown | via CMAUP database |
| Npc47993 | 37439 | Click to see | 192.17 | unknown | via CMAUP database |
| Quinic acid | 6508 | Click to see C1C(C(C(CC1(C(=O)O)O)O)O)O | 192.17 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / C-glycosyl compounds | |||||
| Ethyl alpha-D-fructofuranoside | 133590 | Click to see CCOC1(C(C(C(O1)CO)O)O)CO | 208.21 | unknown | https://doi.org/10.1248/YAKUSHI1947.101.8_700 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds | |||||
| GlyTouCan:G29155XH | 91692850 | Click to see | 342.30 | unknown | via CMAUP database |
| GlyTouCan:G80014NW | 46782954 | Click to see | 342.30 | unknown | via CMAUP database |
| Sucrose | 5988 | Click to see | 342.30 | unknown | https://doi.org/10.1007/978-3-642-48618-0_9 |
| Zizybeoside I | 11972301 | Click to see C1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)O)OC3C(C(C(C(O3)CO)O)O)O | 432.40 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides | |||||
| D-Fructose | 2723872 | Click to see | 180.16 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Hexoses | |||||
| D-Glucose | 5793 | Click to see C(C1C(C(C(C(O1)O)O)O)O)O | 180.16 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Oligosaccharides | |||||
| L-Glc(a1-2)[Glc(b1-3)]Glc(b)-O-Bn | 46173942 | Click to see | 594.60 | unknown | via CMAUP database |
| Zizybeoside II | 11968322 | Click to see | 594.60 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives | |||||
| CID 21583978 | 21583978 | Click to see | 150.09 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones | |||||
| 2,4,5,6-tetrahydro-1H-cyclopenta[d][1,3]oxazin-7-one | 5316289 | Click to see | 139.15 | unknown | https://doi.org/10.1007/BF02857741 |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones | |||||
| 8-Benzoyl-3-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-9,9-dimethyl-6,10-bis(3-methylbut-2-enyl)-4-oxatricyclo[6.3.1.01,5]dodec-5-ene-7,12-dione | 75104405 | Click to see | 602.80 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| > Organic oxygen compounds / Organooxygen compounds / Ethers / Acetals / Ketals | |||||
| Ethyl beta-fructopyranoside | 6325163 | Click to see CCOC1(C(C(C(CO1)O)O)O)CO | 208.21 | unknown | https://doi.org/10.1248/YAKUSHI1947.101.8_700 |
| > Organoheterocyclic compounds / Benzodioxoles | |||||
| Myristicin | 4276 | Click to see | 192.21 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Diazines / Pyrimidines and pyrimidine derivatives / Hydroxypyrimidines | |||||
| 5-methylpyrimidine-2,4-diol | 5274265 | Click to see | 126.11 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Diazines / Pyrimidines and pyrimidine derivatives / Pyrimidones | |||||
| Uracil | 1174 | Click to see | 112.09 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides | |||||
| D-ascorbic acid | 54690394 | Click to see C(C(C1C(=C(C(=O)O1)O)O)O)O | 176.12 | unknown | via CMAUP database |
| L-Ascorbic Acid | 54670067 | Click to see | 176.12 | unknown | via CMAUP database |
| Npc119107 | 54676536 | Click to see | 176.12 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives | |||||
| 2-amino-3,7-dihydropurin-6-one | 764 | Click to see C1=NC2=C(N1)C(=O)N=C(N2)N | 151.13 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / 6-aminopurines | |||||
| Adenine | 190 | Click to see C1=NC2=NC=NC(=C2N1)N | 135.13 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / Purinones / Hypoxanthines | |||||
| CID 790 | 790 | Click to see | 136.11 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / Xanthines | |||||
| Xanthine | 1188 | Click to see | 152.11 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Indoles and derivatives / Carbazoles / Pyrrolocarbazoles / Indolocarbazoles | |||||
| O-Desmethyl staurosporin | 5230524 | Click to see | 452.50 | unknown |
https://doi.org/10.1055/S-2007-969269 https://doi.org/10.1055/S-2007-969308 |
| > Organoheterocyclic compounds / Indoles and derivatives / Indoles / 3-alkylindoles | |||||
| Melatonin | 896 | Click to see | 232.28 | unknown | https://doi.org/10.1016/S0024-3205(03)00252-2 |
| > Organoheterocyclic compounds / Isoquinolines and derivatives / Benzylisoquinolines | |||||
| Coclaurine | 160487 | Click to see | 285.34 | unknown |
https://doi.org/10.1007/BF02857740 https://doi.org/10.1007/BF02911058 |
| Machiline | 281691 | Click to see COC1=C(C=C2C(NCCC2=C1)CC3=CC=C(C=C3)O)O | 285.34 | unknown |
https://doi.org/10.1007/BF02911058 https://doi.org/10.1007/BF02857740 |
| > Organoheterocyclic compounds / Lactones / Gamma butyrolactones | |||||
| 4-Hydroxy-4-methyl-3-(3-oxobutyl)-valeric acid gamma-lactone | 138243 | Click to see | 184.23 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Oxanes | |||||
| 1,8-Cineole | 2758 | Click to see | 154.25 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pteridines and derivatives / Alloxazines and isoalloxazines / Flavins | |||||
| Riboflavin | 493570 | Click to see | 376.40 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyridines and derivatives / Pyridinecarboxylic acids and derivatives / Pyridinecarboxylic acids | |||||
| Nicotinic Acid | 938 | Click to see | 123.11 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyrrolidines | |||||
| Daechualkaloid A | 13875298 | Click to see | 179.22 | unknown | https://doi.org/10.1007/BF02857741 |
| > Phenylpropanoids and polyketides / Cinnamaldehydes | |||||
| Cinnamaldehyde | 637511 | Click to see | 132.16 | unknown | via CMAUP database |
| cis-Cinnamaldehyde | 6428995 | Click to see | 132.16 | unknown | via CMAUP database |
| > 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 | via CMAUP database |
| cis-Cinnamic acid | 5372954 | Click to see C1=CC=C(C=C1)C=CC(=O)O | 148.16 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives | |||||
| [(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-(4-hydroxyphenyl)-7-methoxy-4-oxo-5,6-dihydrochromen-6-yl]oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate | 5321319 | Click to see | 800.80 | unknown | via CMAUP database |
| > 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 | via CMAUP database |
| P-Coumaric Acid | 637542 | Click to see | 164.16 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins | |||||
| Scopoletin | 5280460 | Click to see | 192.17 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Anthocyanidins | |||||
| Flavylium | 145858 | Click to see C1=CC=C(C=C1)C2=[O+]C3=CC=CC=C3C=C2 | 207.25 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids | |||||
| (-)-Epiafzelechin-(4beta-8)-(-)-epicatechin | 10239837 | Click to see | 562.50 | unknown | https://doi.org/10.1007/BF02291535 |
| (-)-Epicatechin-(4beta->8)-(-)-epigallocatechin | 14284603 | Click to see | 594.50 | unknown | https://doi.org/10.1007/BF02291535 |
| (2R,3R,4R)-4-[(2R,3R,4R)-4-[(2R,3R,4S)-4-[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol | 162969754 | Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC(=C4C5C(C(OC6=C(C(=CC(=C56)O)O)C7C(C(OC8=C(C(=CC(=C78)O)O)C9C(C(OC1=CC(=CC(=C91)O)O)C1=CC=C(C=C1)O)O)C1=CC(=C(C(=C1)O)O)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O | 1475.30 | unknown | https://doi.org/10.1007/BF02291535 |
| (2R,3R,4R)-4-[(2R,3S,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R,4S)-4-[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol | 163192134 | Click to see | 1459.30 | unknown | https://doi.org/10.1007/BF02291535 |
| (2R,3R,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol | 15403180 | Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC=C(C=C7)O)O)C8=CC(=C(C=C8)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O | 850.80 | unknown | https://doi.org/10.1007/BF02291535 |
| (2R,3R,4S)-4-[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol | 15403179 | Click to see | 866.80 | unknown | https://doi.org/10.1007/BF02291535 |
| (2R,3R)-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol | 15403178 | Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC=C(C=C5)O)O)O)O)C6=CC(=C(C(=C6)O)O)O)O | 578.50 | unknown | https://doi.org/10.1007/BF02291535 |
| 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol | 73193906 | Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC=C(C=C7)O)O)C8=CC(=C(C=C8)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O | 850.80 | unknown | https://doi.org/10.1007/BF02291535 |
| 2-(3,4-dihydroxyphenyl)-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol | 5089688 | Click to see | 562.50 | unknown | https://doi.org/10.1007/BF02291535 |
| 4-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol | 73193905 | Click to see | 866.80 | unknown | https://doi.org/10.1007/BF02291535 |
| 4-[2-(3,4-dihydroxyphenyl)-4-[4-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol | 162898516 | Click to see | 1459.30 | unknown | https://doi.org/10.1007/BF02291535 |
| 4-[4-[4-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol | 162969753 | Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC(=C4C5C(C(OC6=C(C(=CC(=C56)O)O)C7C(C(OC8=C(C(=CC(=C78)O)O)C9C(C(OC1=CC(=CC(=C91)O)O)C1=CC=C(C=C1)O)O)C1=CC(=C(C(=C1)O)O)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O | 1475.30 | unknown | https://doi.org/10.1007/BF02291535 |
| 8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol | 73193904 | Click to see | 578.50 | unknown | https://doi.org/10.1007/BF02291535 |
| Epicatechin-(4beta->8)-gallocatechin | 14284599 | Click to see | 594.50 | unknown | https://doi.org/10.1007/BF02291535 |
| Proanthocyanidin B2 | 5320711 | Click to see | 578.50 | unknown | via CMAUP database |
| Procyanidin B | 130556 | Click to see | 578.50 | unknown | https://doi.org/10.1007/BF02291535 |
| Procyanidin B2, (+)- | 122738 | Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O | 578.50 | unknown | https://doi.org/10.1007/BF02291535 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins | |||||
| (-)-Catechol | 73160 | Click to see | 290.27 | unknown | via CMAUP database |
| (+)-Epicatechin | 182232 | Click to see | 290.27 | unknown | via CMAUP database |
| 2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol | 1203 | Click to see | 290.27 | unknown | https://doi.org/10.1007/BF02291535 |
| Catechin | 9064 | Click to see | 290.27 | unknown | https://doi.org/10.1007/BF02291535 |
| Epicatechin | 72276 | Click to see | 290.27 | unknown |
https://doi.org/10.1016/J.BSE.2013.04.001 https://doi.org/10.1007/BF02291535 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Catechin gallates | |||||
| (-)-Epicatechin gallate | 107905 | Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O | 442.40 | unknown | https://doi.org/10.1007/BF02291535 |
| (+)-Catechin 3-Gallate | 5276454 | Click to see | 442.40 | unknown | https://doi.org/10.1007/BF02291535 |
| 2-(3,4-Dihydroxyphenyl)-5,7-Dihydroxychroman-3-Yl 3,4,5-Trihydroxybenzoate | 367141 | Click to see | 442.40 | unknown | https://doi.org/10.1007/BF02291535 |
| Epigallocatechin Gallate | 65064 | Click to see | 458.40 | unknown | https://doi.org/10.1007/BF02291535 |
| Tea, ext. | 1287 | Click to see | 458.40 | unknown | https://doi.org/10.1007/BF02291535 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Epigallocatechins | |||||
| (-)-Gallocatechin | 9882981 | Click to see | 306.27 | unknown | https://doi.org/10.1016/J.BSE.2013.04.001 |
| Epigallocatechin | 72277 | Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O | 306.27 | unknown | https://doi.org/10.1007/BF02291535 |
| Flavan-3,3',4',5,5',7-hexol | 1249 | Click to see | 306.27 | unknown | https://doi.org/10.1007/BF02291535 |
| Gallocatechin | 65084 | Click to see | 306.27 | unknown | https://doi.org/10.1007/BF02291535 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavan-3-ols | |||||
| (-)-Epiafzelechin | 443639 | Click to see | 274.27 | unknown | https://doi.org/10.1007/BF02291535 |
| 2-(4-Hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol | 282014 | Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC=C(C=C3)O)O | 274.27 | unknown | https://doi.org/10.1007/BF02291535 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones / Flavanonols | |||||
| 3,5,7-Trihydroxy-2-(4-Hydroxyphenyl)Chroman-4-One | 662 | Click to see | 288.25 | unknown | https://doi.org/10.1016/J.BSE.2013.04.001 |
| Aromadendrin | 122850 | Click to see C1=CC(=CC=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O | 288.25 | unknown | https://doi.org/10.1016/J.BSE.2013.04.001 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones | |||||
| Quercetin-7-olate | 46906036 | Click to see | 301.23 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols | |||||
| Kaempferol | 5280863 | Click to see | 286.24 | unknown | https://doi.org/10.1055/S-2007-969308 |
| Myricetin | 5281672 | Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O | 318.23 | unknown | https://doi.org/10.1055/S-2007-969308 |
| Quercetin | 5280343 | Click to see | 302.23 | unknown | https://doi.org/10.1016/J.BSE.2013.04.001 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides | |||||
| [(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxochromen-6-yl]-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate | 11972349 | Click to see | 784.70 | unknown | via CMAUP database |
| [(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxochromen-6-yl]-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxybenzoate | 101616452 | Click to see | 728.60 | unknown | via CMAUP database |
| [(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-7-methyl-4-oxochromen-6-yl]-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate | 5316122 | Click to see CC1=CC2=C(C(=O)C=C(O2)C3=CC=C(C=C3)O)C(=C1C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)COC(=O)C=CC6=CC(=C(C=C6)O)OC)O)O)O)O | 768.70 | unknown | via CMAUP database |
| 5-Hydroxy-2-(4-Hydroxyphenyl)-7-Methoxy-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Chromen-4-One | 369636 | Click to see | 446.40 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| 5,7-Dihydroxy-2-(4-Hydroxyphenyl)-6-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Chromen-4-One | 4475102 | Click to see | 432.40 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| 6-[(2S,3R,4S,5S,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one | 160702278 | Click to see | 594.50 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| 6-[4,5-Dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one | 14730433 | Click to see | 608.50 | unknown |
https://doi.org/10.1016/S0040-4020(00)00842-5 https://doi.org/10.1007/S10600-011-9936-Y |
| 6-beta-D-Glucopyranosyl-4',5-dihydroxy-7-methoxyflavone | 44258316 | Click to see | 446.40 | unknown | via CMAUP database |
| 6-Feruloylspinosin | 73157747 | Click to see | 784.70 | unknown |
https://doi.org/10.1016/S0040-4020(00)00842-5 https://doi.org/10.1007/S10600-011-9936-Y |
| 6'''-Feruloylspinosin | 21597353 | Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OC3C(C(C(OC3C4=C(C=C5C(=C4O)C(=O)C=C(O5)C6=CC=C(C=C6)O)OC)CO)O)O)O)O)O)O | 784.70 | unknown |
https://doi.org/10.1016/S0040-4020(00)00842-5 https://doi.org/10.1007/S10600-011-9936-Y |
| 6'''-Sinapoylspinosin | 101616450 | Click to see | 814.70 | unknown | via CMAUP database |
| Glucoisovitexin | 323971 | Click to see | 594.50 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| Isovitexin | 162350 | Click to see | 432.40 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| isovitexin 2''-O-glucoside | 185995 | Click to see | 594.50 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| Spinosin | 155692 | Click to see | 608.50 | unknown |
https://doi.org/10.1016/S0040-4020(00)00842-5 https://doi.org/10.1248/CPB.45.1186 https://doi.org/10.1007/S10600-011-9936-Y https://doi.org/10.1007/BF02856299 |
| Swertisin | 124034 | Click to see | 446.40 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides | |||||
| [(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5S,6S)-4,5-dihydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxochromen-8-yl]-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate | 163105240 | Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OC3C(C(C(OC3C4=C(C=C(C5=C4OC(=CC5=O)C6=CC=C(C=C6)O)O)OC)CO)O)O)O)O)O)O | 784.70 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| 5,7-dihydroxy-2-(4-hydroxyphenyl)-6,8-bis[(2S,4R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one | 44257674 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C(=C3O2)C4C(C(C(C(O4)CO)O)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O | 594.50 | unknown | https://doi.org/10.1248/CPB.45.1186 |
| Isospinosin | 11801844 | Click to see | 608.50 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| Vicenin 2 | 442664 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C(=C3O2)C4C(C(C(C(O4)CO)O)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O | 594.50 | unknown | via CMAUP database |
| Vitexin | 5280441 | Click to see | 432.40 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides | |||||
| (2S,3R,4S,5S,6R)-2-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-chroman-5-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol | 10343835 | Click to see C1C(C(OC2=C1C(=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C=C4)O)O)O | 452.40 | unknown | via CMAUP database |
| Flavocommelitin 4'-beta-D-glucopyranoside | 44258346 | Click to see | 608.50 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides | |||||
| 2-(2,3-Dihydroxyphenyl)-5,7-dihydroxy-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one | 53399169 | Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=C(C(=CC=C5)O)O)O)O)O)O)O)O | 610.50 | unknown | via CMAUP database |
| 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,5R)-3,4,5-trihydroxy-6-[[(2R,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one | 44259100 | Click to see | 610.50 | unknown | via CMAUP database |
| 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl D-galactopyranoside | 11751616 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O | 464.40 | unknown | via CMAUP database |
| Hyperasid | 90657624 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)[O-] | 463.40 | unknown | via CMAUP database |
| Hyperoside | 5281643 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O | 464.40 | unknown | https://doi.org/10.1021/JF302848U |
| Isoquercetin | 5280804 | Click to see | 464.40 | unknown | via CMAUP database |
| Kaempferol-3-O-Rutinoside | 5318767 | Click to see | 594.50 | unknown | via CMAUP database |
| Rutin | 5280805 | Click to see | 610.50 | unknown | https://doi.org/10.1016/J.BSE.2013.04.001 |
| Vitamin P | 5293655 | Click to see | 610.50 | unknown | https://doi.org/10.1021/JF302848U |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides | |||||
| Isocytisoside 7-O-glucoside | 44257882 | Click to see | 608.50 | unknown | via CMAUP database |
| Kaempferol 7-neohesperidoside | 5483905 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=C3)OC(=C(C4=O)O)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O | 594.50 | unknown | via CMAUP database |
| Saponarin | 441381 | Click to see | 594.50 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Hydroxyflavonoids / 7-hydroxyflavonoids | |||||
| (2S,3S)-2-(3,4-dihydroxyphenyl)-3-methyl-3,4-dihydro-2H-chromene-5,7-diol | 44445800 | Click to see | 288.29 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 3-O-methylated flavonoids | |||||
| Chrysoeriol | 5280666 | Click to see | 300.26 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Isoflavonoids / Coumestans | |||||
| Coumestrol | 5281707 | Click to see C1=CC2=C(C=C1O)OC3=C2C(=O)OC4=C3C=CC(=C4)O | 268.22 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Isoflavonoids / Isoflavonoid C-glycosides | |||||
| [6-[4,5-Dihydroxy-2-[5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4-oxochromen-8-yl]-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate | 162987097 | Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OC3C(C(C(OC3C4=C(C=C(C5=C4OC=C(C5=O)C6=CC=C(C=C6)O)O)OC)CO)O)O)O)O)O)O | 784.70 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| 7-hydroxy-3-(4-hydroxyphenyl)-8-((2S,3S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)chromen-4-one | 53384442 | Click to see | 416.40 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| 7-Hydroxy-3-(4-hydroxyphenyl)-8-(3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)chromen-4-one | 5385074 | Click to see | 416.40 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| 8-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5-hydroxy-3-(4-hydroxyphenyl)-7-methoxychromen-4-one | 163016249 | Click to see | 608.50 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| 8-[4,5-Dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5-hydroxy-3-(4-hydroxyphenyl)-7-methoxychromen-4-one | 163016248 | Click to see | 608.50 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| Puerarin | 5281807 | Click to see C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3C4C(C(C(C(O4)CO)O)O)O)O)O | 416.40 | unknown | https://doi.org/10.1016/S0040-4020(00)00842-5 |
| > Phenylpropanoids and polyketides / Phenylpropanoic acids | |||||
| 3-Phenylpropionate | 4740700 | Click to see C1=CC=C(C=C1)CCC(=O)[O-] | 149.17 | unknown | via CMAUP database |
| Benzenepropanoic acid | 107 | Click to see | 150.17 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins | |||||
| Ellagic Acid | 5281855 | Click to see | 302.19 | unknown | via CMAUP database |
| Pseudolaroside B | 98774697 | Click to see COC1=C(C=CC(=C1)C(=O)O)OC2C(C(C(C(O2)CO)O)O)O | 330.29 | unknown | via CMAUP database |
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