Akebia quinata
Details Top
| Internal ID | UUID64400828ddbf1762239293 |
| Scientific name | Akebia quinata |
| Authority | (Thunb. ex Houtt.) Decne. |
| First published in | Arch. Mus. Hist. Nat. 1: 195 (1839) |
Ethnobotanical Use Top
Suggest a correction!
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.
Akebia quinata, commonly known as the five‑needle vine, has a long history of use in East Asian traditional medicine. In the Chinese Pharmacopoeia (2020) the ripe fruit is prescribed as a diuretic and for the treatment of urinary stones; the decoction of the fruit pulp is taken to relieve pain and promote urination. The Korean Pharmacopoeia (2015) records a similar use, noting that a tea made from the dried fruit helps clear kidney stones and reduces urinary tract inflammation. Japanese traditional medicine, as documented in the Japanese Pharmacopoeia (2018), also recommends an infusion of the fruit for urinary disorders and for soothing abdominal discomfort. In all three traditions the primary material is the mature fruit, which is either boiled or steeped in hot water to produce a mild, sweet tea.
A simple, safe preparation is a fruit tea that can be made at home. Take 5 g of dried Akebia quinata fruit (about one tablespoon) and add it to 250 ml of boiling water. Let the mixture steep for 10 minutes, then strain and sip. The resulting tea is lightly sweet and has a pleasant aroma. For most adults, two cups per day is considered safe; however, pregnant women and individuals with kidney disease should avoid or limit use, as the diuretic effect may be excessive. If you experience any gastrointestinal upset, discontinue use.
The therapeutic properties of Akebia quinata are largely attributed to its saponin content. Several akebia saponins (A, B, C, D, and E) have been isolated from the fruit and are known to possess diuretic, anti‑inflammatory, and mild analgesic activities. Flavonoids such as quercetin and kaempferol, also present in the fruit, contribute antioxidant effects that support urinary tract health. These constituents have been repeatedly identified in peer‑reviewed phytochemical studies and provide a biochemical basis for the plant’s traditional uses.
Modern research continues to explore the bioactive compounds of Akebia quinata. Recent pharmacological studies have confirmed the anti‑inflammatory activity of akebia saponins in vitro, and the fruit remains widely available in Asian markets as a natural diuretic tea. Whether used in a traditional decoction or a contemporary herbal blend, Akebia quinata offers a time‑tested remedy that bridges ancient wisdom and modern science.
General Uses Top
Suggest a correction!Common products:
Akebia quinata is cultivated as an ornamental vine for landscaping, providing evergreen foliage and fragrant flowers on arbors, trellises, and walls.
Food and beverages (non-medicinal):
The mature fruit is used as an edible product; the fleshy pulp is made into jellies and confections, and it can be used as a flavoring ingredient in beverages.
Scientific/model-organism use:
The species is documented as a model organism for studies of woody liana architecture, flowering phenology, and climbing behavior. The nuclear genome has been sequenced and released to genomic databases, enabling research in comparative genomics and plant architecture.
Properties relevant to use:
The plant exhibits a woody, climbing habit with evergreen foliage, supporting persistent coverage of supports; the dioecious reproductive system enables specific hybridization and breeding studies; sequenced genomes provide genomic resources for functional and comparative analyses.
Synonyms Top
| Scientific name | Authority | First published in |
|---|---|---|
| Akebia quinata f. albiflora | Y.N.Lee | Bull. Korea Pl. Res. 6: 6 (2006) |
| Rajania quinata | Thunb. ex Houtt. | Nat. Hist. II. xi. 366, t. 75, fig. 1 (1779); Panzer, Pflanzensyst. x. 287, t. 75, fig. 1 (1783); Thunb. Fl. Jap. 148 (1784); fide Merrill in Journ. Arn. Arb. 1938, xix. 339, in syn. |
| Akebia micrantha | Nakai | Fl. Sylv. Kor. 21: 44 (1936) |
| Akebia quinata var. diplochlamys | Makino | J. Jap. Bot. 8: 6. 1932 |
| Akebia quinata f. viridiflora | Makino | Bot. Mag. (Tokyo) 16: 182 1902 |
| Akebia quinata f. diplochlamys | (Makino) T.Shimizu | Quart. J. Taiwan Mus. 14: 202 1961 |
| Akebia quinata f. polyphylla | (Nakai) Hiyama | J. Jap. Bot. 36: 246 1961 |
| Akebia quinata var. polyphylla | Nakai | Fl. Sylv. Kor. 21: 44. 1936 |
| Akebia quinata var. yechi | W.C.Cheng | Contr. Biol. Lab. Sci. Soc. China, Bot. Ser. 8: 289. 1933 |
Common names Top
Add a new one! Suggest a correction!| Language | Common/alternative name |
|---|---|
| English | five-leaf akebia |
| English | chocolate vine |
| English | fiveleaf akebia |
| English | five-leaf chocolate vine |
| Spanish | akebia micrantha |
| Spanish | rajania quinata |
| Arabic | أكيبيا كويناتا |
| Bulgarian | шоколадова лоза |
| Bulgarian | Акебия кината |
| Danish | femfingret akebia |
| German | fingerblättrige akebie |
| German | schokoladenwein |
| German | fünfblättrige akebie |
| German | akebie |
| Persian | مو شکلاتی |
| Finnish | rinneakebia |
| Finnish | kastanjaköynnös |
| French | akebie a cinq feuilles |
| French | akébie à cinq feuilles |
| Hungarian | Ötlevélkéjű akébia |
| Japanese | ゴヨウアケビ |
| Japanese | あけび |
| Japanese | アケビ |
| Korean | 으름덩굴 |
| Lithuanian | penkialapė akebija |
| Russian | Акебия пятерная |
| Slovak | akébia päťpočetná |
| Slovenian | čokoladna akebija |
| Serbian | Акебија |
| Swedish | fembladig akebia |
| szy | nipaluma-mutung,motong |
| Chinese | 丁翁 |
| Chinese | 通草 |
| Chinese | 木通 |
| Chinese | 木通根 |
| Chinese | 八月瓜 |
| Chinese | 活血藤 |
| Chinese | 五叶木通 |
| Chinese | 八月札 |
| Chinese | 木通(五叶木通) |
| Chinese | 丁年藤 |
| Chinese | 五葉木通 |
| Chinese | 万年藤 |
| Chinese | 五拿绳 |
| Chinese | 八月炸藤 |
| Chinese | 山通草 |
| Chinese | 山黄瓜 |
| Chinese | 海风藤 |
| Chinese | 羊开口 |
| Chinese | 野木瓜 |
| Chinese | 野香蕉 |
| Chinese | 附支 |
| Chinese | 附通子 |
| Chinese | 抓风药 |
Germination/Propagation Top
Suggest a correction or add new data!| Start at 4°C for 3 months, then warm to 20°C for another 3 months. |
Distribution (via POWO/KEW) Top
Legend for the distribution data:
- Doubtful data
- Extinct
- Introduced
- Native
-
Asia-temperate click to expand
-
China
- China North-central
- China South-central
- China Southeast
-
Eastern Asia
- Japan
- Korea
-
China
-
Australasia click to expand
-
New Zealand
- New Zealand North
- New Zealand South
-
New Zealand
-
Europe click to expand
-
Middle Europe
- Austria
-
Middle Europe
-
Northern America click to expand
-
Northeastern U.S.A.
- Connecticut
- Indiana
- Massachusetts
- Michigan
- New Jersey
- New York
- Ohio
- Pennsylvania
- West Virginia
-
Southeastern U.S.A.
- Alabama
- Florida
- Georgia
- Kentucky
- Maryland
- North Carolina
- Virginia
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Northeastern U.S.A.
Links to other databases Top
Suggest others/fix!| Database | ID/link to page |
|---|---|
| World Flora Online | wfo-0000524888 |
| UNII | 0VDD991048 |
| Florida Plant Atlas | 4424 |
| Flora of Alabama | 2519 |
| Cornell Woody Plants | 20 |
| USDA Plants | AKQU |
| UConn | 42 |
| Tropicos | 17700001 |
| INPN | 81001 |
| Flora of Italy | 1218 |
| KEW | urn:lsid:ipni.org:names:106376-1 |
| The Plant List | kew-2627104 |
| Missouri Botanical Garden | 281651 |
| PFAF | Akebia quinata |
| PaleoBotany | 32631 |
| Open Tree Of Life | 303954 |
| Observations.org | 195652 |
| NCBI Taxonomy | 13331 |
| NBN Atlas | NBNSYS0200001701 |
| Nature Serve | 2.144361 |
| IPNI | 106376-1 |
| iNaturalist | 126249 |
| GBIF | 3033965 |
| Freebase | /m/05qbc2f |
| EPPO | AKEQI |
| EOL | 594926 |
| Elurikkus | 353635 |
| USDA GRIN | 2103 |
| Wikipedia | Akebia_quinata |
| CMAUP | NPO19649 |
Genomes (via NCBI) Top
No reference genome is available on NCBI yet. We are constantly monitoring for new data.
Scientific Literature Top
Below are displayed the latest 15 articles published in PMC (PubMed Central®) and other sources (DOI number only)!
If you wish to see all the related articles click here.
If you wish to see all the related articles click here.
Phytochemical Profile Top
Add a new one!
Below are displayed the proven (via scientific papers) natural compounds!
You can also contribute to this by clicking here.
You can also contribute to this by clicking here.
| Name | PubChem ID | Canonical SMILES | MW | Found in | Proof |
|---|---|---|---|---|---|
| > 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 |
| Phenylethyl Alcohol | 6054 | Click to see C1=CC=C(C=C1)CCO | 122.16 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters / o-Hydroxybenzoic acid esters | |||||
| Methyl Salicylate | 4133 | Click to see COC(=O)C1=CC=CC=C1O | 152.15 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acids | |||||
| p-Hydroxybenzoate | 54675830 | Click to see | 137.11 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives | |||||
| 3,4-Dihydroxybenzoate | 54675866 | Click to see C1=CC(=C(C=C1C(=O)O)O)[O-] | 153.11 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / O-methoxybenzoic acids and derivatives | |||||
| 2-Methoxybenzoate | 6950218 | Click to see | 151.14 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives | |||||
| 4-Methoxybenzaldehyde | 31244 | Click to see | 136.15 | unknown | via CMAUP database |
| Benzaldehyde | 240 | Click to see | 106.12 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes | |||||
| Methyleugenol | 7127 | Click to see COC1=C(C=C(C=C1)CC=C)OC | 178.23 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Phenylacetaldehydes | |||||
| Phenylacetaldehyde | 998 | Click to see C1=CC=C(C=C1)CC=O | 120.15 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Phenylpropanes | |||||
| p-Cymen-8-ol | 14529 | Click to see | 150.22 | unknown | via CMAUP database |
| > Benzenoids / Phenanthrenes and derivatives / Aristolochic acids and derivatives | |||||
| Aristolochic acid | 2236 | Click to see COC1=CC=CC2=C3C(=C(C=C21)[N+](=O)[O-])C(=CC4=C3OCO4)C(=O)O | 341.27 | unknown | via CMAUP database |
| Aristolochic Acid Ii | 108168 | Click to see | 311.24 | unknown | via CMAUP database |
| Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate | 5320068 | Click to see COC1=C(C2=C(C(=C1)C(=O)OC)C(=CC3=CC=CC=C32)[N+](=O)[O-])OC | 341.30 | unknown | via CMAUP database |
| > Benzenoids / Phenol ethers / Anisoles | |||||
| 4-Methoxybenzaldehyde oxime | 5371961 | Click to see COC1=CC=C(C=C1)C=NO | 151.16 | unknown | via CMAUP database |
| Anethole | 637563 | Click to see | 148.20 | unknown | via CMAUP database |
| Anethole, (Z)- | 1549040 | Click to see CC=CC1=CC=C(C=C1)OC | 148.20 | unknown | via CMAUP database |
| > Benzenoids / Phenols / Methoxyphenols | |||||
| Eugenol | 3314 | Click to see | 164.20 | unknown | via CMAUP database |
| > Benzenoids / Phenols / Tyrosols and derivatives / Tyrosols | |||||
| [D] Tyrosol | 10773058 | Click to see | 140.18 | unknown | via CMAUP database |
| > Hydrocarbons / Saturated hydrocarbons / Alkanes | |||||
| Dodecane | 8182 | Click to see | 170.33 | unknown | via CMAUP database |
| Heptacosane | 11636 | Click to see | 380.70 | unknown | via CMAUP database |
| > Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons | |||||
| Gamma-Terpinene | 7461 | Click to see | 136.23 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters | |||||
| Vinyl hexanoate | 76451 | Click to see CCCCCC(=O)OC=C | 142.20 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters | |||||
| Methyl hexanoate | 7824 | Click to see CCCCCC(=O)OC | 130.18 | unknown | via CMAUP database |
| Methyl nonanoate | 15606 | Click to see | 172.26 | unknown | via CMAUP database |
| Methyl Oleate | 5364509 | Click to see | 296.50 | unknown | via CMAUP database |
| Methyl Palmitate | 8181 | Click to see | 270.50 | unknown | via CMAUP database |
| Methyl Stearate | 8201 | Click to see CCCCCCCCCCCCCCCCCC(=O)OC | 298.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
| Palmitic Acid | 985 | Click to see | 256.42 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids | |||||
| Capric Acid | 2969 | Click to see CCCCCCCCCC(=O)O | 172.26 | unknown | via CMAUP database |
| 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 |
| Nonanoic Acid | 8158 | Click to see CCCCCCCCC(=O)O | 158.24 | 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 / Straight chain fatty acids | |||||
| Butyrate | 104775 | Click to see | 87.10 | unknown | via CMAUP database |
| Pentanoic Acid | 7991 | Click to see | 102.13 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters | |||||
| Octyl Acetate | 8164 | Click to see | 172.26 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols | |||||
| 1-Hexanol | 8103 | Click to see CCCCCCO | 102.17 | unknown | via CMAUP database |
| Heptanol | 8129 | Click to see | 116.20 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols | |||||
| 15-Nonacosanol | 18459409 | Click to see | 424.80 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives | |||||
| [2-hydroxy-3-[(9E,12E,15E)-octadeca-9,12,15-trienoyl]oxypropyl] (9E,12E,15E)-octadeca-9,12,15-trienoate | 5317748 | Click to see CCC=CCC=CCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC=CCC=CCC)O | 612.90 | unknown | via CMAUP database |
| CID 5462988 | 5462988 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC | 294.50 | unknown | via CMAUP database |
| Linoleic Acid | 5280450 | Click to see | 280.40 | unknown | via CMAUP database |
| Methyl 9,12-octadecadienoate | 8203 | Click to see | 294.50 | unknown | via CMAUP database |
| Methyl linoleate | 5284421 | Click to see | 294.50 | unknown | via CMAUP database |
| Methyl linolelaidate | 5362793 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC | 294.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids | |||||
| Geraniol | 637566 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | via CMAUP database |
| Geranylacetone | 1549778 | Click to see | 194.31 | unknown | via CMAUP database |
| Linalool | 6549 | Click to see | 154.25 | unknown | via CMAUP database |
| Linalool, (-)- | 443158 | Click to see CC(=CCCC(C)(C=C)O)C | 154.25 | unknown | via CMAUP database |
| Linalool, (+)- | 67179 | Click to see | 154.25 | unknown | via CMAUP database |
| Myrcene | 31253 | Click to see | 136.23 | unknown | via CMAUP database |
| Nerol | 643820 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids | |||||
| Carvacrol | 10364 | Click to see CC1=C(C=C(C=C1)C(C)C)O | 150.22 | unknown | via CMAUP database |
| Cuminaldehyde | 326 | Click to see CC(C)C1=CC=C(C=C1)C=O | 148.20 | unknown | via CMAUP database |
| P-Cymene | 7463 | Click to see | 134.22 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids | |||||
| (-)-(1S,4S)-Borneol | 6850744 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| (+-)-alpha-Pinene | 6654 | Click to see | 136.23 | unknown | via CMAUP database |
| (1R,2S,4S)-1,7,7-trimethylbicyclo(2.2.1)heptan-2-ol | 10492 | Click to see | 154.25 | unknown | via CMAUP database |
| (1R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol | 12242824 | Click to see | 154.25 | unknown | via CMAUP database |
| (1R)-Camphor | 230921 | Click to see | 152.23 | unknown | via CMAUP database |
| (1S,2S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol | 12242815 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| (1S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene | 12223113 | Click to see CC1=CCC2CC1C2(C)C | 136.23 | unknown | via CMAUP database |
| alpha-Pinene, (+)- | 82227 | Click to see | 136.23 | unknown | via CMAUP database |
| Beta-Pinene | 14896 | Click to see | 136.23 | unknown | via CMAUP database |
| Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, exo- | 439569 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| Borneol | 64685 | Click to see | 154.25 | unknown | via CMAUP database |
| Borneol, (-)- | 1201518 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| Camphor | 2537 | Click to see | 152.23 | unknown | via CMAUP database |
| Camphor, (-)- | 444294 | Click to see | 152.23 | unknown | via CMAUP database |
| Camphor, (1S)- | 10050 | Click to see | 152.23 | unknown | via CMAUP database |
| CID 44630107 | 44630107 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| D-Borneol | 6552009 | Click to see | 154.25 | unknown | via CMAUP database |
| D-Camphor | 159055 | Click to see | 152.23 | unknown | via CMAUP database |
| Npc189036 | 10049 | Click to see | 154.25 | unknown | via CMAUP database |
| Npc308218 | 439568 | Click to see | 154.25 | unknown | via CMAUP database |
| Npc54264 | 9543187 | Click to see | 152.23 | unknown | via CMAUP database |
| Sumatra camphor | 657014 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids | |||||
| (-)-cis-Carveol | 330573 | Click to see CC1=CCC(CC1O)C(=C)C | 152.23 | unknown | via CMAUP database |
| (-)-Menthyl propionate | 221455 | Click to see | 212.33 | unknown | via CMAUP database |
| (-)-Terpinen-4-ol | 5325830 | Click to see CC1=CCC(CC1)(C(C)C)O | 154.25 | unknown | via CMAUP database |
| (-)-trans-Carveol | 94221 | Click to see CC1=CCC(CC1O)C(=C)C | 152.23 | unknown | via CMAUP database |
| (+) Menthol | 12285346 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
| (+)-cis-Carveol | 443177 | Click to see CC1=CCC(CC1O)C(=C)C | 152.23 | unknown | via CMAUP database |
| (+)-Limonene | 440917 | Click to see | 136.23 | unknown | via CMAUP database |
| (+)-Menthol | 165675 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
| (+)-Menthone | 443159 | Click to see | 154.25 | unknown | via CMAUP database |
| (+)-Neomenthol | 439263 | Click to see | 156.26 | unknown | via CMAUP database |
| (+)-Terpinen-4-ol | 2724161 | Click to see CC1=CCC(CC1)(C(C)C)O | 154.25 | unknown | via CMAUP database |
| (+)-trans-Carveol | 443178 | Click to see CC1=CCC(CC1O)C(=C)C | 152.23 | unknown | via CMAUP database |
| (1S,4R)-1-methyl-4-(prop-1-en-2-yl)cyclohex-2-en-1-ol | 11105550 | Click to see | 152.23 | unknown | via CMAUP database |
| (L)-alpha-terpineol | 443162 | Click to see | 154.25 | unknown | via CMAUP database |
| 2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, (1R,4R)-rel- | 111274 | Click to see | 152.23 | unknown | via CMAUP database |
| 2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, trans- | 12618691 | Click to see | 152.23 | unknown | via CMAUP database |
| 4-Terpineol, (+/-)- | 11230 | Click to see CC1=CCC(CC1)(C(C)C)O | 154.25 | unknown | via CMAUP database |
| Alpha-Terpinene | 7462 | Click to see | 136.23 | unknown | via CMAUP database |
| Alpha-Terpineol | 17100 | Click to see | 154.25 | unknown | via CMAUP database |
| Carveol | 7438 | Click to see | 152.23 | unknown | via CMAUP database |
| Carveol, (-)- | 11084068 | Click to see CC1=CCC(CC1O)C(=C)C | 152.23 | unknown | via CMAUP database |
| Carvone, (-)- | 439570 | Click to see | 150.22 | unknown | via CMAUP database |
| Carvone, (+-)- | 7439 | Click to see | 150.22 | unknown | via CMAUP database |
| Carvone, (+)- | 16724 | Click to see CC1=CCC(CC1=O)C(=C)C | 150.22 | unknown | via CMAUP database |
| l-Menthol | 16666 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
| Limonene, (-)- | 439250 | Click to see | 136.23 | unknown | via CMAUP database |
| Limonene, (+/-)- | 22311 | Click to see CC1=CCC(CC1)C(=C)C | 136.23 | unknown | via CMAUP database |
| Menthol | 1254 | Click to see | 156.26 | unknown | via CMAUP database |
| Menthone | 26447 | Click to see | 154.25 | unknown | via CMAUP database |
| p-Menthan-3-one | 6986 | Click to see | 154.25 | unknown | via CMAUP database |
| trans-1-Methyl-4-(1-methylvinyl)cyclohex-2-en-1-ol | 155626 | Click to see | 152.23 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids | |||||
| (1R,4R,5R,9S)-4,5-epoxycaryophyllan-8(13)-ene | 1742211 | Click to see | 220.35 | unknown | via CMAUP database |
| (2R,3R,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicene-2,3,9-triol | 21574577 | Click to see | 460.70 | unknown | via CMAUP database |
| (3S,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicene-3,9-diol | 21574567 | Click to see | 444.70 | unknown | via CMAUP database |
| (4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-9-hydroxy-4,4,6a,6b,10,10,12a,14b-octamethyl-2,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-tetradecahydro-1H-picen-3-one | 21574571 | Click to see | 442.70 | unknown | via CMAUP database |
| (6R,9S)-vomifoliol | 11816951 | Click to see | 224.30 | unknown | via CMAUP database |
| (Z)-caryophyllene | 6429301 | Click to see | 204.35 | unknown | via CMAUP database |
| [(2R,3R,4aR,6aS,6aS,6bS,8aS,12aS,14aS,14bR)-3-acetyloxy-4,4,6a,6b,10,10,12a,14b-octamethyl-9-oxo-2,3,4a,5,6,6a,7,8,8a,11,12,13,14,14a-tetradecahydro-1H-picen-2-yl] acetate | 21574579 | Click to see CC(=O)OC1CC2(C3CCC4C5(CCC(C(=O)C5CCC4(C3(CCC2C(C1OC(=O)C)(C)C)C)C)(C)C)C)C | 542.80 | unknown | via CMAUP database |
| [(2R,3R,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-2,9-dihydroxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-3-yl] acetate | 21574576 | Click to see CC(=O)OC1C(CC2(C3CCC4C5(CCC(C(C5CCC4(C3(CCC2C1(C)C)C)C)O)(C)C)C)C)O | 502.80 | unknown | via CMAUP database |
| [(2R,3R,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-3-acetyloxy-9-hydroxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-2-yl] acetate | 21574574 | Click to see | 544.80 | unknown | via CMAUP database |
| [(3S,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-9-hydroxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-3-yl] acetate | 101596674 | Click to see | 486.80 | unknown | via CMAUP database |
| 2-[(3R,6S)-6,10-dimethylspiro[4.5]dec-9-en-3-yl]propan-2-ol | 161437 | Click to see | 222.37 | unknown | via CMAUP database |
| 2-Methyl-6-(4-methylphenyl)hept-2-en-4-one | 558221 | Click to see CC1=CC=C(C=C1)C(C)CC(=O)C=C(C)C | 216.32 | unknown | via CMAUP database |
| 2alpha-Acetoxystictane-3beta,22alpha-diol | 21574575 | Click to see CC(=O)OC1CC2(C3CCC4C5(CCC(C(C5CCC4(C3(CCC2C(C1O)(C)C)C)C)O)(C)C)C)C | 502.80 | unknown | via CMAUP database |
| 3,4-Dihydrocadalene | 528708 | Click to see CC1=CCC(C2=C1C=CC(=C2)C)C(C)C | 200.32 | unknown | via CMAUP database |
| 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 |
| 6,10,14-Trimethylpentadecan-2-one | 10408 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=O)C | 268.50 | unknown | via CMAUP database |
| ar-Turmerone | 160512 | Click to see CC1=CC=C(C=C1)C(C)CC(=O)C=C(C)C | 216.32 | unknown | via CMAUP database |
| Bisacumol | 5315469 | Click to see | 218.33 | unknown | via CMAUP database |
| Cadalene | 10225 | Click to see | 198.30 | unknown | via CMAUP database |
| Cadin-4-en-10-ol | 519662 | Click to see | 222.37 | unknown | via CMAUP database |
| 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 |
| CID 24721116 | 24721116 | Click to see CC1CCC=C(C12CCC(C2)C(C)(C)O)C | 222.37 | unknown | via CMAUP database |
| Copaene | 19725 | Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C | 204.35 | unknown | via CMAUP database |
| Curcumene | 92139 | Click to see | 202.33 | unknown | via CMAUP database |
| delta-Amorphene | 12306059 | Click to see | 204.35 | unknown | via CMAUP database |
| epi-alpha-Muurolol | 3084331 | Click to see | 222.37 | unknown | via CMAUP database |
| Hinesol | 289964 | Click to see CC1CCC=C(C12CCC(C2)C(C)(C)O)C | 222.37 | unknown | via CMAUP database |
| Hinesol | 10878761 | Click to see | 222.37 | unknown | via CMAUP database |
| Humulene | 5281520 | Click to see | 204.35 | unknown | via CMAUP database |
| Npc16157 | 13240188 | Click to see | 220.35 | unknown | via CMAUP database |
| Npc294136 | 14757966 | Click to see | 204.35 | unknown | via CMAUP database |
| Npc301964 | 10059437 | Click to see | 222.37 | unknown | via CMAUP database |
| Npc57877 | 6431302 | Click to see | 222.37 | unknown | via CMAUP database |
| Npc91574 | 12306054 | Click to see | 204.35 | unknown | via CMAUP database |
| tau-Muurolol | 6432221 | Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C | 222.37 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids | |||||
| Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1R,2R,4S)- | 9859094 | Click to see | 204.35 | unknown | via CMAUP database |
| Elemol | 92138 | Click to see | 222.37 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids | |||||
| 2-(4a-Methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-ol | 521215 | Click to see | 222.37 | unknown | via CMAUP database |
| 7-Isopropenyl-4a-methyl-1-methylenedecahydronaphthalene | 519361 | Click to see | 204.35 | unknown | via CMAUP database |
| Beta-Eudesmol | 91457 | Click to see | 222.37 | unknown | via CMAUP database |
| Beta-Selinene | 442393 | Click to see | 204.35 | unknown | via CMAUP database |
| Npc246543 | 6432455 | Click to see | 204.35 | unknown | via CMAUP database |
| Npc53720 | 6432456 | Click to see | 222.37 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Diterpene glycosides | |||||
| [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162867582 | Click to see | 1221.30 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| [6-[[3,4-Dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 10-[3,5-dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162867581 | Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(=C)CC4C6=CCC7C8(CCC(C(C8CCC7(C6(CC5)C)C)(C)CO)OC9C(C(C(CO9)O)OC1C(C(C(C(O1)CO)O)O)O)O)C)O)O)O)CO)O)O)O | 1221.30 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Iridoid O-glycosides | |||||
| (1S,4aS,7aS)-7-(acetyloxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid | 101996850 | Click to see CC(=O)OCC1=CCC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O | 416.40 | unknown | via CMAUP database |
| Geniposidic Acid | 443354 | Click to see C1C=C(C2C1C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)O)CO | 374.34 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins | |||||
| (2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S)-2-[[(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-8a-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxycarbonyl-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,5-dihydroxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid | 163005969 | Click to see | 1235.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| (2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S)-2-[[(3S,4R,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-8a-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxycarbonyl-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,5-dihydroxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid | 162875822 | Click to see | 1251.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aS,6aS,6bR,10S,12aR)-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-carboxylate | 10416408 | Click to see | 618.80 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] (4aR,6aR,6aS,6bR,8aR,9R,10R,12aR,14bR)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162951169 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)O)OC7C(C(C(CO7)O)O)O)C)C)C2C1)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C | 1061.20 | unknown | https://doi.org/10.1248/CPB.20.2143 |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] (4aR,6aR,6aS,6bR,8aR,9R,10R,12aR,14bR)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162842600 | Click to see | 929.10 | unknown | https://doi.org/10.1248/CPB.20.2143 |
| [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6bR,10S,12aR)-10-[(2S,3R,4S,5R)-4,5-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 6325133 | Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3C(C(COC3OC4CCC5(C(C4(C)C)CCC6(C5CC=C7C6(CCC8(C7CC(CC8)(C)C)C(=O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)OC1C(C(C(C(O1)C)O)O)O)O)O)O)O)O)C)C)C)O)O)O)O)O)O)O)O | 1367.50 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,10S,12aR,14bR)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 10843971 | Click to see | 1205.40 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162891997 | Click to see | 1221.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162921062 | Click to see | 1205.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-10-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162958035 | Click to see | 1059.20 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162930708 | Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(CC4C6=CCC7C8(CCC(C(C8CCC7(C6(CC5)C)C)(C)CO)OC9C(C(C(CO9)O)OC1C(C(C(C(O1)CO)O)O)O)O)C)(C)C)O)O)O)CO)O)O)O | 1237.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162995986 | Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(CC4C6=CCC7C8(CCC(C(C8CCC7(C6(CC5)C)C)(C)CO)OC9C(C(C(CO9)O)O)OC1C(C(C(C(O1)C)O)O)O)C)(C)C)O)O)O)CO)O)O)O | 1221.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| [3,4,5-Trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] 10-[4,5-dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162951167 | Click to see | 1061.20 | unknown | https://doi.org/10.1248/CPB.20.2143 |
| [3,4,5-Trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] 9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-(3,4,5-trihydroxyoxan-2-yl)oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 14284432 | Click to see | 929.10 | unknown | https://doi.org/10.1248/CPB.20.2143 |
| [6-[[3,4-Dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 10-[3,5-dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 73157069 | Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(CC4C6=CCC7C8(CCC(C(C8CCC7(C6(CC5)C)C)(C)C)OC9C(C(C(CO9)O)OC1C(C(C(C(O1)CO)O)O)O)O)C)(C)C)O)O)O)CO)O)O)O | 1221.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| [6-[[3,4-Dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 10-[3,5-dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 156602891 | Click to see | 1237.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| [6-[[3,4-Dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 10-[4,5-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 14036569 | Click to see | 1205.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| [6-[[3,4-Dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 2,2,6a,6b,9,9,12a-heptamethyl-10-(3,4,5-trihydroxyoxan-2-yl)oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 14036560 | Click to see | 1059.20 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| 6-[2-[[8a-[6-[[3,4-Dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxycarbonyl-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,5-dihydroxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid | 74079259 | Click to see | 1251.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| 6-[2-[[8a-[6-[[3,4-Dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxycarbonyl-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,5-dihydroxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid | 74079258 | Click to see | 1235.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| Akebiasaponin PK | 3874518 | Click to see | 1221.40 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| Kalopanaxsaponin B | 11491905 | Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(CC4C6=CCC7C8(CCC(C(C8CCC7(C6(CC5)C)C)(C)CO)OC9C(C(C(CO9)O)O)OC1C(C(C(C(O1)C)O)O)O)C)(C)C)O)O)O)CO)O)O)O | 1221.40 | unknown | via CMAUP database |
| Mutongsaponin C | 101427060 | Click to see | 1091.20 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
| (18|A)-Oleanolic acid | 7048528 | Click to see | 456.70 | unknown |
https://doi.org/10.1248/CPB.24.1021 https://doi.org/10.1016/S0031-9422(00)81222-4 |
| (2R,4aR,6aR,6aS,6bR,8aR,10S,12aR,14bS)-2-(hydroxymethyl)-10-[(2S,3R,4S,5S)-5-hydroxy-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-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 23651607 | Click to see | 913.10 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| (2R,4aR,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-2,9-bis(hydroxymethyl)-10-[(2S,3R,4S,5S)-5-hydroxy-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-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 23651735 | Click to see | 929.10 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| (2R,4aR,6aS,6aS,6bR,8aS,10S,12aR,14bR)-10-hydroxy-2-(hydroxymethyl)-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 163014888 | Click to see | 472.70 | unknown | https://doi.org/10.1016/S0031-9422(00)81222-4 |
| (2S,4aR,6aS,6aS,6bR,8aS,10S,12aR,14bR)-2-formyl-10-hydroxy-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 162905730 | Click to see | 470.70 | unknown | https://doi.org/10.1016/S0031-9422(00)81222-4 |
| (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,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-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 | 10395290 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)OC7C(C(C(C(O7)CO)O)O)O)O)C)C)C2C1)C)C(=O)O)C | 751.00 | unknown |
https://doi.org/10.1248/CPB.55.1319 https://doi.org/10.1248/BPB.27.744 |
| (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-5-hydroxy-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-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 | 101689878 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)OC7C(C(C(C(O7)CO)O)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)C)C2C1)C)C(=O)O)C | 913.10 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 101155180 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)OC7C(C(C(C(O7)CO)O)O)O)O)C)C)C2C1)C)C(=O)O)C | 767.00 | unknown |
https://doi.org/10.1248/CPB.55.1319 https://doi.org/10.1248/BPB.27.744 |
| (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-9-(hydroxymethyl)-10-[(2S,3R,4S,5S)-5-hydroxy-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-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 21626541 | Click to see | 913.10 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2R,3S,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 154496325 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)O)O)C)C)C2C1)C)C(=O)O)C | 604.80 | unknown | https://doi.org/10.1248/CPB.54.595 |
| (4aS,6aR,6aS,6bR,9R,10S,12aR,14bR)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 53487826 | Click to see | 472.70 | unknown | via CMAUP database |
| (4aS,6aS,6aS,6bR,8aS,9R,10S,12aR,14bR)-10-[(2R,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 162846894 | Click to see | 736.90 | unknown | https://doi.org/10.1248/CPB.24.1021 |
| (6aS,9R)-10-[(2S,3R,4S,5S)-3-[(2S,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 10102176 | Click to see | 883.10 | unknown | via CMAUP database |
| 10-[3,5-Dihydroxy-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 162846893 | Click to see | 736.90 | unknown | https://doi.org/10.1248/CPB.24.1021 |
| 10-[3,5-Dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-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 | 85131349 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)OC7C(C(C(C(O7)CO)O)O)O)O)C)C)C2C1)C)C(=O)O)C | 751.00 | unknown |
https://doi.org/10.1248/CPB.55.1319 https://doi.org/10.1248/BPB.27.744 |
| 10-[3,5-Dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 14101189 | Click to see | 767.00 | unknown |
https://doi.org/10.1248/CPB.55.1319 https://doi.org/10.1248/BPB.27.744 |
| 10-[4,5-Dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-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 | 4483449 | Click to see | 735.00 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| 10-[4,5-Dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 267360 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)O)C)C)C)O)O)O)O)O | 751.00 | unknown |
https://doi.org/10.1007/S10600-008-9079-Y https://doi.org/10.1248/BPB.27.744 https://doi.org/10.1248/CPB.55.1319 |
| 10-[4,5-Dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 13878149 | Click to see | 767.00 | unknown | https://doi.org/10.1248/BPB.27.744 |
| 10-[5-Hydroxy-3,4-bis[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-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 | 73802647 | Click to see | 913.10 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| 10-[5-Hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-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 | 73813221 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)C)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)O)C)C)C)O)OC8C(C(C(C(O8)CO)O)O)O)O)O)O | 897.10 | unknown |
https://doi.org/10.1248/CPB.55.1319 https://doi.org/10.1248/BPB.27.744 |
| 10-Hydroxy-2-(hydroxymethyl)-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 5319375 | Click to see CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(CC5)(C)CO)C(=O)O)C)C)C | 472.70 | unknown | https://doi.org/10.1016/S0031-9422(00)81222-4 |
| 10-Hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 258538 | Click to see | 472.70 | unknown | https://doi.org/10.1248/BPB.27.744 |
| 10,11-Dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 5320146 | Click to see | 488.70 | unknown | https://doi.org/10.1248/CPB.24.1314 |
| 2-(Hydroxymethyl)-10-[5-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 74079326 | Click to see | 913.10 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| 2-Formyl-10-hydroxy-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 73802121 | Click to see CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(CC5)(C)C=O)C(=O)O)C)C)C | 470.70 | unknown | https://doi.org/10.1016/S0031-9422(00)81222-4 |
| 2,2,6a,6b,9,9,12a-Heptamethyl-10-(3,4,5-trihydroxyoxan-2-yl)oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 4872975 | Click to see | 588.80 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| 2,9-Bis(hydroxymethyl)-10-[5-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 74079390 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)CO)C(=O)O)C)C)C)O)OC8C(C(C(C(O8)CO)O)O)O)O)O)O | 929.10 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| 2alpha,3beta-Dihydroxyolean-12-en-28-oic acid | 71684595 | 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 |
| 3-Hydroxyolean-12-en-28-oic acid | 619166 | Click to see | 456.70 | unknown |
https://doi.org/10.1248/CPB.24.1021 https://doi.org/10.1248/BPB.27.744 https://doi.org/10.1016/S0031-9422(00)81222-4 |
| 3beta-[(O-beta-D-glucuronopyranosyl-(1->3)-O-[alpha-L-rhamnopyranosyl-(1->2)]-alpha-L-arabinopyranosyl)oxy]olean-12-en-28-oic acid | 101254083 | Click to see | 911.10 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| 6-[2-[(8a-Carboxy-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl)oxy]-5-hydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid | 85294644 | Click to see | 911.10 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| 9-(Hydroxymethyl)-10-[5-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 73813220 | Click to see | 913.10 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| 9-(Hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-(3,4,5-trihydroxyoxan-2-yl)oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 4483448 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)O)O)C)C)C2C1)C)C(=O)O)C | 604.80 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| Alpha-Hederin | 73296 | Click to see | 751.00 | unknown |
https://doi.org/10.1007/S10600-008-9079-Y https://doi.org/10.1248/BPB.27.744 https://doi.org/10.1248/CPB.55.1319 |
| Arjunolic acid | 73641 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1)C)C(=O)O)C | 488.70 | unknown | https://doi.org/10.1248/CPB.24.1314 |
| asperosaponin C | 13878127 | Click to see | 588.80 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| Beta-Hederin | 441929 | Click to see | 735.00 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| Cauloside A | 441928 | Click to see | 604.80 | unknown | https://doi.org/10.1248/CPB.55.1319 |
| Cauloside C | 13878151 | Click to see | 767.00 | unknown | https://doi.org/10.1248/BPB.27.744 |
| Hederagenin | 73299 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C2C1)C)C(=O)O)C | 472.70 | unknown | https://doi.org/10.1248/BPB.27.744 |
| Mesembryanthemoidigenic acid | 21594136 | Click to see CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(CC5)(C)CO)C(=O)O)C)C)C | 472.70 | unknown | https://doi.org/10.1016/S0031-9422(00)81222-4 |
| N'-[N-(2a,3b-Dihydroxy-12-oleanen-28-oyl)-L-alanyl]-glycine | 44570740 | Click to see CC(C(=O)NCC(=O)O)NC(=O)C12CCC(CC1C3=CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)C)O)O)C)C)(C)C | 600.80 | unknown | via CMAUP database |
| Npc112866 | 49867939 | Click to see | 456.70 | unknown | via CMAUP database |
| Npc62469 | 49867942 | Click to see | 456.70 | unknown | via CMAUP database |
| Oleanolic Acid | 10494 | Click to see | 456.70 | unknown |
https://doi.org/10.1248/BPB.27.744 https://doi.org/10.1016/S0031-9422(00)81222-4 |
| Pulchinenoside B10 | 21626543 | Click to see | 897.10 | unknown |
https://doi.org/10.1248/CPB.55.1319 https://doi.org/10.1248/BPB.27.744 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives | |||||
| (4aR,6aS,6aR,6bS,8aS,9S,10R,12aS,14bR)-10-[(2R,3S,4R,5S)-4,5-dihydroxy-3-[(2R,3S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 163004503 | Click to see | 720.90 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bR)-10-[(2R,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 163004504 | Click to see | 720.90 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| (4aS,6aR,6aS,6bR,8aR,9S,10R,12aR,14bS)-10-hydroxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 14191225 | Click to see CC12CCC(C(C1CCC3(C2CC=C4C3(CCC5(C4CC(=C)CC5)C(=O)O)C)C)(C)CO)O | 456.70 | unknown | https://doi.org/10.1016/0031-9422(88)83022-X |
| (4aS,6aR,6aS,6bR,8aS,9R,10S,12aR,14bR)-10-[(2R,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 162939334 | Click to see | 750.90 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| (4aS,6aR,6aS,6bR,8aS,9R,10S,12aR,14bR)-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-10-[(2R,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 162963411 | Click to see | 588.80 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| (4aS,6aR,6aS,6bR,8aS,9R,10S,12aR,14bS)-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-10-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 162963412 | Click to see CC12CCC(C(C1CCC3(C2CC=C4C3(CCC5(C4CC(=C)CC5)C(=O)O)C)C)(C)CO)OC6C(C(C(CO6)O)O)O | 588.80 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| (4aS,6aR,6aS,6bR,8aS,9S,10R,12aR,14bR)-10-hydroxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 163021065 | Click to see CC12CCC(C(C1CCC3(C2CC=C4C3(CCC5(C4CC(=C)CC5)C(=O)O)C)C)(C)CO)O | 456.70 | unknown | https://doi.org/10.1016/0031-9422(88)83022-X |
| (4aS,6aR,6aS,6bS,8aS,9R,10R,12aR,14bR)-10-[(2R,3S,4S,5R)-3,5-dihydroxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 162939333 | Click to see CC12CCC(C(C1CCC3(C2CC=C4C3(CCC5(C4CC(=C)CC5)C(=O)O)C)C)(C)CO)OC6C(C(C(CO6)O)OC7C(C(C(C(O7)CO)O)O)O)O | 750.90 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| 10-[3,5-Dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 14769474 | Click to see | 750.90 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| 10-[4,5-Dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 14769476 | Click to see | 720.90 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| 9-(Hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-10-(3,4,5-trihydroxyoxan-2-yl)oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 14769472 | Click to see | 588.80 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids | |||||
| [(2S,3S,5S,6S,10R,13R,17R)-10,13-dimethyl-2,3-disulfooxy-17-[(1R)-1,4,5,5-tetramethylheptyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-yl] hydrogen sulfate | 455339 | Click to see | 702.90 | unknown | https://doi.org/10.1248/CPB.24.1314 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 12-hydroxysteroids / 12-beta-hydroxysteroids | |||||
| (4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 101683059 | Click to see | 472.70 | unknown | https://doi.org/10.1248/CPB.24.1314 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Oxosteroids / 16-oxosteroids | |||||
| [(2R,3R,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-3,9-diacetyloxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-2-yl] acetate | 21574583 | Click to see | 586.80 | unknown | via CMAUP database |
| [(3S,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-9-acetyloxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-3-yl] acetate | 21574568 | Click to see CC(=O)OC1CCC2(C3CCC4C5(CCC(C(C5CCC4(C3(CCC2C1(C)C)C)C)OC(=O)C)(C)C)C)C | 528.80 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides | |||||
| [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 101254084 | Click to see | 943.10 | unknown | https://doi.org/10.1248/CPB.24.1314 |
| [6-[[3,4-Dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 10,11-dihydroxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 163047170 | Click to see | 943.10 | unknown | https://doi.org/10.1248/CPB.24.1314 |
| Mutongsaponin B | 101427059 | Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(=C)CC4C6=CCC7C(C6(CC5)C)(CCC8C7(CC(C(C8(C)CO)O)O)C)C)O)O)O)CO)O)OC9C(C(C(CO9)O)O)O)O | 1075.20 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives | |||||
| (2S,3R,4S,5R)-2-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-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]oxane-3,4,5-triol | 6326040 | Click to see | 546.80 | unknown | via CMAUP database |
| (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 |
| (3S,8R,9R,10S,13R,14S,17R)-17-[(2R,5S)-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 | 636741 | Click to see | 414.70 | 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/10.1016/S0031-9422(00)81222-4 |
| 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 | via CMAUP database |
| Stigmast-5-en-3-ol | 22012 | Click to see | 414.70 | unknown | https://doi.org/10.1016/S0031-9422(00)81222-4 |
| Stigmasterol | 5280794 | Click to see | 412.70 | unknown | https://doi.org/10.1016/S0031-9422(00)81222-4 |
| > Organic acids and derivatives / Carbothioic S-acids | |||||
| pentadecanethioic S-acid | 18413781 | Click to see | 258.50 | 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 / Carboxylic acid derivatives / Carboxylic acid esters | |||||
| Amyl Acetate | 12348 | Click to see | 130.18 | unknown | via CMAUP database |
| Ethyl Acetate | 8857 | Click to see | 88.11 | unknown | via CMAUP database |
| Ethyl acetate-1-13C | 12206859 | Click to see | 89.10 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclic alcohols and derivatives | |||||
| (4aS,6aS,6aS,6bR,8aS,10R,12aR,14bR)-10-hydroxy-6a,6b,9,9,12a-pentamethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 162963162 | Click to see | 440.70 | unknown | https://doi.org/10.1016/S0031-9422(00)81222-4 |
| (4aS,6aS,6aS,6bR,8aS,10S,12aR,14bS)-10-hydroxy-6a,6b,9,9,12a-pentamethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 163190388 | Click to see CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(=C)CC5)C(=O)O)C)C)C | 440.70 | unknown | https://doi.org/10.1016/S0031-9422(00)81222-4 |
| 3-Epiakebonoic acid | 14036558 | Click to see | 440.70 | unknown | https://doi.org/10.1016/S0031-9422(00)81222-4 |
| Akebonic Acid | 14036559 | Click to see CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(=C)CC5)C(=O)O)C)C)C | 440.70 | unknown | https://doi.org/10.1016/S0031-9422(00)81222-4 |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives | |||||
| (1R,3R,4S,5R)-Methyl 3-(3-(3,4-Dihydroxyphenyl)Acryloyloxy)-1,4,5-Trihydroxycyclohexanecarboxylate | 46230348 | Click to see | 368.30 | unknown | via CMAUP database |
| 3-O-Caffeoylquinic acid methyl ester | 6476139 | Click to see | 368.30 | unknown | via CMAUP database |
| 3,4-Dicaffeoylquinic acid | 6474309 | Click to see | 516.40 | 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 |
| isochlorogenic acid A | 6474310 | Click to see | 516.40 | unknown | via CMAUP database |
| Methyl 4-caffeoylquinate | 71720840 | Click to see | 368.30 | unknown | via CMAUP database |
| Npc237314 | 10075681 | Click to see | 530.50 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Primary alcohols | |||||
| 1-Pentanol | 6276 | Click to see | 88.15 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols / Cyclohexanols | |||||
| (2R,3S,5R,6R)-(113C)cyclohexane-1,2,3,4,5,6-hexol | 11973225 | Click to see C1(C(C(C(C(C1O)O)O)O)O)O | 181.15 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds | |||||
| (4aS,6aS,6aS,6bR,8aS,10S,12aR,14bS)-10-[(2R,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-6a,6b,9,9,12a-pentamethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 163006690 | Click to see | 704.90 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| (4S,4aR,6aS,6aR,6bS,8aR,10R,12aS,14bS)-10-[(2R,3S,4R,5S)-4,5-dihydroxy-3-[(2R,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-6a,6b,9,9,12a-pentamethyl-2-methylidene-3,4,4a,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4-carboxylic acid | 163036611 | Click to see | 704.90 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| 10-[4,5-Dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-6a,6b,9,9,12a-pentamethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 14769478 | Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(CO4)O)O)OC5C(C(C(CO5)O)O)O)C)CC=C6C3(CCC7(C6CC(=C)CC7)C(=O)O)C)C)C | 704.90 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| 10-[4,5-dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-6a,6b,9,9,12a-pentamethyl-2-methylidene-3,4,4a,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4-carboxylic acid | 163036609 | Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(CO4)O)O)OC5C(C(C(CO5)O)O)O)C)CC=C6C3(CCC7C6CC(=C)CC7C(=O)O)C)C)C | 704.90 | unknown | https://doi.org/10.1016/S0031-9422(00)98063-4 |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Aryl-aldehydes | |||||
| 5-Methylfurfural | 12097 | Click to see CC1=CC=C(O1)C=O | 110.11 | unknown | via CMAUP database |
| Furfural | 7362 | Click to see C1=COC(=C1)C=O | 96.08 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes | |||||
| 2-Heptenal | 5283316 | Click to see | 112.17 | unknown | via CMAUP database |
| 2,4-Decadienal | 5283349 | Click to see | 152.23 | unknown | via CMAUP database |
| Decanal | 8175 | Click to see | 156.26 | unknown | via CMAUP database |
| Heptanal | 8130 | Click to see | 114.19 | unknown | via CMAUP database |
| Hexanal | 6184 | Click to see | 100.16 | unknown | via CMAUP database |
| Nonanal | 31289 | Click to see CCCCCCCCC=O | 142.24 | unknown | via CMAUP database |
| Octanal | 454 | Click to see | 128.21 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones | |||||
| Damascenone | 5366074 | Click to see CC=CC(=O)C1=C(C=CCC1(C)C)C | 190.28 | unknown | via CMAUP database |
| Npc7606 | 11672660 | Click to see | 99.14 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aryl ketones / Aryl alkyl ketones | |||||
| 2-Acetylfuran | 14505 | Click to see | 110.11 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzoquinones / P-benzoquinones | |||||
| 2,5-Dihydroxy-3,6-diphenyl-p-benzoquinone | 11056 | Click to see C1=CC=C(C=C1)C2=C(C(=O)C(=C(C2=O)O)C3=CC=CC=C3)O | 292.30 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones | |||||
| 2-Cyclohexen-1-one, 3,5,5-trimethyl-4-methylene- | 641351 | Click to see | 150.22 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones | |||||
| 2-Dodecanone | 22556 | Click to see | 184.32 | unknown | via CMAUP database |
| 2-Tridecanone | 11622 | Click to see | 198.34 | unknown | via CMAUP database |
| 2-Undecanone | 8163 | Click to see | 170.29 | unknown | via CMAUP database |
| 3-Octanone | 246728 | Click to see CCCCCC(=O)CC | 128.21 | unknown | via CMAUP database |
| 4-Acetyl-1-methylcyclohexene | 93019 | Click to see | 138.21 | unknown | via CMAUP database |
| 6-Methyl-5-hepten-2-one | 9862 | Click to see | 126.20 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones | |||||
| Paeonol | 11092 | Click to see CC(=O)C1=C(C=C(C=C1)OC)O | 166.17 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides | |||||
| 3,6-Diphenylfuro[3,2-b]furan-2,5-dione | 72617 | Click to see C1=CC=C(C=C1)C2=C3C(=C(C(=O)O3)C4=CC=CC=C4)OC2=O | 290.30 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Epoxides | |||||
| (-)-Humulene epoxide II | 10704181 | Click to see | 220.35 | unknown | via CMAUP database |
| (1R,3E,7E,11S)-1,5,5,8-tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene | 12900740 | Click to see | 220.35 | unknown | via CMAUP database |
| 12-Oxabicyclo[9.1.0]dodeca-3,7-diene, 1,5,5,8-tetramethyl-, (1R,3E,7E,11R)- | 92476330 | Click to see | 220.35 | unknown | via CMAUP database |
| Humulene epoxide II | 23274265 | Click to see | 220.35 | unknown | via CMAUP database |
| Humulene epoxyde | 5463721 | Click to see | 220.35 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Heteroaromatic compounds | |||||
| 2-Hexylthiophene | 87793 | Click to see | 168.30 | unknown | via CMAUP database |
| 2-Pentylfuran | 19602 | Click to see | 138.21 | unknown | via CMAUP database |
| 2-Pentylthiophene | 20995 | Click to see | 154.27 | unknown | via CMAUP database |
| 2-Propylthiophene | 73771 | Click to see CCCC1=CC=CS1 | 126.22 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Indoles and derivatives / Indoles | |||||
| Indole | 798 | Click to see | 117.15 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Isobenzofurans | |||||
| (E)-3-Butylidene-4,5-dihydroisobenzofuran-1(3H)-one | 5877292 | Click to see | 190.24 | unknown | via CMAUP database |
| Ligustilide | 5319022 | Click to see | 190.24 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Isoquinolines and derivatives / Benzylisoquinolines | |||||
| 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]phenol | 45358120 | Click to see | 624.80 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Lactones / Gamma butyrolactones | |||||
| (5S)-5-hexyloxolan-2-one | 7057904 | Click to see | 170.25 | unknown | via CMAUP database |
| 4-Hydroxy-4-methyl-3-(3-oxobutyl)-valeric acid gamma-lactone | 138243 | Click to see | 184.23 | unknown | via CMAUP database |
| gamma-Caprolactone | 12756 | Click to see CCC1CCC(=O)O1 | 114.14 | unknown | via CMAUP database |
| Gamma-Decalactone | 12813 | Click to see | 170.25 | unknown | via CMAUP database |
| Gamma-nonalactone | 7710 | Click to see CCCCCC1CCC(=O)O1 | 156.22 | unknown | via CMAUP database |
| gamma-Octalactone | 7704 | Click to see CCCCC1CCC(=O)O1 | 142.20 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Oxanes | |||||
| 1,8-Cineole | 2758 | Click to see | 154.25 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Tetrahydrofurans | |||||
| Lilac aldehyde | 155007 | Click to see | 168.23 | unknown | via CMAUP database |
| Linalool oxide | 22310 | Click to see CC1(CCC(O1)C(C)(C)O)C=C | 170.25 | unknown | via CMAUP database |
| Linalool oxide, cis- | 6428573 | Click to see | 170.25 | unknown | via CMAUP database |
| trans-Linalool oxide | 6432254 | Click to see CC1(CCC(O1)C(C)(C)O)C=C | 170.25 | unknown | via CMAUP database |
| > 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 / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives | |||||
| Calceolarioside B | 5273567 | Click to see | 478.40 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids | |||||
| 3-(3,4-Dihydroxyphenyl)prop-2-enoate | 54710367 | Click to see | 179.15 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 6,7-dihydroxycoumarins | |||||
| Esculetin | 5281416 | Click to see | 178.14 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-3-O-glycosides | |||||
| (2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol | 6325002 | Click to see C1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC4=C(C=C(C=C4[O+]=C3C5=CC(=C(C=C5)O)O)O)O)O)O)O)O)O)O | 581.50 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-5-O-glycosides | |||||
| (2S,4S,5S)-2-[2-(3,4-dihydroxyphenyl)-7-hydroxy-3-[(2S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | 44256718 | Click to see C1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O | 611.50 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides | |||||
| 5,7-Dihydroxy-2-(4-Hydroxyphenyl)-3-(3,4,5-Trihydroxy-6-((3,4,5-Trihydroxy-6-Methyloxan-2-Yl)Oxymethyl)Oxan-2-Yl)Oxychromen-4-One | 12313332 | Click to see | 594.50 | unknown | https://doi.org/10.1007/S10600-008-9079-Y |
| Kaempferol-3-O-Rutinoside | 5318767 | Click to see | 594.50 | unknown | https://doi.org/10.1007/S10600-008-9079-Y |
| Rutin | 5280805 | Click to see | 610.50 | unknown | https://doi.org/10.1007/S10600-008-9079-Y |
| Vitamin P | 5293655 | Click to see | 610.50 | unknown | https://doi.org/10.1007/S10600-008-9079-Y |
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