Akebia trifoliata - Unknown
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Internal ID UUID644008290a435546013080
Scientific name Akebia trifoliata
Authority (Thunb.) Koidz.
First published in Bot. Mag. (Tokyo) 39: 310 (1925)

Description Top

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Akebia trifoliata, also known as chocolate vine, is a climbing vine with three-leafed leaves and deep purple flowers. It is closely related to Akebia quinata and can grow up to 30 feet long. This plant is hardy in USDA zones 5a to 9b and produces oblong, sweet-tasting fruits that are edible and have various health benefits. In traditional Chinese medicine, it is used to treat urinary tract infections and improve blood flow. Extracts from the fruit have been found to have diuretic, anti-inflammatory, and anti-obesity effects. The rind of the fruit contains high levels of antioxidants that may help fight cancer. Additionally, Akebia trifoliata has potential commercial uses, such as creating antibacterial pectin from its waste products. Overall, this plant is valued for its ornamental appeal and its potential culinary and medicinal uses.

Synonyms Top

Scientific name Authority First published in
Akebia trifoliata var. litoralis Konta & Katsuy. Bull. Natl. Sci. Mus. Tokyo, B 31: 134 (2005)
Akebia chaffanjonii H.Lév. Bull. Soc. Agric. Sarthe 39: 316 (1904)
Akebia chingshuiensis Shimizu Quart. J. Taiwan Mus. 14: 201 (1961)
Akebia clematidifolia Siebold & Zucc. Fl. Jap. (Siebold) 1: 146. 1841
Akebia lobata Decne. Ann. Sci. Nat., Bot. , sér. 2, 12: 107 (1839)
Akebia lobata var. australis Diels Bot. Jahrb. Syst. 29: 344 (1901)
Akebia quercifolia Siebold & Zucc. Fl. Jap. 1: 146 (1841)
Akebia sempervirens Nakai Bull. Natl. Sci. Mus. Tokyo 27: 30 (1949)
Clematis trifoliata Thunb. Trans. Linn. Soc. London 2: 337 (1794)
Akebia lobata var. clematifolia (Siebold & Zucc.) Ito J. Linn. Soc., Bot. 22: 425. 1887
Akebia lobata var. quercifoliata (Siebold & Zucc.) Ito J. Linn. Soc., Bot. 22: 425. 1887
Akebia trifoliata var. clematifolia (Siebold & Zucc.) Nakai Bull. Natl. Sci. Mus. Tokyo 27: 30. 1949
Akebia trifoliata var. honanensis T.Shimizu Quart. J. Taiwan Mus. 14: 201. 1961

Common names Top

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Language Common/alternative name
German kleeblättrige akebie
German dreiblättrige akebie
Japanese ミツバアケビ
Lithuanian trilapė akebija
Chinese 拿藤
Chinese 三葉木通
Chinese 甜果木通
Chinese 爆肚拿
Chinese 活血藤
Chinese 八月瓜
Chinese 八月瓜藤
Chinese 八月楂
Chinese 八月柞
Chinese 三叶拿藤
Chinese 木通根
Chinese 木通
Chinese 三叶木通
Chinese 八月炸

Subspecies (abbr. subsp./ssp.) Top

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Name Authority First published in
Akebia trifoliata subsp. australis (Diels) T.Shimizu Quart. J. Taiwan Mus. 14: 201. 1961 (1961)

Varieties (abbr. var.) Top

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No variety added yet.

Subvarieties (abbr. subvar.) Top

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No subvariety added yet.

Forms (abbr. f.) Top

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No forms added yet.

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
  • Asia-temperate
    • China
      • China North-central
      • China South-central
      • China Southeast
    • Eastern Asia
      • Japan
      • Taiwan

Links to other databases Top

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Database ID/link to page
World Flora Online wfo-0000524892
UNII 5ZE628M21N
Tropicos 50123986
KEW urn:lsid:ipni.org:names:462097-1
The Plant List kew-2627108
PFAF Akebia trifoliata
Open Tree Of Life 97323
NCBI Taxonomy 155132
NBN Atlas NBNSYS0500000246
IPNI 462097-1
iNaturalist 367374
GBIF 7306109
EPPO AKETF
EOL 2886350
USDA GRIN 2104
Wikipedia Akebia_trifoliata
CMAUP NPO11170

Genomes (via NCBI) Top

Below is displayed the reference genome only!
If you wish to browse all genomes for this plant click here.
Accession Assembly
Name Level Submitter Released Coverage Size
GCA_017979445.1 ASM1797944v1 Chromosome Sichuan Agriculture University 2021-04-16 92.0x 622.56 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.
Title Authors Publication Released IDs
Optimization of Composite Enzymatic Extraction, Structural Characterization and Biological Activity of Soluble Dietary Fiber from Akebia trifoliata Peel Song Y, Sun G, Wang D, Chen J, Lv J, Jiang S, Zhang G, Yu S, Zheng H Molecules 01-May-2024
PMCID:PMC11085559
doi:10.3390/molecules29092085
PMID:38731576
α‐Hederin induces paraptosis by targeting GPCRs to activate Ca2+/MAPK signaling pathway in colorectal cancer Rao X, Li Z, Zhang Q, Lai Y, Liu J, Li L, Cheng H, Shen W, Sun D Cancer Med 25-Apr-2024
PMCID:PMC11043672
doi:10.1002/cam4.7202
PMID:38659391
Conserved DNA sequence analysis reveals the phylogeography and evolutionary events of Akebia trifoliata in the region across the eastern edge of the Tibetan Plateau and subtropical China Dong Q, Zhang Y, Zhong S, Zhang Q, Yang H, Yang H, Yi X, Tan F, Chen C, Luo P BMC Ecol Evol 23-Apr-2024
PMCID:PMC11040917
doi:10.1186/s12862-024-02243-0
PMID:38654171
Genome-Wide Identification of the WRKY Gene Family and Functional Characterization of CpWRKY5 in Cucurbita pepo Chen J, Tao F, Xue Y, Xu B, Li X Int J Mol Sci 10-Apr-2024
PMCID:PMC11049939
doi:10.3390/ijms25084177
PMID:38673762
Isolation, Purification and Tyrosinase Inhibitory Activity of Anthocyanins and Their Novel Degradation Compounds from Solanum tuberosum L. Ouyang J, Hu N, Wang H Molecules 27-Mar-2024
PMCID:PMC11013068
doi:10.3390/molecules29071492
PMID:38611771
Microencapsulation of Tecoma stans Extracts: Bioactive Properties Preservation and Physical Characterization Analysis García-Jiménez JR, Luna-Guevara ML, Luna-Guevara JJ, Conde-Hernández LA, Ramos-Cassellis ME, Hernández-Cocoletzi H Foods 25-Mar-2024
PMCID:PMC11011495
doi:10.3390/foods13071001
PMID:38611307
Chromosome-level genome assembly provides insights into the genome evolution and functional importance of the phenylpropanoid–flavonoid pathway in Thymus mongolicus Dang Z, Xu Y, Zhang X, Mi W, Chi Y, Tian Y, Liu Y, Ren W BMC Genomics 19-Mar-2024
PMCID:PMC10949689
doi:10.1186/s12864-024-10202-8
PMID:38504151
Effectiveness of adjuvant traditional Chinese medicine on macrovascular invasion in patients with hepatocellular carcinoma: a real-world propensity score-matched study Yan H, Wang X, Yu L, Liu X, Yan F, Xie Y, Pu Q, Yang Z Front Pharmacol 23-Feb-2024
PMCID:PMC10923102
doi:10.3389/fphar.2024.1353720
PMID:38464727
Physicochemical, structural, and functional characterization of guar meal protein isolate (Cyamopsis tetragonoloba) Kotnala B, Panneerselvam V, Vijayakumar AK Heliyon 20-Jan-2024
PMCID:PMC10838761
doi:10.1016/j.heliyon.2024.e24925
PMID:38318049
Physiological Mechanisms of Citrus Fruit Cracking: Study on Cell Wall Components, Osmoregulatory Substances, and Antioxidant Enzyme Activities Huang S, Yang X, Wang T, Li H, Deng L, Bi X, Hu J, Gong Y, Li Y, Qin Z, Yao Y, Sun G, Liao L, Zhang M, He S, Jiang L, Wang Z Plants (Basel) 16-Jan-2024
PMCID:PMC10820700
doi:10.3390/plants13020257
PMID:38256810
Preliminary exploration of herbal tea products based on traditional knowledge and hypotheses concerning herbal tea selection: a case study in Southwest Guizhou, China Long X, Ranjitkar S, Waldstein A, Wu H, Li Q, Geng Y J Ethnobiol Ethnomed 02-Jan-2024
PMCID:PMC10763305
doi:10.1186/s13002-023-00645-w
PMID:38169414
Global Analysis of the WOX Transcription Factor Family in Akebia trifoliata Chen S, Yang H, Zhang Y, Chen C, Ren T, Tan F, Luo P Curr Issues Mol Biol 19-Dec-2023
PMCID:PMC10814775
doi:10.3390/cimb46010002
PMID:38275662
A cornucopia of diversity—Ranunculales as a model lineage Becker A, Bachelier JB, Carrive L, Conde e Silva N, Damerval C, Del Rio C, Deveaux Y, Di Stilio VS, Gong Y, Jabbour F, Kramer EM, Nadot S, Pabón-Mora N, Wang W J Exp Bot 18-Dec-2023
PMCID:PMC10967251
doi:10.1093/jxb/erad492
PMID:38109712
Genome-Wide Analysis of the Polygalacturonase Gene Family Sheds Light on the Characteristics, Evolutionary History, and Putative Function of Akebia trifoliata Yi X, Chen W, Guan J, Zhu J, Zhang Q, Yang H, Yang H, Zhong S, Chen C, Tan F, Ren T, Luo P Int J Mol Sci 30-Nov-2023
PMCID:PMC10707396
doi:10.3390/ijms242316973
PMID:38069295
SSR molecular marker developments and genetic diversity analysis of Zanthoxylum nitidum (Roxb.) DC Zhu Y, Ma T, Lin Y, Peng Y, Huang Y, Jiang J Sci Rep 26-Nov-2023
PMCID:PMC10679188
doi:10.1038/s41598-023-48022-7
PMID:38008750

Phytochemical Profile Top

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Below are displayed the proven (via scientific papers) natural compounds!
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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 / Methoxybenzoic acids and derivatives / O-methoxybenzoic acids and derivatives
2-Methoxybenzoate 6950218 Click to see COC1=CC=CC=C1C(=O)[O-] 151.14 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives
Benzaldehyde 240 Click to see C1=CC=C(C=C1)C=O 106.12 unknown via CMAUP database
p-Anisaldehyde 31244 Click to see COC1=CC=C(C=C1)C=O 136.15 unknown https://doi.org/10.5650/JOS.56.59
> 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
2-(4-Methylphenyl)propan-2-ol 14529 Click to see CC1=CC=C(C=C1)C(C)(C)O 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 C1OC2=C(O1)C3=C(C(=C2)C(=O)O)C(=CC4=CC=CC=C43)[N+](=O)[O-] 311.24 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 CC=CC1=CC=C(C=C1)OC 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 COC1=C(C=CC(=C1)CC=C)O 164.20 unknown via CMAUP database
> Hydrocarbons / Saturated hydrocarbons / Alkanes
Dodecane 8182 Click to see CCCCCCCCCCCC 170.33 unknown via CMAUP database
Heptacosane 11636 Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCC 380.70 unknown via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
gamma-Terpinene 7461 Click to see CC1=CCC(=CC1)C(C)C 136.23 unknown via CMAUP database
> Lignans, neolignans and related compounds / Lignan glycosides
(2S,3R,4S,5S,6R)-2-[4-[(3R,3aS,6R,6aS)-3a,6a-dihydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,4,6-tetrahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 102529865 Click to see COC1=CC(=CC(=C1O)OC)C2C3(COC(C3(CO2)O)C4=CC(=C(C(=C4)OC)OC5C(C(C(C(O5)CO)O)O)O)OC)O 612.60 unknown https://doi.org/10.1002/MRC.2152
(4-hydroxy-3,5-dimethoxyphenyl)-[(3R,4R,5S)-5-(4-hydroxy-3,5-dimethoxyphenyl)-4-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxolan-3-yl]methanone 102232701 Click to see COC1=CC(=CC(=C1O)OC)C2C(C(CO2)C(=O)C3=CC(=C(C(=C3)OC)O)OC)COC4C(C(C(C(O4)CO)O)O)O 596.60 unknown https://doi.org/10.1002/MRC.2152
(4-hydroxy-3,5-dimethoxyphenyl)-[(3S,4S,5R)-5-(4-hydroxy-3,5-dimethoxyphenyl)-4-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxolan-3-yl]methanone 162955316 Click to see COC1=CC(=CC(=C1O)OC)C2C(C(CO2)C(=O)C3=CC(=C(C(=C3)OC)O)OC)COC4C(C(C(C(O4)CO)O)O)O 596.60 unknown https://doi.org/10.1002/MRC.2152
(4-Hydroxy-3,5-dimethoxyphenyl)-[5-(4-hydroxy-3,5-dimethoxyphenyl)-4-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxolan-3-yl]methanone 162955315 Click to see COC1=CC(=CC(=C1O)OC)C2C(C(CO2)C(=O)C3=CC(=C(C(=C3)OC)O)OC)COC4C(C(C(C(O4)CO)O)O)O 596.60 unknown https://doi.org/10.1002/MRC.2152
2-[4-[3a,6a-Dihydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,4,6-tetrahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 162912050 Click to see COC1=CC(=CC(=C1O)OC)C2C3(COC(C3(CO2)O)C4=CC(=C(C(=C4)OC)OC5C(C(C(C(O5)CO)O)O)O)OC)O 612.60 unknown https://doi.org/10.1002/MRC.2152
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters
2,8-Decadiene-4,6-diynoic acid, methyl ester, (Z,Z)- 5319306 Click to see CC=CC#CC#CC=CC(=O)OC 174.20 unknown via CMAUP database
Vinyl hexanoate 76451 Click to see CCCCCC(=O)OC=C 142.20 unknown https://doi.org/10.5650/JOS.56.59
> 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 CCCCCCCCC(=O)OC 172.26 unknown https://doi.org/10.5650/JOS.56.59
Methyl oleate 5364509 Click to see CCCCCCCCC=CCCCCCCCC(=O)OC 296.50 unknown via CMAUP database
Methyl palmitate 8181 Click to see CCCCCCCCCCCCCCCC(=O)OC 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 CCCCCCCCCCCCCCCC(=O)O 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
Caproic Acid 8892 Click to see CCCCCC(=O)O 116.16 unknown via CMAUP database
Heptanoic Acid 8094 Click to see CCCCCCC(=O)O 130.18 unknown via CMAUP database
Lauric Acid 3893 Click to see CCCCCCCCCCCC(=O)O 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
Butanoate 104775 Click to see CCCC(=O)[O-] 87.10 unknown via CMAUP database
Valeric acid 7991 Click to see CCCCC(=O)O 102.13 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters
Octyl Acetate 8164 Click to see CCCCCCCCOC(=O)C 172.26 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
1-Heptanol 8129 Click to see CCCCCCCO 116.20 unknown https://doi.org/10.5650/JOS.56.59
1-Hexanol 8103 Click to see CCCCCCO 102.17 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Annonaceous acetogenins
2-methyl-4-[8,9,13-trihydroxy-13-[5-(1-hydroxytridecyl)oxolan-2-yl]-3-oxotridecyl]-2H-furan-5-one 73238317 Click to see CCCCCCCCCCCCC(C1CCC(O1)C(CCCC(C(CCCCC(=O)CCC2=CC(OC2=O)C)O)O)O)O 610.90 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
CID 5462988 5462988 Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC 294.50 unknown via CMAUP database
Linoleic Acid 5280450 Click to see CCCCCC=CCC=CCCCCCCCC(=O)O 280.40 unknown via CMAUP database
Methyl linoleate 5284421 Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC 294.50 unknown via CMAUP database
Methyl linolelaidate 5362793 Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC 294.50 unknown via CMAUP database
Methyl octadeca-9,12-dienoate 8203 Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC 294.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids
(E,7R,11R)-3,7,11,15-tetramethyloctadec-2-en-1-ol 163191143 Click to see CCCC(C)CCCC(C)CCCC(C)CCCC(=CCO)C 324.60 unknown https://doi.org/10.5650/JOS.56.59
Methylphytol 129664483 Click to see CCC(C)CCCC(C)CCCC(C)CCCC(=CCO)C 310.60 unknown https://doi.org/10.5650/JOS.56.59
> 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 CC(=CCCC(=CCCC(=O)C)C)C 194.31 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 CC(=CCCC(C)(C=C)O)C 154.25 unknown via CMAUP database
Linalool, (+/-)- 6549 Click to see CC(=CCCC(C)(C=C)O)C 154.25 unknown via CMAUP database
Myrcene 31253 Click to see CC(=CCCC(=C)C=C)C 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 CC1=CC=C(C=C1)C(C)C 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
(-)-Camphor 444294 Click to see CC1(C2CCC1(C(=O)C2)C)C 152.23 unknown via CMAUP database
(+)-alpha-Pinene 82227 Click to see CC1=CCC2CC1C2(C)C 136.23 unknown via CMAUP database
(1R,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-OL 12242824 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 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
1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol 64685 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
alpha-PINENE 6654 Click to see CC1=CCC2CC1C2(C)C 136.23 unknown via CMAUP database
beta-Pinene 14896 Click to see CC1(C2CCC(=C)C1C2)C 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 6552009 Click to see CC1(C2CCC1(C(C2)O)C)C 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 CC1(C2CCC1(C(=O)C2)C)C 152.23 unknown via CMAUP database
Camphor (synthetic) 159055 Click to see CC1(C2CCC1(C(=O)C2)C)C 152.23 unknown via CMAUP database
Camphor, (1S,4S)-(-)- 10050 Click to see CC1(C2CCC1(C(=O)C2)C)C 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-2-Bornanone 9543187 Click to see CC1(C2CCC1(C(=O)C2)C)C 152.23 unknown via CMAUP database
d-Camphor 230921 Click to see CC1(C2CCC1(C(=O)C2)C)C 152.23 unknown via CMAUP database
DL-2-Bornanol 10049 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
DL-Borneol 10492 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
endo-2-Bornanol 439568 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 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
(-)-alpha-Terpineol 443162 Click to see CC1=CCC(CC1)C(C)(C)O 154.25 unknown via CMAUP database
(-)-cis-Carveol 330573 Click to see CC1=CCC(CC1O)C(=C)C 152.23 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
(+)-Menthol 165675 Click to see CC1CCC(C(C1)O)C(C)C 156.26 unknown via CMAUP database
(+)-Menthone 443159 Click to see CC1CCC(C(=O)C1)C(C)C 154.25 unknown via CMAUP database
(+)-Neomenthol 439263 Click to see CC1CCC(C(C1)O)C(C)C 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
(1r,4r)-1-Methyl-4-(prop-1-en-2-yl)cyclohex-2-en-1-ol 111274 Click to see CC(=C)C1CCC(C=C1)(C)O 152.23 unknown via CMAUP database
(1S,4R)-1-methyl-4-(prop-1-en-2-yl)cyclohex-2-enol 11105550 Click to see CC(=C)C1CCC(C=C1)(C)O 152.23 unknown via CMAUP database
2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, trans- 12618691 Click to see CC(=C)C1CCC(C=C1)(C)O 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 CC1=CC=C(CC1)C(C)C 136.23 unknown via CMAUP database
Alpha-Terpineol 17100 Click to see CC1=CCC(CC1)C(C)(C)O 154.25 unknown via CMAUP database
Carveol 7438 Click to see CC1=CCC(CC1O)C(=C)C 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 CC1=CCC(CC1=O)C(=C)C 150.22 unknown via CMAUP database
Carvone, (+)- 16724 Click to see CC1=CCC(CC1=O)C(=C)C 150.22 unknown via CMAUP database
Carvone, (+/-)- 7439 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
l-Menthyl propionate 221455 Click to see CCC(=O)OC1CC(CCC1C(C)C)C 212.33 unknown via CMAUP database
Limonene, (-)- 439250 Click to see CC1=CCC(CC1)C(=C)C 136.23 unknown via CMAUP database
Limonene, (+)- 440917 Click to see CC1=CCC(CC1)C(=C)C 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 CC1CCC(C(C1)O)C(C)C 156.26 unknown via CMAUP database
Menthone 26447 Click to see CC1CCC(C(=O)C1)C(C)C 154.25 unknown via CMAUP database
P-Mentha-2,8-dien-1-ol 155626 Click to see CC(=C)C1CCC(C=C1)(C)O 152.23 unknown via CMAUP database
p-Menthan-3-one 6986 Click to see CC1CCC(C(=O)C1)C(C)C 154.25 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
(-)-Hinesol 10878761 Click to see CC1CCC=C(C12CCC(C2)C(C)(C)O)C 222.37 unknown via CMAUP database
(+)(-)-(E)-beta-caryophyllene 14757966 Click to see CC1(CC2C1CCC(=C)CCCC2=C)C 204.35 unknown via CMAUP database
(2S,5R,10R)-alpha,alpha,6,10-Tetramethylspiro[4.5]dec-6-ene-2-methanol 10059437 Click to see CC1CCC=C(C12CCC(C2)C(C)(C)O)C 222.37 unknown via CMAUP database
(Z)-caryophyllene 6429301 Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C 204.35 unknown via CMAUP database
2-[(3R,6S)-6,10-dimethylspiro[4.5]dec-9-en-3-yl]propan-2-ol 161437 Click to see CC1CCC=C(C12CCC(C2)C(C)(C)O)C 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
3,4-Dihydrocadalene 528708 Click to see CC1=CCC(C2=C1C=CC(=C2)C)C(C)C 200.32 unknown via CMAUP database
4-Isopropyl-1,6-dimethyl-1,2,3,4,4a,7,8,8a-octahydro-1-naphthalenol 519662 Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C 222.37 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
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
alpha-Cadinol #1 6431302 Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C 222.37 unknown via CMAUP database
alpha-Curcumene 92139 Click to see CC1=CC=C(C=C1)C(C)CCC=C(C)C 202.33 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 https://doi.org/10.5650/JOS.56.59
beta-CARYOPHYLLENE OXIDE 1742210 Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C 220.35 unknown via CMAUP database
Bisacumol 5315469 Click to see CC1=CC=C(C=C1)C(C)CC(C=C(C)C)O 218.33 unknown via CMAUP database
Cadalene 10225 Click to see CC1=CC2=C(C=CC(=C2C=C1)C)C(C)C 198.30 unknown via CMAUP database
Caryophyllene 5281515 Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C 204.35 unknown via CMAUP database
Caryophyllene epoxide 14350 Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C 220.35 unknown via CMAUP database
Caryophyllene oxide 2 13240188 Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C 220.35 unknown via CMAUP database
Caryophyllene,alpha + beta mixt. 5354499 Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C 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
delta-Cadinene 12306054 Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C 204.35 unknown via CMAUP database
Hinesol 289964 Click to see CC1CCC=C(C12CCC(C2)C(C)(C)O)C 222.37 unknown via CMAUP database
Humulene 5281520 Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C 204.35 unknown via CMAUP database
Isocaryophyllene oxide 1742211 Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C 220.35 unknown via CMAUP database
Naphthalene, 1,2,3,5,6,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, (1S-cis)- 12306059 Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C 204.35 unknown via CMAUP database
T-Muurolol 3084331 Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C 222.37 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 CC(=C)C1CCC(C(C1)C(=C)C)(C)C=C 204.35 unknown via CMAUP database
Elemol 92138 Click to see CC(=C)C1CC(CCC1(C)C=C)C(C)(C)O 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 CC12CCCC(=C)C1CC(CC2)C(C)(C)O 222.37 unknown via CMAUP database
2-Naphthalenemethanol, decahydro-alpha,alpha,4a-trimethyl-8-methylene-, [2R-(2alpha,4aalpha,8abeta)]- 6432456 Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O 222.37 unknown via CMAUP database
7-Isopropenyl-4a-methyl-1-methylenedecahydronaphthalene 519361 Click to see CC(=C)C1CCC2(CCCC(=C)C2C1)C 204.35 unknown via CMAUP database
beta-EUDESMOL 91457 Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O 222.37 unknown via CMAUP database
beta-Selinene 442393 Click to see CC(=C)C1CCC2(CCCC(=C)C2C1)C 204.35 unknown via CMAUP database
Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethenyl)-, [2R-(2alpha,4aalpha,8abeta)]- 6432455 Click to see CC1=CCCC2(C1CC(CC2)C(=C)C)C 204.35 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,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,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-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-carboxylate 21607575 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)C)OC9C(C(C(CO9)O)O)OC1C(C(C(C(O1)CO)O)O)O)C)O)O)O)CO)O)O)O 1205.30 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[(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,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3S,4R,5S)-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-carboxylate 162999094 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)C)OC9C(C(C(CO9)O)O)OC1C(C(C(CO1)O)O)O)C)O)O)O)CO)O)O)O 1175.30 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[(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,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 101427061 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/10.1016/J.PHYTOCHEM.2006.09.003
[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-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 163043706 Click to see CC12CCC3C(C1CC=C4C2(CCC5(C4CC(=C)CC5)C(=O)OC6C(C(C(C(O6)CO)O)O)O)C)(CC(C(C3(C)CO)O)O)C 634.80 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[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/10.1016/J.PHYTOCHEM.2006.09.003
[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-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-carboxylate 162999093 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)C)OC9C(C(C(CO9)O)O)OC1C(C(C(CO1)O)O)O)C)O)O)O)CO)O)O)O 1175.30 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[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-(hydroxymethyl)oxan-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-carboxylate 14283359 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)C)OC9C(C(C(CO9)O)O)OC1C(C(C(C(O1)CO)O)O)O)C)O)O)O)CO)O)O)O 1205.30 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
Mutongsaponin A 101427058 Click to see CC12CCC3C(C1CC=C4C2(CCC5(C4CC(=C)CC5)C(=O)OC6C(C(C(C(O6)CO)O)O)O)C)(CC(C(C3(C)CO)O)O)C 634.80 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-5-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2R,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 162932680 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)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)O)C 1237.40 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[(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] (1S,2R,4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate 162907986 Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)O)O)O)O 959.10 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[(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,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(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 163034793 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)O)OC1C(C(C(C(O1)CO)O)O)O)C)(C)C)O)O)O)CO)O)O)O 1221.40 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[(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 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)O)OC1C(C(C(C(O1)C)O)O)O)C)(C)C)O)O)O)CO)O)O)O 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,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,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 101065820 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.51.960
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-5-[(2R,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-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-carboxylate 162994479 Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(CC4C6=CCC7C(C6(CC5)C)(CCC8C7(CC(C(C8(C)CO)O)O)C)C)(C)C)O)O)O)CO)O)OC9C(C(C(CO9)O)O)O)O 1091.20 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-5-[(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-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-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-carboxylate 101254086 Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(CC4C6=CCC7C(C6(CC5)C)(CCC8C7(CC(C(C8(C)CO)O)O)C)C)(C)C)O)O)O)CO)O)OC9C(C(C(CO9)O)O)O)O 1091.20 unknown https://doi.org/10.1248/CPB.51.960
[(5S)-3,4,5-trihydroxy-6-[[(4S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] (6aS,9R)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(3R,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 134694889 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)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O)C 929.10 unknown https://doi.org/10.4268/CJCMM20111611
[3,4,5-Trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] 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-carboxylate 162932677 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)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)O)C 1237.40 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[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 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.51.960
[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-(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 14283356 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)O)OC1C(C(C(C(O1)CO)O)O)O)C)(C)C)O)O)O)CO)O)O)O 1221.40 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[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-[5-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-(3,4,5-trihydroxyoxan-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 162980673 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)OC1C(C(C(CO1)O)O)O)C)(C)C)O)O)O)CO)O)O)O 1353.50 unknown https://doi.org/10.1248/CPB.51.960
[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-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 56657544 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)O)C)(C)C)O)O)O)CO)O)O)O 927.10 unknown https://doi.org/10.1248/CPB.51.960
[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)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate 163011899 Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(CC4C6=CCC7C(C6(CC5)C)(CCC8C7(CC(C(C8(C)CO)O)O)C)C)(C)C)O)O)O)CO)O)O)O 959.10 unknown https://doi.org/10.1248/CPB.51.960
[6-[[5-[3,5-dihydroxy-6-methyl-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate 162989118 Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)OC9C(C(C(CO9)O)O)O)O)O)O)O)O)O 1091.20 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[6-[[5-[3,5-Dihydroxy-6-methyl-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 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-carboxylate 162994478 Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(CC4C6=CCC7C(C6(CC5)C)(CCC8C7(CC(C(C8(C)CO)O)O)C)C)(C)C)O)O)O)CO)O)OC9C(C(C(CO9)O)O)O)O 1091.20 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
https://doi.org/10.1248/CPB.51.960
Araliasaponin XIII 101992963 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)OC1C(C(C(CO1)O)O)O)C)(C)C)O)O)O)CO)O)O)O 1353.50 unknown https://doi.org/10.1248/CPB.51.960
Asiaticoside 11954171 Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)O)O)O)O 959.10 unknown https://doi.org/10.1248/CPB.51.960
Cussonoside B 169187 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)O)C)(C)C)O)O)O)CO)O)O)O 927.10 unknown https://doi.org/10.1248/CPB.51.960
Eleutheroside M 14036569 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)O)OC1C(C(C(C(O1)C)O)O)O)C)(C)C)O)O)O)CO)O)O)O 1205.40 unknown https://doi.org/10.1248/CPB.51.960
Hederasaponin B 21626480 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)O)OC1C(C(C(C(O1)C)O)O)O)C)(C)C)O)O)O)CO)O)O)O 1205.40 unknown https://doi.org/10.1248/CPB.51.960
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 https://doi.org/10.1248/CPB.51.960
Kalopanaxsaponin B;Glycoside L-H2; Hederoside H1 3874518 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.51.960
Madecassol 108062 Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)O)O)O)O 959.10 unknown https://doi.org/10.1248/CPB.51.960
https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
Mutongsaponin C 101427060 Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)OC9C(C(C(CO9)O)O)O)O)O)O)O)O)O 1091.20 unknown https://doi.org/10.1007/S10600-015-1213-Z
https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
Scheffoleoside A 101675595 Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(CC4C6=CCC7C(C6(CC5)C)(CCC8C7(CC(C(C8(C)CO)O)O)C)C)(C)C)O)O)O)CO)O)O)O 959.10 unknown https://doi.org/10.1248/CPB.51.960
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
Xerantholide 442337 Click to see CC1CC2C(CC3=C(C(=O)CC13)C)C(=C)C(=O)O2 246.30 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(1R,3aS,5aR,5bR,7aR,9S,10R,11aR,11bR,13aR,13bR)-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 12020561 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/10.1248/CPB.51.960
(2R,4aR,6bR,10S,12aR)-10-hydroxy-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2,4a-dicarboxylic acid 5321260 Click to see CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(CC5)(C)C(=O)O)C(=O)O)C)C)C 486.70 unknown https://doi.org/10.1021/NP50123A007
(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S)-2-[[(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-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-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid 101254083 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)C(=O)O)O)O)O)O)O)O 911.10 unknown https://doi.org/10.1248/CPB.51.960
(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/10.1016/J.PHYTOCHEM.2006.09.003
(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/10.1016/J.PHYTOCHEM.2006.09.003
https://doi.org/10.1248/CPB.51.960
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-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,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid 21626543 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.51.960
[(1R,2S,3R,4R,5S,6R)-3-[[(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]-2,4,5,6-tetrahydroxycyclohexyl] (4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-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-carboxylate 163010930 Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(C3O)OC(=O)C45CCC(CC4C6=CCC7C(C6(CC5)C)(CCC8C7(CC(C(C8(C)CO)O)O)C)C)(C)C)O)O)O)CO)O)O)O 973.10 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[3-[[3,4-Dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-2,4,5,6-tetrahydroxycyclohexyl] 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-carboxylate 163010929 Click to see CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(C3O)OC(=O)C45CCC(CC4C6=CCC7C(C6(CC5)C)(CCC8C7(CC(C(C8(C)CO)O)O)C)C)(C)C)O)O)O)CO)O)O)O 973.10 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
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/10.1016/J.PHYTOCHEM.2006.09.003
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 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/10.1016/J.PHYTOCHEM.2006.09.003
https://doi.org/10.1248/CPB.51.960
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.51.960
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 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.51.960
2-hydroxy-10-[(2R,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-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 6325707 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)CO)O)OC5C(C(C(CO5)O)O)O)OC6C(C(C(CO6)O)O)O)C)CC=C7C3(CCC8(C7CC(CC8)(C)O)C(=O)O)C)C)C 885.00 unknown https://doi.org/10.1021/NP50123A007
2,3-Dihydroxyolean-12-en-28-oic acid 3694932 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 https://doi.org/10.1248/CPB.51.960
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-Epioleanolic acid 11869658 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 https://doi.org/10.1021/NP50123A007
3-O-Acetyloleanolic acid 151202 Click to see CC(=O)OC1CCC2(C(C1(C)C)CCC3(C2CC=C4C3(CCC5(C4CC(CC5)(C)C)C(=O)O)C)C)C 498.70 unknown https://doi.org/10.1016/S0031-9422(00)86855-7
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 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)C(=O)O)O)O)O)O)O)O 911.10 unknown https://doi.org/10.1248/CPB.51.960
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 12305767 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/10.1248/CPB.51.960
alpha-Hederin 73296 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/10.1089/JMF.2005.8.78
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/10.1248/CPB.51.960
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.51.960
Beta-Amyrin 73145 Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C)C 426.70 unknown https://doi.org/10.1021/NP50123A007
epi-Maslinic acid 25564831 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 https://doi.org/10.1248/CPB.51.960
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 via CMAUP database
Hederasaponin C 3037108 Click to see CC(CC(CC(CC(CC(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(CC(COC1CCC2(C(C1(C)CO)CCC3(C2CC=C4C3(CCC5(C4CC(CC5)(C)C)C(=O)O)C)C)C)O)O)[O-])O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O 1230.40 unknown via CMAUP database
Maslinic Acid 73659 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 https://doi.org/10.1248/CPB.51.960
https://doi.org/10.1002/CHIN.200403182
Mubenoside A 195810 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)CO)O)OC5C(C(C(CO5)O)O)O)OC6C(C(C(CO6)O)O)O)C)CC=C7C3(CCC8(C7CC(CC8)(C)O)C(=O)O)C)C)C 885.00 unknown https://doi.org/10.1021/NP50123A007
Oleanolic Acid 10494 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 https://doi.org/10.1021/NP50123A007
Oleanolic acid-3-O-beta-D-glucopyranosyl (1-->2)-alpha-L-arabinopyranoside 494511 Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)O)C 751.00 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
Saponin PE 13878145 Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)O)C 751.00 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
Serratagenic acid 21594175 Click to see CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(CC5)(C)C(=O)O)C(=O)O)C)C)C 486.70 unknown https://doi.org/10.1021/NP50123A007
> Lipids and lipid-like molecules / Steroids and steroid derivatives
(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,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-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 101683944 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)OC8C(C(C(CO8)O)O)O 883.00 unknown https://doi.org/10.1021/NP50123A007
(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/10.1248/CPB.51.960
https://doi.org/10.1021/NP50123A007
(4aS,6aR,6aS,6bR,8aS,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 163021066 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
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 14191224 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
https://doi.org/10.1248/CPB.51.960
> 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 CCC(C)(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC(C4C3(CC(C(C4)OS(=O)(=O)O)OS(=O)(=O)O)C)OS(=O)(=O)O)C 702.90 unknown https://doi.org/10.1248/CPB.51.960
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 12-hydroxysteroids
10,11-dihydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-4,5,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid 162911874 Click to see CC1=CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1)C)C(=O)O 472.70 unknown https://doi.org/10.1248/CPB.51.960
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 12-hydroxysteroids / 12-beta-hydroxysteroids
(4aR,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-4,5,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid 12067090 Click to see CC1=CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1)C)C(=O)O 472.70 unknown https://doi.org/10.1248/CPB.51.960
(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 CC12CCC3C(C1CC=C4C2(CCC5(C4CC(=C)CC5)C(=O)O)C)(CC(C(C3(C)CO)O)O)C 472.70 unknown https://doi.org/10.1248/CPB.51.960
> 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-[(2R,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 163190296 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)O)O 943.10 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[(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 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)O)O 943.10 unknown https://doi.org/10.1248/CPB.51.960
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-5-[(2R,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-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 163092651 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 https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[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 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)O)O 943.10 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
https://doi.org/10.1248/CPB.51.960
[6-[[5-[3,5-Dihydroxy-6-methyl-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-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 163092650 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 https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
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
(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 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
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids
2-Azaniumylhexanoate 517543 Click to see CCCCC(C(=O)[O-])[NH3+] 131.17 unknown via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters
Ethyl Acetate 8857 Click to see CCOC(=O)C 88.11 unknown via CMAUP database
Ethyl acetate-1-13C 12206859 Click to see CCOC(=O)C 89.10 unknown via CMAUP database
Pentyl acetate 12348 Click to see CCCCCOC(=O)C 130.18 unknown https://doi.org/10.5650/JOS.56.59
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclic alcohols and derivatives
(4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-10,11-dihydroxy-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 11048752 Click to see CC1(C2CCC3(C(C2(CC(C1O)O)C)CC=C4C3(CCC5(C4CC(=C)CC5)C(=O)O)C)C)C 456.70 unknown https://doi.org/10.1248/CPB.51.960
(4aS,6aR,6aS,6bR,8aR,10S,11R,12aR,14bS)-10,11-dihydroxy-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 11015930 Click to see CC1(C2CCC3(C(C2(CC(C1O)O)C)CC=C4C3(CCC5(C4CC(=C)CC5)C(=O)O)C)C)C 456.70 unknown https://doi.org/10.1248/CPB.51.960
10,11-Dihydroxy-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 85367651 Click to see CC1(C2CCC3(C(C2(CC(C1O)O)C)CC=C4C3(CCC5(C4CC(=C)CC5)C(=O)O)C)C)C 456.70 unknown https://doi.org/10.1248/CPB.51.960
3-Epiakebonoic acid 129316616 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/10.1021/NP50123A007
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/10.1021/NP50123A007
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
3,4-Dicaffeoylquinic acid 6474309 Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O 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 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
Isochlorogenic acid A 6474310 Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O 516.40 unknown via CMAUP database
methyl 3,5-di-O-caffeoyl quinate 10075681 Click to see COC(=O)C1(CC(C(C(C1)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O 530.50 unknown via CMAUP database
Methyl 4-caffeoylquinate 71720840 Click to see COC(=O)C1(CC(C(C(C1)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O 368.30 unknown via CMAUP database
Methyl chlorogenate 6476139 Click to see COC(=O)C1(CC(C(C(C1)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O)O 368.30 unknown via CMAUP database
Neochlorogenic acid methyl ester 46230348 Click to see COC(=O)C1(CC(C(C(C1)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O)O 368.30 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Primary alcohols
1-Pentanol 6276 Click to see CCCCCO 88.15 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-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 21607576 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(CO4)O)O)OC5C(C(C(C(O5)CO)O)O)O)C)CC=C6C3(CCC7(C6CC(=C)CC7)C(=O)O)C)C)C 734.90 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-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,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 101683943 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(CO4)O)OC5C(C(C(C(O5)CO)O)O)O)OC6C(C(C(CO6)O)O)O)C)CC=C7C3(CCC8(C7CC(=C)CC8)C(=O)O)C)C)C 867.00 unknown https://doi.org/10.1021/NP50123A007
10-[4,5-Dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-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 14283367 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(CO4)O)O)OC5C(C(C(C(O5)CO)O)O)O)C)CC=C6C3(CCC7(C6CC(=C)CC7)C(=O)O)C)C)C 734.90 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
> 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-Decenal 5283345 Click to see CCCCCCCC=CC=O 154.25 unknown https://doi.org/10.5650/JOS.56.59
2-Heptenal 5283316 Click to see CCCCC=CC=O 112.17 unknown https://doi.org/10.5650/JOS.56.59
2,4-Decadienal 5283349 Click to see CCCCCC=CC=CC=O 152.23 unknown via CMAUP database
Decanal 8175 Click to see CCCCCCCCCC=O 156.26 unknown via CMAUP database
Heptanal 8130 Click to see CCCCCCC=O 114.19 unknown via CMAUP database
Hexanal 6184 Click to see CCCCCC=O 100.16 unknown via CMAUP database
Nonanal 31289 Click to see CCCCCCCCC=O 142.24 unknown via CMAUP database
Octanal 454 Click to see CCCCCCCC=O 128.21 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones
(R,S)-5-Ethyl-6-methyl-3E-hepten-2-one 5363638 Click to see CCC(C=CC(=O)C)C(C)C 154.25 unknown https://doi.org/10.5650/JOS.56.59
3-Nonen-2-one 5317045 Click to see CCCCCC=CC(=O)C 140.22 unknown https://doi.org/10.5650/JOS.56.59
Damascenone 5366074 Click to see CC=CC(=O)C1=C(C=CCC1(C)C)C 190.28 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aryl ketones / Aryl alkyl ketones
2-Acetylfuran 14505 Click to see CC(=O)C1=CC=CO1 110.11 unknown https://doi.org/10.5650/JOS.56.59
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones
2-Cyclohexen-1-one, 3,5,5-trimethyl-4-methylene- 641351 Click to see CC1=CC(=O)CC(C1=C)(C)C 150.22 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
2-Dodecanone 22556 Click to see CCCCCCCCCCC(=O)C 184.32 unknown via CMAUP database
2-Tridecanone 11622 Click to see CCCCCCCCCCCC(=O)C 198.34 unknown via CMAUP database
2-Undecanone 8163 Click to see CCCCCCCCCC(=O)C 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 CC1=CCC(CC1)C(=O)C 138.21 unknown via CMAUP database
6-Methyl-5-hepten-2-one 9862 Click to see CC(=CCCC(=O)C)C 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
> Organic oxygen compounds / Organooxygen compounds / Enols
z-Pentenol 10011839 Click to see CCCC=CO 86.13 unknown https://doi.org/10.5650/JOS.56.59
> Organoheterocyclic compounds / Epoxides
(1R,3E,7E,11S)-1,5,5,8-tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene 12900740 Click to see CC1=CCC(C=CCC2(C(O2)CC1)C)(C)C 220.35 unknown via CMAUP database
1,5,5,8-Tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene 23274265 Click to see CC1=CCC(C=CCC2(C(O2)CC1)C)(C)C 220.35 unknown via CMAUP database
CID 92476330 92476330 Click to see CC1=CCC(C=CCC2(C(O2)CC1)C)(C)C 220.35 unknown via CMAUP database
Humulene epoxide II 10704181 Click to see CC1=CCC(C=CCC2(C(O2)CC1)C)(C)C 220.35 unknown via CMAUP database
Humulene epoxyde 5463721 Click to see CC1=CCC(C=CCC2(C(O2)CC1)C)(C)C 220.35 unknown via CMAUP database
> Organoheterocyclic compounds / Heteroaromatic compounds
2-Hexylthiophene 87793 Click to see CCCCCCC1=CC=CS1 168.30 unknown https://doi.org/10.5650/JOS.56.59
2-Pentylfuran 19602 Click to see CCCCCC1=CC=CO1 138.21 unknown via CMAUP database
2-Pentylthiophene 20995 Click to see CCCCCC1=CC=CS1 154.27 unknown https://doi.org/10.5650/JOS.56.59
2-Propylthiophene 73771 Click to see CCCC1=CC=CS1 126.22 unknown https://doi.org/10.5650/JOS.56.59
> Organoheterocyclic compounds / Indoles and derivatives / Indoles
Indole 798 Click to see C1=CC=C2C(=C1)C=CN2 117.15 unknown via CMAUP database
> Organoheterocyclic compounds / Isobenzofurans
(E)-3-Butylidene-4,5-dihydroisobenzofuran-1(3H)-one 5877292 Click to see CCCC=C1C2=C(C=CCC2)C(=O)O1 190.24 unknown via CMAUP database
Ligustilide 5319022 Click to see CCCC=C1C2=C(C=CCC2)C(=O)O1 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 CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC)OC 624.80 unknown via CMAUP database
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
(5S)-5-hexyloxolan-2-one 7057904 Click to see CCCCCCC1CCC(=O)O1 170.25 unknown via CMAUP database
2(3H)-Furanone, dihydro-5,5-dimethyl-4-(3-oxobutyl)- 138243 Click to see CC(=O)CCC1CC(=O)OC1(C)C 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 CCCCCCC1CCC(=O)O1 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 https://doi.org/10.5650/JOS.56.59
> Organoheterocyclic compounds / Oxanes
Eucalyptol 2758 Click to see CC1(C2CCC(O1)(CC2)C)C 154.25 unknown via CMAUP database
> Organoheterocyclic compounds / Tetrahydrofurans
2-[(2R,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-2-ol 6428573 Click to see CC1(CCC(O1)C(C)(C)O)C=C 170.25 unknown via CMAUP database
Lilac aldehyde 155007 Click to see CC(C=O)C1CCC(O1)(C)C=C 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
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 C1=CC=C(C=C1)C=CC=O 132.16 unknown via CMAUP database
cis-Cinnamaldehyde 6428995 Click to see C1=CC=C(C=C1)C=CC=O 132.16 unknown via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
[(2R,3S,4S,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate 13845929 Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OCCC3=CC(=C(C=C3)O)O)O)O)O)O 492.50 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[6-[2-(3,4-Dihydroxyphenyl)ethoxy]-3,4,5-trihydroxyoxan-2-yl]methyl 3-(3,4-dihydroxyphenyl)prop-2-enoate 78380900 Click to see C1=CC(=C(C=C1CCOC2C(C(C(C(O2)COC(=O)C=CC3=CC(=C(C=C3)O)O)O)O)O)O)O 478.40 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
[6-[2-(3,4-Dihydroxyphenyl)ethoxy]-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate 163050385 Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OCCC3=CC(=C(C=C3)O)O)O)O)O)O 492.50 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
Calceolarioside B 5273567 Click to see C1=CC(=C(C=C1CCOC2C(C(C(C(O2)COC(=O)C=CC3=CC(=C(C=C3)O)O)O)O)O)O)O 478.40 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
coumaroyl(3-OH)(-6)Glc(b)-O-EtPh(4-OH) 14311190 Click to see C1=CC(=CC=C1CCOC2C(C(C(C(O2)COC(=O)C=CC3=CC(=C(C=C3)O)O)O)O)O)O 462.40 unknown https://doi.org/10.1016/J.PHYTOCHEM.2006.09.003
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 6,7-dihydroxycoumarins
Esculetin 5281416 Click to see C1=CC(=O)OC2=CC(=C(C=C21)O)O 178.14 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-3-O-glycosides
Kuromanin 441667 Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O 449.40 unknown https://doi.org/10.1016/S0031-9422(00)86855-7

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