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Isodon xerophilus

Table of Contents

Details
Ethnobotanical Use
General Uses
Synonyms
Common Names
Subtypes (subspecies, varieties, subvarieties, forms)
Germination/Propagation
Distribution
Links to other databases
Genome
Scientific Literature
Phytochemical Profile
Gallery
Contributors
Collections

Details Top

Internal ID UUID643fdf861e1d3084361423
Scientific name Isodon xerophilus
Authority (C.Y.Wu & H.W.Li) H.Hara
First published in J. Jap. Bot. 60: 237 (1985)

Ethnobotanical Use Top

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General Uses Top

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Common products:
- Research‑grade extracts of ent‑kaurane diterpenoids are routinely prepared from the aerial parts of Isodon xerophilus and are supplied to phytochemical and synthetic chemistry laboratories for studies of structure‑activity relationships and as chiral building blocks.

Fragrance and cosmetics:
- The essential oil obtained from the leaves and stems of I. xerophilus is dominated by monoterpenes such as α‑pinene, β‑pinene and 1,8‑cineole, together with sesquiterpene hydrocarbons; these constituents are widely employed in fragrance formulations, though commercial exploitation of the species’ oil itself is not documented.

Properties relevant to use:
- The ent‑kaurane diterpenoids isolated from I. xerophilus possess a C20 ent‑kaurane skeleton bearing multiple hydroxyl and carbonyl groups, which confer high reactivity and make them useful scaffolds for total synthesis. The leaf‑oil profile, characterized by a high proportion of low‑boiling monoterpenes (C10) and moderate sesquiterpene content (C15), aligns with typical aromatic Lamiaceae oils used in the fragrance sector.

Sustainability and sourcing:
- Isodon xerophilus is a shrub endemic to mountainous regions of southwestern China; it is not cultivated on a commercial scale and is collected from the wild for research purposes. Sustainable harvesting practices are recommended to prevent local over‑exploitation.

Synonyms Top

Scientific name Authority First published in
Rabdosia xerophila C.Y.Wu & H.W.Li Fl. Yunnanica 1: 787 (1977)

Common names Top

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Language Common/alternative name
Chinese 旱生香茶菜

Subspecies (abbr. subsp./ssp.) Top

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No subspecies added yet.

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

Links to other databases Top

Suggest others/fix!
Database ID/link to page
World Flora Online wfo-0000218008
Tropicos 17607217
KEW urn:lsid:ipni.org:names:915172-1
The Plant List kew-103068
Open Tree Of Life 491360
NCBI Taxonomy 662931
IPNI 915172-1
GBIF 5608796
EOL 2899001
CMAUP NPO8404

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.
Title Authors Publication Released IDs
Current Advances in Japanese Encephalitis Virus Drug Development Guo J, Mi Y, Guo Y, Bai Y, Wang M, Wang W, Wang Y Viruses 28-Jan-2024
PMCID:PMC10892782
doi:10.3390/v16020202
PMID:38399978
Sulfur-Containing Compounds from Endophytic Fungi: Sources, Structures and Bioactivities Fan Y, Ma Z, Zhang Y, Wang Y, Ding Y, Wang C, Cao S J Fungi (Basel) 13-Jun-2022
PMCID:PMC9224594
doi:10.3390/jof8060628
PMID:35736111
Pharmacophore based virtual screening for natural product database revealed possible inhibitors for SARS-COV-2 main protease El-Ashrey MK, Bakr RO, Fayed MA, Refaey RH, Nissan YM Virology 22-Mar-2022
PMCID:PMC8938917
doi:10.1016/j.virol.2022.03.003
PMID:35339903
Molecular and morphological evidence for a new species of Isodon (Lamiaceae) from southern China Chen YP, Huang CZ, Zhao Y, Xiang CL Plant Divers 14-Jul-2020
PMCID:PMC7987569
doi:10.1016/j.pld.2020.06.004
PMID:33778225
Arthrinins E–G, Three Botryane Sesquiterpenoids from the Plant Endophytic Fungus Arthrinium sp. HS66 Su XZ, Tang JW, Hu K, Li XN, Sun HD, Puno PT Nat Prod Bioprospect 12-Jul-2020
PMCID:PMC7367987
doi:10.1007/s13659-020-00248-y
PMID:32656629
Mechanistic Pathways and Molecular Targets of Plant-Derived Anticancer ent-Kaurane Diterpenes Sarwar MS, Xia YX, Liang ZM, Tsang SW, Zhang HJ Biomolecules 16-Jan-2020
PMCID:PMC7023344
doi:10.3390/biom10010144
PMID:31963204
Novel Approach to Classify Plants Based on Metabolite-Content Similarity Liu K, Abdullah AA, Huang M, Nishioka T, Altaf-Ul-Amin M, Kanaya S Biomed Res Int 09-Jan-2017
PMCID:PMC5253511
doi:10.1155/2017/5296729
PMID:28164123
Andrographis paniculata elicits anti-invasion activities by suppressing TM4SF3 gene expression and by anoikis-sensitization in esophageal cancer cells Yue GG, Lee JK, Li L, Chan KM, Wong EC, Chan JY, Fung KP, Lui VW, Chiu PW, Lau CB Am J Cancer Res 15-Nov-2015
PMCID:PMC4731632
PMID:26885447
Two Natural ent-kauranoids as Novel Wnt Signaling Inhibitors Zhang J, Kong LM, Zhan R, Ye ZN, Pu JX, Sun HD, Li Y Nat Prod Bioprospect 24-Apr-2014
PMCID:PMC4050307
doi:10.1007/s13659-014-0016-4
PMID:24955294
Structure and cytotoxicity of diterpenoids from Isodon adenolomus. Zhao W, Pu JX, Du X, Su J, Li XN, Yang JH, Xue YB, Li Y, Xiao WL, Sun HD J Nat Prod 27-May-2011
doi:10.1021/NP200140J
PMID:21534539
Ponicidin Inhibits Monocytic Leukemia Cell Growth by Induction of Apoptosis Liu JJ, Zhang Y, Guang WB, Yang HZ, Lin DJ, Xiao RZ Int J Mol Sci 19-Nov-2008
PMCID:PMC2635634
doi:10.3390/ijms9112265
PMID:19330074
Cytotoxic ent-kauranoids from the medicinal plant Isodon xerophilus. Li LM, Weng ZY, Huang SX, Pu JX, Li SH, Huang H, Yang BB, Han Y, Xiao WL, Li ML, Han QB, Sun HD J Nat Prod 01-Aug-2007
doi:10.1021/NP070205M
PMID:17665952
Two New ent‐Kaurane Diterpenoids from Isodon Macrophyllus. Ji Xia Zhang, Zheng Yue Chen, Yong Xue Wang, Pei Yong Qiu, Sheng Xiong Huang, Han Dong Sun Wiley 17-Nov-2006
doi:10.1002/CHIN.200649184
Two Novel <i>ent</i>‐Abietane Diterpenoids from <i>Isodon xerophilus</i> Xue‐Mei Niu, Sheng‐Hong Li, Zhi Na, Zhong‐Wen Lin, Han‐Dong Sun Wiley 27-Aug-2004
doi:10.1002/HLCA.200490176
ent-Kaurane diterpenoids from the leaves of Isodon xerophilus. Li SH, Niu XM, Peng LY, Zhang HJ, Yao P, Sun HD Planta Med 01-Oct-2002
doi:10.1055/S-2002-34926
PMID:12391566

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.
Name PubChem ID Canonical SMILES MW Found in Proof
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters
[(E)-2-[(1S,5S,7R,8S,9S,12S)-2-formyl-5-methoxy-5,9-dimethyl-12-propan-2-yl-4-oxatricyclo[7.3.1.03,7]tridec-2-en-8-yl]ethenyl] 3-methylbut-2-enoate 10993703 Click to see CC(C)C1CCC2(CC1C(=C3C(C2C=COC(=O)C=C(C)C)CC(O3)(C)OC)C=O)C 430.60 unknown via CMAUP database
[(E)-2-[(1S,5S,7S,8S,9S,12S)-2-formyl-5-methoxy-5,9-dimethyl-12-propan-2-yl-4-oxatricyclo[7.3.1.03,7]tridec-2-en-8-yl]ethenyl] 3-methylbut-2-enoate 10950055 Click to see 430.60 unknown via CMAUP database
5-epi-Vibsanin E 44185775 Click to see CC(=CC(=O)OC=CC1C(C(=O)C2COC(C3C2CC1(CC3)C)(C)C)CC(=O)C)C 416.50 unknown via CMAUP database
Vibsanin E 21582659 Click to see CC(=CC(=O)OC=CC1C(C(=O)C2COC(C3C2CC1(CC3)C)(C)C)CC(=O)C)C 416.50 unknown via CMAUP database
Vibsanin P 643712 Click to see CC(=CC(=O)OC1C=CC(CC=C(CCC2C1(O2)C)CO)(C)CC=CC(C)(C)O)C 418.60 unknown via CMAUP database
Vibsanin Q 11154724 Click to see 432.60 unknown via CMAUP database
Vibsanin R 11258097 Click to see CC(=CC(=O)OC1C=CC(CC=C(CCC2C1(O2)C)CO)(C)CC=CC(=C)C)C 400.50 unknown via CMAUP database
Vibsanin T 11441439 Click to see 416.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
(3S,3aS,7S,8S,8aS)-3-(2-hydroxypropan-2-yl)-8a-methyl-8-[(E)-2-(3-methylbut-2-enoyloxy)ethenyl]-6-oxo-7-(2-oxopropyl)-1,2,3,3a,7,8-hexahydroazulene-5-carboxylic acid 10456233 Click to see CC(=CC(=O)OC=CC1C(C(=O)C(=CC2C1(CCC2C(C)(C)O)C)C(=O)O)CC(=O)C)C 446.50 unknown via CMAUP database
[(E)-2-[(1S,2S,7R)-2-[(E)-4-hydroperoxy-4-methylpent-2-enyl]-5-(hydroxymethyl)-2-methyl-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl] 3-methylbut-2-enoate 10863262 Click to see 448.50 unknown via CMAUP database
[(E)-2-[(1S,2S,7R)-2-[(E)-4-hydroperoxy-4-methylpent-2-enyl]-5-(methoxymethyl)-2-methyl-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl] 3-methylbut-2-enoate 11026956 Click to see 462.60 unknown via CMAUP database
[(E)-2-[(1S,2S,7R)-5-(hydroxymethyl)-2-methyl-2-(4-methylpent-3-enyl)-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl] 3-methylbut-2-enoate 10319743 Click to see 416.50 unknown via CMAUP database
[(E)-2-[(1S,2S,7S)-2-[(3S)-3,4-dihydroxy-4-methylpentyl]-5-(hydroxymethyl)-2-methyl-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl] 3-methylbut-2-enoate 93488714 Click to see 450.60 unknown via CMAUP database
[(E)-2-[(1S,2S,7S)-2-[(E)-4-hydroperoxy-4-methylpent-2-enyl]-5-(methoxymethyl)-2-methyl-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl] 3-methylbut-2-enoate 10695370 Click to see CC(=CC(=O)OC=CC1C(C(=O)C(=CCC1(C)CC=CC(C)(C)OO)COC)CC(=O)C)C 462.60 unknown via CMAUP database
[(E)-2-[(1S,2S,7S)-5-(hydroxymethyl)-2-[(3R)-3-hydroxy-4-methylpent-4-enyl]-2-methyl-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl] 3-methylbut-2-enoate 93492969 Click to see 432.50 unknown via CMAUP database
[(E)-2-[(1S,2S,7S)-5-(hydroxymethyl)-2-[(E)-4-hydroxy-4-methylpent-2-enyl]-2-methyl-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl] 3-methylbut-2-enoate 10550692 Click to see 432.50 unknown via CMAUP database
[(E)-2-[(1S,2S,7S)-5-(methoxymethyl)-2-[(E)-4-methoxy-4-methylpent-2-enyl]-2-methyl-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl] 3-methylbut-2-enoate 10766399 Click to see 460.60 unknown via CMAUP database
5-epi-VibsaninH 9980260 Click to see CC(=CC(=O)OC=CC1C(C(=O)C(=CCC1(C)CC=CC(C)(C)O)CO)CC(=O)C)C 432.50 unknown via CMAUP database
Vibsanin C 10432070 Click to see CC(=CCCC1(CC=C(C(=O)C(C1C=COC(=O)C=C(C)C)CC(=O)C)CO)C)C 416.50 unknown via CMAUP database
Vibsanin K 10718318 Click to see CC(=CC(=O)OC=CC1C(C(=O)C(=CCC1(C)CC=CC(C)(C)OO)CO)CC(=O)C)C 448.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Kaurane diterpenoids
(1R,2R,3S,5R,8R,9S,11R,16R,17R)-3,9,16,17-tetrahydroxy-12,12-dimethyl-6-methylidenepentacyclo[7.6.1.15,8.01,11.02,8]heptadecane-7,10-dione 162867678 Click to see 362.40 unknown https://doi.org/10.1021/NP070205M
(1R,2S,3S,5R,8S,9S,10S,11R,18S)-3,9,10,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 162912129 Click to see 364.40 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
(1R,2S,3S,5S,8R,9S,10S,11R,16S,18R)-3,9,10,18-tetrahydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 102382583 Click to see 394.50 unknown https://doi.org/10.1021/NP070205M
(1R,2S,3S,5S,8R,9S,10S,11R,18R)-3,9,10,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 10428853 Click to see 364.40 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
https://doi.org/10.1016/S0031-9422(01)00164-9
(1R,2S,3S,5S,8R,9S,10S,11S,13R,18R)-3,9,10,13,18-pentahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 102382580 Click to see CC1(C(CCC23C1C(C(C45C2C(CC(C4O)C(=C)C5=O)O)(OC3)O)O)O)C 380.40 unknown https://doi.org/10.1021/NP070205M
(1R,2S,5R,8R,9S,13S,14S,15R)-13,14-dihydroxy-16,16-dimethyl-6-methylidene-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one 70697982 Click to see 346.40 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
(1R,2S,5S,6S,8R,9S,11S,13S,14S,15R,19S)-13,14,19-trihydroxy-6,16,16-trimethyl-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one 162928301 Click to see 364.40 unknown https://doi.org/10.1021/NP9903705
(1R,2S,5S,8R,9R,13R,14S,15R,19R)-13,14,19-trihydroxy-16,16-dimethyl-6-methylidene-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one 44445768 Click to see 362.40 unknown https://doi.org/10.1021/NP070205M
(1R,2S,5S,8R,9S,10S,11R,12R,18S)-9,10,18-trihydroxy-12-(hydroxymethyl)-12-methyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 162927308 Click to see 364.40 unknown https://doi.org/10.1021/NP070205M
(1R,2S,5S,8R,9S,10S,11R,15S,16R,18R)-9,10,15,18-tetrahydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 101663493 Click to see 394.50 unknown https://doi.org/10.1021/NP070205M
(1R,2S,5S,8R,9S,10S,11R,15S,16S,18S)-9,10,15,16,18-pentahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 162904216 Click to see 380.40 unknown https://doi.org/10.1021/NP070205M
(1R,2S,5S,8R,9S,11S,13S,14S,15R,19S)-13,14,19-trihydroxy-16,16-dimethyl-6-methylidene-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one 92484182 Click to see 362.40 unknown https://doi.org/10.1021/NP070205M
(1R,2S,5S,8R,9S,11S,13S,14S,15R)-13,14-dihydroxy-16,16-dimethyl-6-methylidene-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one 153274307 Click to see 346.40 unknown https://doi.org/10.1021/NP070205M
(1R,5R,8R,10S,11R,14S,17S,18R,19S,20R)-10,19,20-trihydroxy-5-methyl-13-methylidene-7,9-dioxahexacyclo[8.7.2.111,14.01,8.05,18.011,17]icosan-12-one 162995905 Click to see CC12CCCC34C1C(C(C56C3CCC(C5O)C(=C)C6=O)(OC4OC2)O)O 362.40 unknown https://doi.org/10.1021/NP070205M
(1S,2S,5R,8S,9S,10S,11R,15R)-9,10,15-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 10360382 Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)O)C 348.40 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
https://doi.org/10.1016/S0031-9422(01)00164-9
(1S,2S,5S,7R,8S,9S,10S,11R,12R,15R,18R)-12-(hydroxymethyl)-12-methyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol 162916008 Click to see 382.40 unknown https://doi.org/10.1021/NP070205M
(1S,2S,5S,7R,9S,10S,11R,12R,15R,18R)-12-(hydroxymethyl)-12-methyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol 163190999 Click to see 382.40 unknown https://doi.org/10.1021/NP070205M
(1S,2S,5S,8R,10S,11R,15S,16R,18R)-9,10,15,16,18-pentahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 163185140 Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3O)O)O)O)C 380.40 unknown https://doi.org/10.1021/NP070205M
(1S,2S,5S,8R,9S,10S,11R,12R,15R,18R)-9,10,15,18-tetrahydroxy-12-(hydroxymethyl)-12-methyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 162870351 Click to see 380.40 unknown https://doi.org/10.1021/NP070205M
(1S,2S,5S,8R,9S,10S,11R,15S,16R,18R)-9,10,15,16,18-pentahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 162904215 Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3O)O)O)O)C 380.40 unknown https://doi.org/10.1021/NP070205M
(2S,3S,5S,8R,9S,10S,11S,18R)-3,9,10,18-Tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 102587878 Click to see 364.40 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
(2S,5R,8S,9R,10S,11R,15R)-9,10,15-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 5315342 Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)O)C 348.40 unknown https://doi.org/10.1002/CHIN.200649184
https://doi.org/10.1021/NP070205M
(2S,5S,8R,10S,11R,12R,18S)-9,10,18-trihydroxy-12-(hydroxymethyl)-12-methyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 163189748 Click to see 364.40 unknown https://doi.org/10.1021/NP070205M
(2S,5S,8R,13R,14S,15R)-13,14,19-trihydroxy-16,16-dimethyl-6-methylidene-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one 5320676 Click to see CC1(CCC(C23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)O)C 362.40 unknown https://doi.org/10.1055/S-2002-34926
https://doi.org/10.1021/NP070205M
(3,7,9,18-Tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl) acetate 162960908 Click to see 408.50 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
https://doi.org/10.1016/S0031-9422(01)00164-9
(3,9,18-Trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl) acetate 85153605 Click to see 406.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
(9,10,15-Trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate 75052824 Click to see 406.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
(9,10,15,18-Tetrahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate 73076422 Click to see 422.50 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
https://doi.org/10.1016/S0031-9422(01)00164-9
(9,10,16,18-Tetrahydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl) acetate 73880642 Click to see 422.50 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
https://doi.org/10.1016/S0031-9422(01)00164-9
https://doi.org/10.1021/NP200140J
(9,10,18-Trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate 457901 Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)C 406.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
(9,10,18-Trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl) acetate 85102780 Click to see 406.50 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
https://doi.org/10.1016/S0031-9422(01)00164-9
[(1R,2S,10S,11S,12R,15R,18R)-9,10,15,18-tetrahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 163193667 Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C 422.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
[(1R,2S,3R,5S,8S,9S,10S,11R,12R)-3,9,10-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 14395565 Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2C(CC(C4)C(=C)C5=O)O)(OC3)O)O)C 406.50 unknown https://doi.org/10.1021/NP070205M
[(1R,2S,3S,5S,7R,8R,9S,10S,11R,18R)-3,7,9,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl] acetate 162960910 Click to see 408.50 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
[(1R,2S,3S,5S,8R,9S,10S,11R,12R,15R,18R)-3,9,10,15,18-pentahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 162886838 Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2C(CC(C4O)C(=C)C5=O)O)(OC3)O)O)O)C 438.50 unknown https://doi.org/10.1021/NP070205M
[(1R,2S,3S,5S,8R,9S,10S,11R,18R)-3,9,18-trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl] acetate 10476429 Click to see 406.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
[(1R,2S,3S,5S,8S,9R,11R,16S,17R)-9,16,17-trihydroxy-12,12-dimethyl-6-methylidene-7,10-dioxo-3-pentacyclo[7.6.1.15,8.01,11.02,8]heptadecanyl] acetate 44445779 Click to see CC(=O)OC1CC2C(C3(C1C45CCCC(C4C(=O)C3(C5O)O)(C)C)C(=O)C2=C)O 404.50 unknown https://doi.org/10.1021/NP070205M
[(1R,2S,3S,5S,8S,9S,11R,16R,17R)-9,16,17-trihydroxy-12,12-dimethyl-6-methylidene-7,10-dioxo-3-pentacyclo[7.6.1.15,8.01,11.02,8]heptadecanyl] acetate 163094542 Click to see 404.50 unknown https://doi.org/10.1021/NP070205M
[(1R,2S,3S,5S,9S,10S,11R,12R,15R,18R)-3,9,10,15,18-pentahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 163194165 Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2C(CC(C4O)C(=C)C5=O)O)(OC3)O)O)O)C 438.50 unknown https://doi.org/10.1021/NP070205M
[(1R,2S,5S,7R,8S,9S,10S,11R,18R)-7-acetyloxy-9,18-dihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl] acetate 162845809 Click to see 434.50 unknown https://doi.org/10.1021/NP070205M
[(1R,2S,5S,7R,9S,10S,11R,18R)-7-acetyloxy-9,18-dihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl] acetate 163194770 Click to see CC(=O)OC1C2C(CCCC23COC1(C45C3CCC(C4O)C(=C)C5OC(=O)C)O)(C)C 434.50 unknown https://doi.org/10.1021/NP070205M
[(1R,2S,5S,8R,9R,10S,11R,12R,18R)-9,10,18-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 10046926 Click to see 406.50 unknown https://doi.org/10.1021/NP070205M
[(1R,2S,5S,8R,9R,10S,11R,15S,18R)-9,10,16,18-tetrahydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl] acetate 11133622 Click to see 422.50 unknown via CMAUP database
[(1R,2S,5S,8R,9S,10S,11R,12R,18R)-9,10,18-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 162945693 Click to see 406.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
[(1R,2S,5S,8R,9S,10S,11R,15S,16R,18S)-9,10,16,18-tetrahydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl] acetate 162905398 Click to see 422.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
[(1R,2S,5S,8R,9S,10S,11R,15S,16S,18R)-9,10,16,18-tetrahydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl] acetate 135959292 Click to see 422.50 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
https://doi.org/10.1016/S0031-9422(01)00164-9
[(1R,2S,5S,8R,9S,10S,11S,12R,15R,18R)-9,10,15,18-tetrahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 162974396 Click to see 422.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
[(1S,2S,3R,5S,8S,9S,10S,11R,12R,13R,15R)-3,9,10,13,15-pentahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 163104232 Click to see 438.50 unknown https://doi.org/10.1021/NP070205M
[(1S,2S,3S,5S,6R,8R,9S,10S,11R,18R)-9,10,18-trihydroxy-6-(methoxymethyl)-12,12-dimethyl-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl] acetate 162919282 Click to see CC(=O)OC1CC2C(C(=O)C3(C1C45CCCC(C4C(C3(OC5)O)O)(C)C)C2O)COC 438.50 unknown https://doi.org/10.1021/NP070205M
[(1S,2S,3S,5S,7R,8S,9S,10S,11R,18R)-10-acetyloxy-7,9,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl] acetate 162930627 Click to see CC(=O)OC1CC2C(C3(C1C45CCCC(C4C(C3(OC5)O)OC(=O)C)(C)C)C(C2=C)O)O 450.50 unknown https://doi.org/10.1021/NP070205M
[(1S,2S,3S,5S,7R,8S,9S,10S,11R,18R)-3,7,9,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl] acetate 162960911 Click to see 408.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
[(1S,2S,3S,5S,8R,9R,10S,11R,16S,18R)-9,10,18-trihydroxy-16-methoxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl] acetate 44445751 Click to see CC(=O)OC1CC2C(C3(C1C45CCCC(C4C(C3(OC5OC)O)O)(C)C)C(=O)C2=C)O 436.50 unknown https://doi.org/10.1021/NP070205M
[(1S,2S,3S,5S,8R,9S,10S,11R,16S,18S)-9,10,18-trihydroxy-16-methoxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl] acetate 162924155 Click to see 436.50 unknown https://doi.org/10.1021/NP070205M
[(1S,2S,3S,5S,8R,9S,10S,11R,18R)-9,10,18-trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl] acetate 10046927 Click to see 406.50 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
https://doi.org/10.1016/S0031-9422(01)00164-9
[(1S,2S,3S,5S,8R,9S,11S,13S,14S,15R)-13,14-dihydroxy-16,16-dimethyl-6-methylidene-7-oxo-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-3-yl] acetate 162866432 Click to see CC(=O)OC1CC2C3C4(C1C56CCCC(C5C(C4(OC6O3)O)O)(C)C)C(=O)C2=C 404.50 unknown https://doi.org/10.1021/NP070205M
[(1S,2S,3S,7R,8S,9S,10S,11R,18R)-10-acetyloxy-7,9,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl] acetate 163185544 Click to see CC(=O)OC1CC2C(C3(C1C45CCCC(C4C(C3(OC5)O)OC(=O)C)(C)C)C(C2=C)O)O 450.50 unknown https://doi.org/10.1021/NP070205M
[(1S,2S,5R,8S,9S,10S,11R,12R,13S,15R)-9,10,13,15-tetrahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 14219426 Click to see CC(=O)OCC1(C(CC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)O)O)C 422.50 unknown https://doi.org/10.1021/NP070205M
[(1S,2S,5R,8S,9S,10S,11R,12R,15R)-9,10,15-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 163083342 Click to see 406.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
[(1S,2S,5R,8S,9S,10S,11R,15R)-9,10,15-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 10092741 Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)O)C 406.50 unknown via CMAUP database
[(1S,2S,5S,8R,9S,10S,11R,12R,13R,15R,18R)-9,10,13,15,18-pentahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 163103526 Click to see CC(=O)OCC1(C(CC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)O)C 438.50 unknown https://doi.org/10.1021/NP070205M
[(1S,2S,5S,8R,9S,11R,12R,18R)-9,10,15,18-tetrahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 137705603 Click to see 422.50 unknown https://doi.org/10.1002/CHIN.200649184
https://doi.org/10.1016/S0031-9422(01)00164-9
[(1S,2S,8S,9R,10S,11R,12R,15R)-9,10,15-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 139031635 Click to see 406.50 unknown https://doi.org/10.1002/CHIN.200649184
[(2S,5S,9S,10R,11R,12R,18R)-9,10,18-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 102117145 Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)C 406.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
[(2S,9R,10S,11R)-9,10,18-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 369902 Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)C 406.50 unknown https://doi.org/10.1021/NP070205M
https://doi.org/10.1016/S0031-9422(01)00164-9
[(5R,8S,9R,10S,12R,15R)-9,10,15-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 5315341 Click to see 406.50 unknown https://doi.org/10.1002/CHIN.200649184
https://doi.org/10.1021/NP070205M
[(5S,8R,9R,10S,12R,15R,18R)-9,10,15,18-tetrahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate 5315340 Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C 422.50 unknown https://doi.org/10.1002/CHIN.200649184
https://doi.org/10.1021/NP070205M
https://doi.org/10.1016/S0031-9422(01)00164-9
13,14-Dihydroxy-16,16-dimethyl-6-methylidene-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one 73074543 Click to see CC1(CCCC23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)C 346.40 unknown https://doi.org/10.1021/NP200140J
13,14,19-Trihydroxy-6,16,16-trimethyl-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one 73208922 Click to see 364.40 unknown https://doi.org/10.1021/NP9903705
3,13,14-Trihydroxy-16,16-dimethyl-6-methylidene-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one 73410543 Click to see CC1(CCCC23C1C(C4(C56C2C(CC(C5OC3O4)C(=C)C6=O)O)O)O)C 362.40 unknown https://doi.org/10.1021/NP200140J
3,9,10,18-Tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 14287139 Click to see 364.40 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
https://doi.org/10.1016/S0031-9422(01)00164-9
3,9,10,18-Tetrahydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 74071572 Click to see 394.50 unknown https://doi.org/10.1021/NP200140J
9,10,15-Trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one 9997896 Click to see 348.40 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
https://doi.org/10.1016/S0031-9422(01)00164-9
CID 91895323 91895323 Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C 422.50 unknown https://doi.org/10.1016/S0031-9422(01)00245-X
https://doi.org/10.1016/S0031-9422(01)00164-9
CID 92278888 92278888 Click to see 362.40 unknown https://doi.org/10.1021/NP070205M
https://doi.org/10.1016/S0031-9422(01)00164-9
Enanderianin C 102587877 Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)O)C 406.50 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
Hebeirubescensins G 44445764 Click to see 380.40 unknown https://doi.org/10.1021/NP070205M
Hebeirubescensins H 44445765 Click to see 380.40 unknown https://doi.org/10.1021/NP070205M
Longikaurin D 44445755 Click to see 406.50 unknown https://doi.org/10.1021/NP070205M
Longikaurin F 70698054 Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2C(CC(C4)C(=C)C5=O)OC(=O)C)(OC3)O)O)C 448.50 unknown https://doi.org/10.1055/S-2002-34926
Macrocalin B 44445771 Click to see 362.40 unknown https://doi.org/10.1021/NP070205M
Maoecrystal I 44445756 Click to see 422.50 unknown https://doi.org/10.1021/NP070205M
Phyllostachysin A 44445778 Click to see 362.40 unknown https://doi.org/10.1021/NP070205M
Rabdoternin C 44445759 Click to see 434.50 unknown https://doi.org/10.1021/NP070205M
Rabdoternin D 44445758 Click to see 408.50 unknown https://doi.org/10.1021/NP070205M
rabdoternin E 44445766 Click to see 394.50 unknown https://doi.org/10.1021/NP070205M
Rosthorin A 44445757 Click to see CC1(CCCC23C1C(C(C45C2C(CC(C4O)C(=C)C5=O)O)(OC3)O)O)C 364.40 unknown https://doi.org/10.1021/NP070205M
Xerophilusin A 44445773 Click to see CC(=O)OC1CC2C3C4(C1C56CCCC(C5C(C4(OC6O3)O)O)(C)C)C(=O)C2=C 404.50 unknown https://doi.org/10.1021/NP070205M
https://doi.org/10.1016/S0031-9422(01)00164-9
Xerophilusin B 44445767 Click to see 346.40 unknown https://doi.org/10.1021/NP070205M
Xerophilusin C 9975895 Click to see CC1(CCCC23C1C(C4(C56C2C(CC(C5OC3O4)C(=C)C6=O)O)O)O)C 362.40 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
Xerophilusin D 44445775 Click to see 362.40 unknown https://doi.org/10.1021/NP070205M
Xerophilusin G 11729514 Click to see 422.50 unknown https://doi.org/10.1021/NP070205M
Xerophilusin H 44445754 Click to see 406.50 unknown https://doi.org/10.1021/NP070205M
Xerophilusin I 11057179 Click to see 348.40 unknown https://doi.org/10.1002/CHIN.200649184
https://doi.org/10.1021/NP070205M
xerophilusin II 23626809 Click to see CC1(CCCC2(C1C(C(=O)C34C2C(CC(C3O)C(=C)C4=O)O)O)C=O)C 362.40 unknown https://doi.org/10.1021/NP070205M
Xerophilusin Iv 23626811 Click to see 364.40 unknown https://doi.org/10.1021/NP070205M
Xerophilusin K 10971529 Click to see 406.50 unknown https://doi.org/10.1021/NP070205M
Xerophilusin V 44445728 Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3)O)O)O)CO 382.40 unknown https://doi.org/10.1021/NP070205M
Xerophilusin Vi 23626813 Click to see 438.50 unknown https://doi.org/10.1021/NP070205M
Xerophilusin X 44445745 Click to see CC(=O)OC1CC2C(C3(C1C45CCCC(C4C(C3(OC5)O)OC(=O)C)(C)C)C(C2=C)O)O 450.50 unknown https://doi.org/10.1021/NP070205M
Xerophilusin X1 23626973 Click to see CC(=O)OC1CC2C(C(=O)C3(C1C45CCCC(C4C(C3(OC5)O)O)(C)C)C2O)COC 438.50 unknown https://doi.org/10.1021/NP070205M
xerophilusin XI 44445749 Click to see CC1(CCCC23C1C(C(C45C2C(CC(C4O)C(=C)C5=O)O)(OC3OC)O)O)C 394.50 unknown https://doi.org/10.1021/NP070205M
Xerophilusine I 23626808 Click to see 362.40 unknown https://doi.org/10.1021/NP070205M
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
2,6-Dimethylocta-2,6-diene-1,8-diol 537558 Click to see CC(=CCO)CCC=C(C)CO 170.25 unknown https://doi.org/10.1021/NP070205M
https://doi.org/10.1021/NP200140J
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Iridoids and derivatives
(1S,2R,3S,5R,6S)-2-methyl-5-[(1S)-1,2,2-trimethylcyclopentyl]-7-oxabicyclo[4.1.0]heptane-2,3-diol 11076002 Click to see CC1(CCCC1(C)C2CC(C(C3C2O3)(C)O)O)C 254.36 unknown https://doi.org/10.1055/S-2002-34926
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
[(E)-2-[(1S,5S,7R,8S,11R)-11-(2-methoxypropan-2-yl)-8-methyl-5-(2-oxopropyl)-4-oxatricyclo[6.3.1.02,6]dodec-2(6)-en-7-yl]ethenyl] 3-methylbut-2-enoate 11154655 Click to see 430.60 unknown via CMAUP database
[(E)-2-[(1S,5S,7R,8S,11S)-11-(2-methoxypropan-2-yl)-8-methyl-5-(2-oxopropyl)-4-oxatricyclo[6.3.1.02,6]dodec-2(6)-en-7-yl]ethenyl] 3-methylbut-2-enoate 11166314 Click to see CC(=CC(=O)OC=CC1C2=C(COC2CC(=O)C)C3CC1(CCC3C(C)(C)OC)C)C 430.60 unknown via CMAUP database
[(E)-2-[(1S,5S,7R,8S,11S)-8-methyl-5-(2-oxopropyl)-11-prop-1-en-2-yl-4-oxatricyclo[6.3.1.02,6]dodec-2(6)-en-7-yl]ethenyl] 3-methylbut-2-enoate 11188728 Click to see 398.50 unknown via CMAUP database
Neovibsanin G 11188727 Click to see CC(=CC(=O)OC=CC1C2=C(COC2CC(=O)C)C3CC1(CCC3C(=C)C)C)C 398.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Guaianes
2-[(3aS,5R,8aR)-3-methyl-8-methylidene-3a,4,5,6,7,8a-hexahydro-1H-azulen-5-yl]propan-2-ol 10656574 Click to see 220.35 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
[(E)-2-[(1S,5S,7R,8S,11R)-11-(2-methoxypropan-2-yl)-8-methyl-3-oxo-5-(2-oxopropyl)-4-oxatricyclo[6.3.1.02,6]dodec-2(6)-en-7-yl]ethenyl] 3-methylbut-2-enoate 11351274 Click to see 444.60 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones
(-)-Rabdoternin A 3086622 Click to see 364.40 unknown https://doi.org/10.1055/S-2002-34926
(1R,2R,5S,8R,9S,10S,11R,18R)-9,10,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,16-dione 162870349 Click to see 362.40 unknown https://doi.org/10.1021/NP070205M
[(1S,1'R,2'R,5S,6S,7R,9S)-2'-formyl-7-hydroxy-1'-methyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-1'-yl]methyl acetate 13241289 Click to see CC(=O)OCC1(CCCC2(C1C=O)COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)C 404.50 unknown https://doi.org/10.1021/NP070205M
[(3R,4a'R,5'S,7'R,9a'R)-2-Formyl-5'-hydroxy-3-methyl-8'-methylene-1',9'-dioxohexahydrospiro[cyclohexane-1,4'-[2]oxa[7,9a]methanocyclohepta[c]pyran]-3-yl]methyl acetate 122739 Click to see CC(=O)OCC1(CCCC2(C1C=O)COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)C 404.50 unknown https://doi.org/10.1021/NP070205M
9,10,18-Trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,16-dione 77916056 Click to see 362.40 unknown https://doi.org/10.1021/NP200140J
Rabdoternin A 70698010 Click to see CC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3=O)O)O)C 364.40 unknown https://doi.org/10.1055/S-2002-34926
Trichorabdal B 44445777 Click to see 404.50 unknown https://doi.org/10.1021/NP070205M
Xerophilusin N 44445776 Click to see CC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3=O)O)O)C 362.40 unknown https://doi.org/10.1021/NP070205M
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(1R,3aS,5aR,5bR,7R,7aR,11aR,11bR,13aR,13bR)-7-hydroxy-5a,5b,8,8,11a-pentamethyl-9-oxo-1-prop-1-en-2-yl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysene-3a-carboxylic acid 11547321 Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(=O)C(C5C(CC4(C3(CC2)C)C)O)(C)C)C)C(=O)O 470.70 unknown via CMAUP database
(1R,3aS,5aR,5bR,7S,7aR,11aR,11bR,13aR,13bR)-7-hydroxy-5a,5b,8,8,11a-pentamethyl-9-oxo-1-prop-1-en-2-yl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysene-3a-carboxylic acid 21636123 Click to see 470.70 unknown via CMAUP database
(1R,3aS,5aR,5bR,7S,7aS,11aR,11bR,13aR,13bR)-7-hydroxy-5a,5b,8,8,11a-pentamethyl-9-oxo-1-prop-1-en-2-yl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysene-3a-carboxylic acid 38361098 Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(=O)C(C5C(CC4(C3(CC2)C)C)O)(C)C)C)C(=O)O 470.70 unknown via CMAUP database
(1S,4S,5R,8R,13S,14R,17S,18R)-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-one 15385431 Click to see 438.70 unknown via CMAUP database
(3S,4aS,6aR,6bS,8aR,12aR,14aS,14bR)-3-hydroxy-4,4,6a,6b,8a,11,11,14b-octamethyl-3,4a,5,6,7,8,9,10,12,12a,14,14a-dodecahydro-2H-picen-1-one 14194115 Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(C(=O)CC(C5(C)C)O)C)C)C2C1)C)C)C 440.70 unknown via CMAUP database
(3S,4aS,6aR,6bS,8aS,12aS,14aS,14bR)-3-hydroxy-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-3,4a,5,6,7,8,9,10,12,12a,14,14a-dodecahydro-2H-picen-1-one 15349716 Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(C(=O)CC(C5(C)C)O)C)C)C2C1)C)CO)C 456.70 unknown via CMAUP database
[(1S,1'R,2S,2'S,3S,4'S,5R,6S,6'S,7'S,8R,8'R,9S,11S,13S,13'S,14S,14'S,15R,15'S,17'S)-3-acetyloxy-6',7',13,14-tetrahydroxy-9',9',16,16-tetramethyl-7-oxospiro[10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecane-6,21'-3,5,22-trioxaheptacyclo[12.9.0.01,6.02,17.04,13.08,13.018,23]tricos-18(23)-ene]-15'-yl] acetate 163058091 Click to see 808.90 unknown https://doi.org/10.1021/NP070205M
11-Oxoerythrodiol 15349718 Click to see 456.70 unknown via CMAUP database
Enanderinanin J 73346849 Click to see 808.90 unknown https://doi.org/10.1021/NP070205M
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides / Steroidal saponins
(2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5R,6R)-2-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl)oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol 5315343 Click to see 903.10 unknown via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Pentacarboxylic acids and derivatives
[(1R,3S,3aR,4R,5R,6R,7aS)-6-[(1S,2R,3R,4S,6S)-4-acetyloxy-6-hydroxy-2-(2-methoxy-2-oxoethyl)-1,3-dimethyl-7,9-dioxabicyclo[4.2.1]nonan-3-yl]-5-formyloxy-3-(furan-3-yl)-7a-hydroxy-3a-methyl-7-methylidene-1-propanoyloxy-1,2,3,4,5,6-hexahydroinden-4-yl] (2R,3R)-2-hydroxy-3-methylpentanoate 163190175 Click to see 778.80 unknown https://doi.org/10.1016/S0031-9422(01)00164-9
> Organoheterocyclic compounds / Cycloheptafurans
[(E)-2-[(4R,5S,7S,8S)-8-(hydroxymethyl)-7,8-dimethoxy-2,5-dimethyl-5-(4-methylpent-3-enyl)-6,7-dihydro-4H-cyclohepta[b]furan-4-yl]ethenyl] 3-methylbut-2-enoate 11102578 Click to see 460.60 unknown via CMAUP database
> Organoheterocyclic compounds / Furofurans
[(E)-2-[(2R,3aS,8S,9R,9aS)-8-[(E)-4-hydroperoxy-4-methylpent-2-enyl]-2-methoxy-2,8-dimethyl-3a,5,7,9-tetrahydro-3H-furo[2,3-i][2]benzofuran-9-yl]ethenyl] 3-methylbut-2-enoate 11340195 Click to see 462.60 unknown via CMAUP database
[(E)-2-[(2S,3aS,8S,9R,9aS)-8-[(E)-4-hydroperoxy-4-methylpent-2-enyl]-2-methoxy-2,8-dimethyl-3a,5,7,9-tetrahydro-3H-furo[2,3-i][2]benzofuran-9-yl]ethenyl] 3-methylbut-2-enoate 11385697 Click to see CC(=CC(=O)OC=CC1C(CC=C2C13C(CC(O3)(C)OC)OC2)(C)CC=CC(C)(C)OO)C 462.60 unknown via CMAUP database
Neovibsanin A 46866590 Click to see 430.60 unknown via CMAUP database
Neovibsanin B 25259221 Click to see CC(=CCCC1(CC=C2COC3C2(C1C=COC(=O)C=C(C)C)OC(C3)(C)OC)C)C 430.60 unknown via CMAUP database
> Organoheterocyclic compounds / Isobenzofurans
(1E)-2-((3S,4R,5S,7S)-1,3,4,5,6,7-Hexahydro-7-hydroxy-5-methyl-5-(4-methyl-3-penten-1-yl)-3-(2-oxopropyl)-4-isobenzofuranyl)ethenyl 3-methyl-2-butenoate 10645581 Click to see 416.50 unknown via CMAUP database
[(E)-2-[(3S,4R,5S,7R)-7-methoxy-5-methyl-5-(4-methylpent-3-enyl)-3-(2-oxopropyl)-3,4,6,7-tetrahydro-1H-2-benzofuran-4-yl]ethenyl] 3-methylbut-2-enoate 11362444 Click to see 430.60 unknown via CMAUP database
[(E)-2-[(3S,4R,5S,7S)-7-methoxy-5-methyl-5-(4-methylpent-3-enyl)-3-(2-oxopropyl)-3,4,6,7-tetrahydro-1H-2-benzofuran-4-yl]ethenyl] 3-methylbut-2-enoate 11750791 Click to see 430.60 unknown via CMAUP database
Neovibsanin I 10788065 Click to see CC(=CCCC1(CC(C2=C(C1C=COC(=O)C=C(C)C)C(OC2)CC(=O)C)O)C)C 416.50 unknown via CMAUP database
> Organoheterocyclic compounds / Lactones / Delta valerolactones
(1S,2S,3R,13R,14S)-9-hydroxy-14-(hydroxymethyl)-7,7-dimethyl-10,15-dioxo-16-oxatetracyclo[11.3.1.02,11.03,8]heptadeca-8,11-diene-3-carbaldehyde 11279863 Click to see 360.40 unknown https://doi.org/10.1002/HLCA.200490176
(1S,2S,3R,13R)-9-hydroxy-7,7-dimethyl-14-methylidene-10,15-dioxo-16-oxatetracyclo[11.3.1.02,11.03,8]heptadeca-8,11-diene-3-carbaldehyde 11393709 Click to see CC1(CCCC2(C1=C(C(=O)C3=CC4CC(C32)OC(=O)C4=C)O)C=O)C 342.40 unknown https://doi.org/10.1002/HLCA.200490176
9-Hydroxy-14-(hydroxymethyl)-7,7-dimethyl-10,15-dioxo-16-oxatetracyclo[11.3.1.02,11.03,8]heptadeca-8,11-diene-3-carbaldehyde 72781628 Click to see 360.40 unknown https://doi.org/10.1002/HLCA.200490176
9-Hydroxy-7,7-dimethyl-14-methylidene-10,15-dioxo-16-oxatetracyclo[11.3.1.02,11.03,8]heptadeca-8,11-diene-3-carbaldehyde 72829820 Click to see 342.40 unknown https://doi.org/10.1002/HLCA.200490176
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[(2R,3S)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]oxane-3,4,5-triol 10625848 Click to see 522.50 unknown via CMAUP database
2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-5-[(E)-3-hydroxyprop-1-enyl]-1-benzofuran-7-ol 10246758 Click to see 342.30 unknown via CMAUP database
2-(4-hydroxy-3-methoxyphenyl)-5-[(E)-3-hydroxyprop-1-enyl]-3-(methoxymethyl)-1-benzofuran-7-ol 10498464 Click to see COCC1=C(OC2=C1C=C(C=C2O)C=CCO)C3=CC(=C(C=C3)O)OC 356.40 unknown via CMAUP database
Dihydrodehydroconiferyl alcohol, (7R,8S)-(-)- 5274623 Click to see COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)CCCO 360.40 unknown via CMAUP database
Urolignoside 10602086 Click to see COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)OC)CCCO 522.50 unknown via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Coumarin glycosides
[(2R,3R,4S,5R,6S)-4-acetyloxy-3,5-dihydroxy-6-(6-methoxy-2-oxochromen-7-yl)oxyoxan-2-yl]methyl acetate 21636120 Click to see 438.40 unknown via CMAUP database
[(2R,3S,4S,5R,6S)-5-acetyloxy-3,4-dihydroxy-6-(6-methoxy-2-oxochromen-7-yl)oxyoxan-2-yl]methyl acetate 21636119 Click to see CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C3C=CC(=O)OC3=C2)OC)OC(=O)C)O)O 438.40 unknown via CMAUP database
Scopolin 439514 Click to see COC1=C(C=C2C(=C1)C=CC(=O)O2)OC3C(C(C(C(O3)CO)O)O)O 354.31 unknown via CMAUP database

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