Isodon rubescens
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Table of Contents
Details Top
Internal ID | UUID643fdf8281653646338624 |
Scientific name | Isodon rubescens |
Authority | (Hemsl.) H.Hara |
First published in | J. Jap. Bot. 60: 236 (1985) |
Description Top
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Synonyms Top
Scientific name | Authority | First published in |
---|---|---|
Isodon ricinispermus | Kudô | Mem. Fac. Sci. Taihoku Imp. Univ. 2: 132 (1929) |
Isodon rubescens var. eglandulosus | C.Chen | Guihaia 15: 215 (1995) |
Plectranthus dichromophyllus | Diels | Bot. Jahrb. Syst. 29: 562 (1900) |
Plectranthus ricinispermus | Pamp. | Nuovo Giorn. Bot. Ital. , n.s., 17: 707 (1910) |
Plectranthus rubescens | Hemsl. | J. Linn. Soc., Bot. 26: 273 (1890) |
Rabdosia dichromophylla | (Diels) H.Hara | J. Jap. Bot. 47: 194 (1972) |
Rabdosia ricinisperma | (Pamp.) H.Hara | J. Jap. Bot. 47: 199 (1972) |
Rabdosia rubescens | (Hemsl.) H.Hara | J. Jap. Bot. 47: 199 (1972) |
Rabdosia rubescens f. lushanensis | Z.Y.Gao & Y.R.Li | Acta Phytotax. Sin. 24: 15 (1986) |
Rabdosia rubescens var. lushiensis | Z.Y.Gao & Y.R.Li | Acta Phytotax. Sin. 24: 16 (1986) |
Rabdosia rubescens var. taihangensis | Z.Y.Gao & Y.R.Li | Acta Phytotax. Sin. 24: 15 (1986) |
Isodon henryi var. dichromophyllus | (Diels) Kudô | Mem. Fac. Sci. Taihoku Imp. Univ. 2: 123. 1929 |
Common names Top
Add a new one! Suggest a correction!Language | Common/alternative name |
---|---|
Chinese | 冬凌草 |
Chinese | 碎米桠 |
Chinese | 冰凌草 |
Chinese | 破血丹 |
Chinese | 野藿香花 |
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 click to expand
-
China
- China North-central
- China South-central
- China Southeast
-
China
Links to other databases Top
Suggest others/fix!Database | ID/link to page |
---|---|
World Flora Online | wfo-0000217954 |
UNII | 2J2179ITFU |
Tropicos | 17607215 |
KEW | urn:lsid:ipni.org:names:915158-1 |
The Plant List | kew-103019 |
Open Tree Of Life | 285439 |
NCBI Taxonomy | 587669 |
IPNI | 915158-1 |
GBIF | 7308552 |
EOL | 2898983 |
USDA GRIN | 476478 |
CMAUP | NPO28626 |
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)!
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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 / Anthracenes / Anthraquinones | |||||
Physcione | 10639 | Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)OC | 284.26 | unknown | via CMAUP database |
> Benzenoids / Anthracenes / Anthraquinones / Hydroxyanthraquinones | |||||
Rubiadin | 124062 | Click to see CC1=C(C=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)O | 254.24 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Salicylic acid and derivatives / Salicylic acids | |||||
Salicylic Acid | 338 | Click to see C1=CC=C(C(=C1)C(=O)O)O | 138.12 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
> Benzenoids / Phenol ethers / Anisoles | |||||
Elemicin | 10248 | Click to see COC1=CC(=CC(=C1OC)OC)CC=C | 208.25 | unknown | via CMAUP database |
> Benzenoids / Phenols / Benzenediols / Catechols | |||||
Urushiol III | 5281862 | Click to see CCCC=CCC=CCCCCCCCC1=C(C(=CC=C1)O)O | 316.50 | unknown | via CMAUP database |
> Hydrocarbons / Saturated hydrocarbons | |||||
1-Deuteriodecane | 10877229 | Click to see CCCCCCCCCC | 143.29 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters | |||||
(3S)-3beta,6beta,9beta-Trimethyl-4beta-(angeloyloxy)-6,7alpha-dihydroxy-9-(methoxymethyl)-2,3,3abeta,5,6,7,9,9balpha-octahydro-4H-cyclohepta[2,1-b:3,4-c']difuran-2-one | 102321417 | Click to see CC=C(C)C(=O)OC1CC(C2=C(C3C1C(C(=O)O3)C)C(OC2O)(C)COC)(C)O | 410.50 | unknown | via CMAUP database |
[(3S,3aR,4S,6S,9bS)-6-hydroxy-3,6,9-trimethyl-2-oxo-3,3a,4,5,8,9b-hexahydroazuleno[4,5-b]furan-4-yl] (E)-2-methylbut-2-enoate | 101672241 | Click to see CC=C(C)C(=O)OC1CC(C2=CCC(=C2C3C1C(C(=O)O3)C)C)(C)O | 346.40 | unknown | via CMAUP database |
[(3S,3aR,4S,6S,9bS)-6-hydroxy-3,6,9-trimethyl-2-oxo-3,3a,4,5,8,9b-hexahydroazuleno[4,5-b]furan-4-yl] (Z)-2-methylbut-2-enoate | 101078309 | Click to see CC=C(C)C(=O)OC1CC(C2=CCC(=C2C3C1C(C(=O)O3)C)C)(C)O | 346.40 | unknown | via CMAUP database |
[(3S,3aR,4S,6S,9R,9bS)-6,9-dihydroxy-3,6,9-trimethyl-2,7-dioxo-3,3a,4,5,8,9b-hexahydroazuleno[4,5-b]furan-4-yl] (E)-2-methylbut-2-enoate | 15922700 | Click to see CC=C(C)C(=O)OC1CC(C2=C(C3C1C(C(=O)O3)C)C(CC2=O)(C)O)(C)O | 378.40 | unknown | via CMAUP database |
[(3S,3aR,4S,6S,9R,9bS)-6,9-dihydroxy-3,6,9-trimethyl-2,7-dioxo-3,3a,4,5,8,9b-hexahydroazuleno[4,5-b]furan-4-yl] (Z)-2-methylbut-2-enoate | 101143220 | Click to see CC=C(C)C(=O)OC1CC(C2=C(C3C1C(C(=O)O3)C)C(CC2=O)(C)O)(C)O | 378.40 | unknown | via CMAUP database |
8alpha-Angeloyl-2alpha,4alpha,10beta-trihydroxy-6betaH,7alphaH-1(5)-guaien-12,6alpha-olide | 643640 | Click to see CC=C(C)C(=O)OC1CC(C2=C(C3C1C(C(=O)O3)C)C(CC2O)(C)O)(C)O | 380.40 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids | |||||
(4aS,4bS,7R,8S,10aS,10bS,12aR)-8-(3-hydroxyprop-1-en-2-yl)-2,2,4a,10b-tetramethyl-4b,5,7,8,9,10,10a,11,12,12a-decahydro-4H-phenanthro[2,1-d][1,3]dioxin-7-ol | 11417541 | Click to see CC1(OCC2(C(O1)CCC3(C2CC=C4C3CCC(C4O)C(=C)CO)C)C)C | 376.50 | unknown | https://doi.org/10.1002/HLCA.200490072 |
(4S,4aR,4bR,5S,7S,8aR,10S,10aR)-4,5,10-trihydroxy-1,1-dimethyl-9-oxo-7-(3-oxoprop-1-en-2-yl)-3,4,4b,5,6,7,8,8a,10,10a-decahydro-2H-phenanthrene-4a-carbaldehyde | 162975610 | Click to see CC1(CCC(C2(C1C(C(=O)C3C2C(CC(C3)C(=C)C=O)O)O)C=O)O)C | 364.40 | unknown | https://doi.org/10.1016/J.TET.2004.01.028 |
(4S,4aR,4bS,5S,7R,8aS,10S,10aS)-4,5,10-trihydroxy-1,1-dimethyl-9-oxo-7-(3-oxoprop-1-en-2-yl)-3,4,4b,5,6,7,8,8a,10,10a-decahydro-2H-phenanthrene-4a-carbaldehyde | 101342827 | Click to see CC1(CCC(C2(C1C(C(=O)C3C2C(CC(C3)C(=C)C=O)O)O)C=O)O)C | 364.40 | unknown | https://doi.org/10.1016/J.TET.2004.01.028 |
2-(2,8,15-Trihydroxy-5,5-dimethyl-7-oxo-14-oxatetracyclo[7.6.1.01,6.013,16]hexadecan-11-yl)prop-2-enal | 162861860 | Click to see CC1(CCC(C23C1C(=O)C(C4C2C(CC(C4)C(=C)C=O)OC3O)O)O)C | 364.40 | unknown | https://doi.org/10.1016/J.TET.2004.01.028 |
2-[(1R,2S,6R,8S,9S,11S,13S,15S,16R)-2,8,15-trihydroxy-5,5-dimethyl-7-oxo-14-oxatetracyclo[7.6.1.01,6.013,16]hexadecan-11-yl]prop-2-enal | 162861861 | Click to see CC1(CCC(C23C1C(=O)C(C4C2C(CC(C4)C(=C)C=O)OC3O)O)O)C | 364.40 | unknown | https://doi.org/10.1016/J.TET.2004.01.028 |
2-[(1S,2R,6R,8R,9S,11S,16R)-2,8,15-trihydroxy-5,5-dimethyl-7-oxo-14-oxatetracyclo[7.6.1.01,6.013,16]hexadecan-11-yl]prop-2-enal | 101342826 | Click to see CC1(CCC(C23C1C(=O)C(C4C2C(CC(C4)C(=C)C=O)OC3O)O)O)C | 364.40 | unknown | https://doi.org/10.1016/J.TET.2004.01.028 |
4,5,10-trihydroxy-1,1-dimethyl-9-oxo-7-(3-oxoprop-1-en-2-yl)-3,4,4b,5,6,7,8,8a,10,10a-decahydro-2H-phenanthrene-4a-carbaldehyde | 162975609 | Click to see CC1(CCC(C2(C1C(C(=O)C3C2C(CC(C3)C(=C)C=O)O)O)C=O)O)C | 364.40 | unknown | https://doi.org/10.1016/J.TET.2004.01.028 |
8-(3-hydroxyprop-1-en-2-yl)-2,2,4a,10b-tetramethyl-4b,5,7,8,9,10,10a,11,12,12a-decahydro-4H-phenanthro[2,1-d][1,3]dioxin-7-ol | 72953475 | Click to see CC1(OCC2(C(O1)CCC3(C2CC=C4C3CCC(C4O)C(=C)CO)C)C)C | 376.50 | unknown | https://doi.org/10.1002/HLCA.200490072 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Kaurane diterpenoids | |||||
(-)-Melissoidesin G | 132472107 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)OC(=O)C)O)C(=O)C4=C)O)C | 434.50 | unknown | https://doi.org/10.1002/CHIN.200447161 |
(18-Hydroxy-16-methoxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl) acetate | 75220892 | Click to see CC(=O)OC1CC2C(C3(C1C45CCCC(C4CC3OC5OC)(C)C)C(=O)C2=C)O | 404.50 | unknown |
https://doi.org/10.1002/CHIN.200332121 https://doi.org/10.1021/NP100110U |
(1R,2R,3S,5S,6S,8S,9S,10S,11R,15S)-3,9,10,15-tetrahydroxy-6-(methoxymethyl)-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 162888605 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(C5=O)COC)O)(OC3)O)O)O)C | 396.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
(1R,2R,4S,6R,8S,9R,11R,12S,16R,17R)-8,11,16-trihydroxy-2-methoxy-13,13-dimethyl-7-methylidene-3-oxapentacyclo[7.7.1.16,9.01,12.04,17]octadecan-10-one | 162846815 | Click to see CC1(CCC(C23C1C(C(=O)C45C2C(CC(C4)C(=C)C5O)OC3OC)O)O)C | 378.50 | unknown | https://doi.org/10.1055/S-2004-827165 |
(1R,2R,4S,6S,9S,10S,11S,13S)-2,6,11-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-3,15-dione | 11393921 | Click to see CC1(C(CCC2(C1C(=O)C(C34C2C(CC(C3)C(=C)C4=O)O)O)C)O)C | 348.40 | unknown | https://doi.org/10.1248/CPB.52.767 |
(1R,2S,3R,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 | 73345999 | Click to see CC1(CCCC23C1C(C(C45C2C(CC(C4O)C(=C)C5=O)O)(OC3)O)O)C | 364.40 | unknown | https://doi.org/10.1055/S-0029-1186002 |
(1R,2S,3S,5S,7R,8R,9S,10S,11R,16S,18R)-12,12-dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-3,7,9,10,18-pentol | 163033256 | Click to see CC(C)CCOC1C23CCCC(C2C(C(O1)(C45C3C(CC(C4O)C(=C)C5O)O)O)O)(C)C | 452.60 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(1R,2S,3S,5S,8S,9S,10S,11R,15S,16S)-3,9,10,15-tetrahydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 162991287 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(=C)C5=O)O)(OC3OC)O)O)O)C | 394.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(1R,2S,4S,6S,9S,10S,11S,13S)-2,6,11-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-3,15-dione | 11439459 | Click to see CC1(C(CCC2(C1C(=O)C(C34C2C(CC(C3)C(=C)C4=O)O)O)C)O)C | 348.40 | unknown | https://doi.org/10.1248/CPB.52.767 |
(1R,2S,5S,7R,8R,9S,10S,11R,15S,16R,18R)-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol | 162945782 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3OC)O)O)O)C | 396.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(1R,2S,5S,7R,8R,9S,10S,11R,15S,16S,18R)-16-[[(3aR,5aS,6S,7R,9aS,9bS,11aS)-7-hydroxy-6,9a-dimethyl-1-methylidene-3a,5,5a,7,8,9,9b,10,11,11a-decahydronaphtho[1,2-g][1]benzofuran-6-yl]methoxy]-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol | 163043075 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3OCC6(C(CCC7(C6CC=C8C7CCC9C8OCC9=C)C)O)C)O)O)O)C | 682.90 | unknown | https://doi.org/10.1002/HLCA.200490072 |
(1R,2S,5S,8R,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 | 102004768 | Click to see CC1(CCC(C23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)O)C | 362.40 | unknown | via CMAUP database |
(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 CC1(CCC(C23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)O)C | 362.40 | unknown | via CMAUP database |
(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 CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3OC)O)O)O)C | 394.50 | unknown |
https://doi.org/10.1002/HLCA.200390077 https://doi.org/10.1016/J.TET.2006.02.079 |
(1R,2S,5S,8R,9S,10S,11R,15S,18R)-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol | 102588467 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3OC)O)O)O)C | 396.50 | unknown | https://doi.org/10.1002/HLCA.200390077 |
(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 CC1(CCC(C23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)O)C | 362.40 | unknown |
https://doi.org/10.1016/J.TET.2006.02.079 https://doi.org/10.1248/CPB.48.148 https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1016/J.FITOTE.2011.03.003 https://doi.org/10.1055/S-0029-1186002 |
(1R,2S,5S,8S,9S,11R,15S,16R,17R)-9,15,16,17-tetrahydroxy-12,12-dimethyl-6-methylidenepentacyclo[7.6.1.15,8.01,11.02,8]heptadecane-7,10-dione | 163071096 | Click to see CC1(CCC(C23C1C(=O)C(C2O)(C45C3CCC(C4O)C(=C)C5=O)O)O)C | 362.40 | unknown | https://doi.org/10.1016/0031-9422(92)80306-Y |
(1S,2R,3R,5R,8R,9R,10R,11S,15R,16R)-3,9,10,15-tetrahydroxy-12,12-dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 162844654 | Click to see CC(C)CCOC1C23C(CCC(C2C(C(O1)(C45C3C(CC(C4)C(=C)C5=O)O)O)O)(C)C)O | 450.60 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(1S,2R,4R,6S,9S,10S,11S,13R)-2,6,11-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-3,15-dione | 162897984 | Click to see CC1(C(CCC2(C1C(=O)C(C34C2C(CC(C3)C(=C)C4=O)O)O)C)O)C | 348.40 | unknown | https://doi.org/10.1248/CPB.52.767 |
(1S,2R,5R,7S,8S,9R,10R,11S,15R,16R,18S)-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol | 162945781 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3OC)O)O)O)C | 396.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(1S,2R,5R,7S,8S,9R,10R,11S,15R,16S,18S)-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol | 162945783 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3OC)O)O)O)C | 396.50 | unknown | https://doi.org/10.1002/HLCA.200390077 |
(1S,2R,5R,7S,8S,9R,10R,11S,16R,18S)-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,18-tetrol | 162849432 | Click to see CC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3OC)O)O)C | 380.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(1S,2R,5R,8S,9R,10R,11S,15R,16R,18S)-9,10,15,18-tetrahydroxy-12,12-dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 162964437 | Click to see CC(C)CCOC1C23C4CCC5C(C4(C(=O)C5=C)C(O1)(C(C2C(CCC3O)(C)C)O)O)O | 450.60 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(1S,2R,5R,8S,9R,10R,11S,15R,16R,18S)-9,10,15,18-tetrahydroxy-12,12-dimethyl-6-methylidene-16-(2-methylpropoxy)-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 162967716 | Click to see CC(C)COC1C23C4CCC5C(C4(C(=O)C5=C)C(O1)(C(C2C(CCC3O)(C)C)O)O)O | 436.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(1S,2R,5R,8S,9R,10R,11S,15R,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 | 162904214 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3O)O)O)O)C | 380.40 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(1S,2R,5R,8S,9R,10R,11S,15R,16S,18S)-9,10,15,18-tetrahydroxy-12,12-dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 162964438 | Click to see CC(C)CCOC1C23C4CCC5C(C4(C(=O)C5=C)C(O1)(C(C2C(CCC3O)(C)C)O)O)O | 450.60 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(1S,2S,10S,11R,15S,18S)-9,10,15,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 45358139 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown | via CMAUP database |
(1S,2S,3R,6S,7S,8R,12S,16R,18S)-6,7-dihydroxy-9,9,14,14-tetramethyl-19-methylidene-5,13,15-trioxahexacyclo[16.2.1.01,6.02,16.03,8.03,12]henicosan-20-one | 162881770 | Click to see CC1(CCC2C34C1C(C(C56C3C(CC(C5)C(=C)C6=O)OC(O2)(C)C)(OC4)O)O)C | 404.50 | unknown | https://doi.org/10.1055/S-0029-1186002 |
(1S,2S,3S,5S,6R,8S,9S,10S,11R,15S)-3,6,9,10,15-pentahydroxy-6-(hydroxymethyl)-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 162946451 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(C5=O)(CO)O)O)(OC3)O)O)O)C | 398.40 | unknown | https://doi.org/10.1248/CPB.51.790 |
(1S,2S,3S,5S,6S,8S,9S,10S,11R,15S)-3,9,10,15-tetrahydroxy-6-(methoxymethyl)-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 101249030 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(C5=O)COC)O)(OC3)O)O)O)C | 396.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
(1S,2S,3S,5S,7R,8S,9S,10S,11R,15S)-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-3,7,9,10,15-pentol | 162907281 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(=C)C5O)O)(OC3)O)O)O)C | 366.40 | unknown |
https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1016/J.TET.2006.02.079 |
(1S,2S,3S,5S,8S,9S,11R,16S,18R)-16-ethoxy-3,18-dihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 46906464 | Click to see CCOC1C23CCCC(C2CC(O1)C45C3C(CC(C4O)C(=C)C5=O)O)(C)C | 376.50 | unknown | https://doi.org/10.1021/NP100110U |
(1S,2S,3S,5S,8S,9S,11R,16S,18R)-3,16,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 46906462 | Click to see CC1(CCCC23C1CC(C45C2C(CC(C4O)C(=C)C5=O)O)OC3O)C | 348.40 | unknown | https://doi.org/10.1021/NP100110U |
(1S,2S,3S,5S,8S,9S,11R,16S,18R)-3,18-dihydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 46906463 | Click to see CC1(CCCC23C1CC(C45C2C(CC(C4O)C(=C)C5=O)O)OC3OC)C | 362.50 | unknown | https://doi.org/10.1021/NP100110U |
(1S,2S,5S,6S,8R,9S,10S,11R,15S,18R)-9,10,15,18-tetrahydroxy-6-(hydroxymethyl)-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 102189514 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(C5=O)CO)(OC3)O)O)O)C | 382.40 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
(1S,2S,5S,7R,8S,9S,10S,11R,15S,18R)-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol | 162882158 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3)O)O)O)C | 366.40 | unknown | https://doi.org/10.1248/CPB.51.790 |
(1S,2S,5S,7R,9S,10S,11R,15S,18R)-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol | 163187420 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3)O)O)O)C | 366.40 | unknown | https://doi.org/10.1248/CPB.51.790 |
(1S,2S,5S,8R,10S,11R,15S,18S)-9,10,15,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 102004437 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown | via CMAUP database |
(1S,2S,5S,8S,9S,10S,11R,15S,18R)-9,10,15,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-azapentacyclo[7.6.2.15,8.01,11.02,8]octadec-16-en-7-one | 118735597 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(N=C3)O)O)O)C | 361.40 | unknown | https://doi.org/10.1021/NP5006136 |
(1S,2S,8R,9S,11R)-9,10,15,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 138107787 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown |
https://doi.org/10.1016/S0031-9422(99)00578-6 https://doi.org/10.1002/CHIN.200349162 https://doi.org/10.1248/CPB.48.148 https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1021/NP0304114 |
(1S,3S,5R,7S,11R,12R,13S,16S,19R,20S,21R)-1,20,21-trihydroxy-10,10-dimethyl-17-methylidene-5-[(2R)-1-[(1S,2S,5S,6S,8R,9S,10S,11R,15S,18R)-9,10,15,18-tetrahydroxy-12,12-dimethyl-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-6-yl]propan-2-yl]-2,4,6-trioxahexacyclo[9.8.1.116,19.03,12.07,12.013,19]henicosan-18-one | 163042694 | Click to see CC(CC1C2CCC3C45COC(C3(C2O)C1=O)(C(C4C(CCC5O)(C)C)O)O)C6OC7CCC(C8C79C1CCC2C(C1(C(=O)C2=C)C(C8O)(OC9O6)O)O)(C)C | 784.90 | unknown | https://doi.org/10.1021/OL0531379 |
(2-Acetyloxy-11-hydroxy-5,5,9-trimethyl-14-methylidene-3,15-dioxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate | 4345590 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(=O)C2C1(C)C)OC(=O)C)C(=O)C4=C)O)C | 432.50 | unknown |
https://doi.org/10.1248/CPB.52.767 https://doi.org/10.1016/J.TETLET.2004.02.051 |
(2-Acetyloxy-3,11-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate | 78384977 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)O)OC(=O)C)C(=O)C4=C)O)C | 434.50 | unknown |
https://doi.org/10.1016/S0031-9422(98)00469-5 https://doi.org/10.1248/CPB.52.767 |
(2,11-Dihydroxy-5,5,9-trimethyl-14-methylidene-3,15-dioxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate | 85425270 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(=O)C2C1(C)C)O)C(=O)C4=C)O)C | 390.50 | unknown | https://doi.org/10.1248/CPB.52.767 |
(2,3-Diacetyloxy-11-hydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate | 85135901 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)OC(=O)C)OC(=O)C)C(=O)C4=C)O)C | 476.60 | unknown | https://doi.org/10.1248/CPB.52.767 |
(2,3,6-Triacetyloxy-11-hydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-7-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate | 14058891 | Click to see CC(=O)OC1CC2(C3C(CC4CC3(C(C(C2C(C1OC(=O)C)(C)C)OC(=O)C)OC(=O)C)C(=O)C4=C)O)C | 534.60 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
(2,6,11-Trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-3-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate | 75051974 | Click to see CC(=O)OC1C2C(C(CCC2(C3C(CC4CC3(C1O)C(=O)C4=C)O)C)O)(C)C | 392.50 | unknown | https://doi.org/10.1248/CPB.52.767 |
(2,8,16-Trihydroxy-5,5-dimethyl-14-methylidene-15-oxo-9-tetracyclo[11.2.1.01,10.04,9]hexadecanyl)methyl acetate | 3847003 | Click to see CC(=O)OCC12C3CCC4C(C3(C(CC1C(CCC2O)(C)C)O)C(=O)C4=C)O | 392.50 | unknown | https://doi.org/10.1248/CPB.58.56 |
(2R,3S,5S,6S,8S,9S,10S,11R,15S)-3,9,10,15-tetrahydroxy-6-(methoxymethyl)-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 163193232 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(C5=O)COC)O)(OC3)O)O)O)C | 396.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
(2S,3S,7R,9R,10S,11R)-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-3,7,9,10,18-pentol | 24893880 | Click to see CC1(CCCC23C1C(C(C45C2C(CC(C4O)C(=C)C5O)O)(OC3)O)O)C | 366.40 | unknown | via CMAUP database |
(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/10.1016/S0031-9422(99)00578-6 https://doi.org/10.1248/CPB.48.148 https://doi.org/10.1016/J.CHROMA.2007.01.141 https://doi.org/10.1016/J.BBRC.2005.09.040 https://doi.org/10.1021/NP0304114 https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1002/CHIN.200349162 https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1080/07357900500524371 |
(2S,5S,9R,13R,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 | 50918905 | Click to see CC1(CCC(C23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)O)C | 362.40 | unknown | via CMAUP database |
(2S,5S,9S,10R,11R,15R,18R)-9,10,15,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 102058013 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown | via CMAUP database |
(2S,5S,9S,10R,11R,15S,18R)-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol | 101306824 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3)O)O)O)C | 366.40 | unknown |
https://doi.org/10.1002/CHIN.200349162 https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1016/S0031-9422(99)00578-6 |
(3-Acetyloxy-2,11-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate | 85115852 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)OC(=O)C)O)C(=O)C4=C)O)C | 434.50 | unknown |
https://doi.org/10.1248/CPB.52.767 https://doi.org/10.1016/J.TETLET.2004.02.051 |
(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 CC(=O)OC1C2C(CCCC23COC1(C45C3C(CC(C4O)C(=C)C5O)O)O)(C)C | 408.50 | unknown |
https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1002/HLCA.200390077 https://doi.org/10.1016/J.TET.2006.02.079 |
(5S,8S,10S,15R)-9,10,15,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 91973790 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown | via CMAUP database |
(6-Acetyloxy-11,13-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-7-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate | 78385505 | Click to see CC(=O)OC1CC2(C(CCC34C2C(CC(C3)(C(=C)C4=O)O)O)C(C1OC(=O)C)(C)C)C | 434.50 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
(6-Acetyloxy-3,7-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-11-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate | 73981742 | Click to see CC(=O)OC1CC2CC3(C1C4(CC(C(C(C4C(C3)O)(C)C)OC(=O)C)O)C)C(=O)C2=C | 434.50 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
(6-Acetyloxy-7,13-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-11-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate | 163022446 | Click to see CC(=O)OC1CC2(CC3(C1C4(CC(C(C(C4CC3)(C)C)OC(=O)C)O)C)C(=O)C2=C)O | 434.50 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
(6,20-Dihydroxy-9,9,14,14-tetramethyl-19-methylidene-5,13,15-trioxahexacyclo[16.2.1.01,6.02,16.03,8.03,12]henicosan-7-yl) acetate | 163069214 | Click to see CC(=O)OC1C2C(CCC3C24COC1(C56C4C(CC(C5)C(=C)C6O)OC(O3)(C)C)O)(C)C | 448.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(6beta,7alpha,11beta,14R,15beta)-7,20-Epoxykaur-16-ene-6,7,11,14,15-pentol | 162855895 | Click to see CC1(CCCC23C1C(C(C45C2C(CC(C4O)C(=C)C5O)O)(OC3)O)O)C | 366.40 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(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 | 14564531 | Click to see CC(=O)OC1C2C(CCCC23COC1(C45C3CCC(C4O)C(=C)C5OC(=O)C)O)(C)C | 434.50 | unknown |
https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1016/J.TET.2006.02.079 |
(7,10-Diacetyloxy-9-hydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-18-yl) acetate | 73010227 | Click to see CC(=O)OC1C2CCC3C1(C(C2=C)OC(=O)C)C4(C(C5C3(CCCC5(C)C)CO4)OC(=O)C)O | 476.60 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
(7,9,18-Trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl) acetate | 72825820 | Click to see CC(=O)OC1C2C(CCCC23COC1(C45C3CCC(C4O)C(=C)C5O)O)(C)C | 392.50 | unknown |
https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1016/J.TET.2006.02.079 |
(9,10,18-Trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl) acetate | 429192 | Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4O)C(=C)C5=O)O)(C)C | 406.50 | unknown |
https://doi.org/10.1016/J.TET.2006.02.079 https://doi.org/10.1248/CPB.58.56 |
[(1R,2R,3R,4S,6R,7S,9S,10S,11R,13S)-2,3,6-triacetyloxy-11-hydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-7-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 162947570 | Click to see CC(=O)OC1CC2(C3C(CC4CC3(C(C(C2C(C1OC(=O)C)(C)C)OC(=O)C)OC(=O)C)C(=O)C4=C)O)C | 534.60 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
[(1R,2R,3R,4S,6S,9S,10S,11S,13S)-2-acetyloxy-3,11-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 5317641 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)O)OC(=O)C)C(=O)C4=C)O)C | 434.50 | unknown |
https://doi.org/10.1248/CPB.52.767 https://doi.org/10.1002/CHIN.200447161 |
[(1R,2R,4S,6S,9S,10S,11S,13S,14S)-2,11-dihydroxy-14-(methoxymethyl)-5,5,9-trimethyl-3,15-dioxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 11223962 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(=O)C2C1(C)C)O)C(=O)C4COC)O)C | 422.50 | unknown | https://doi.org/10.1248/CPB.52.767 |
[(1R,2R,4S,6S,9S,10S,11S,13S)-2-acetyloxy-11-hydroxy-5,5,9-trimethyl-14-methylidene-3,15-dioxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 10410561 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(=O)C2C1(C)C)OC(=O)C)C(=O)C4=C)O)C | 432.50 | unknown |
https://doi.org/10.1248/CPB.52.767 https://doi.org/10.1002/CHIN.200447161 https://doi.org/10.1016/J.TETLET.2004.02.051 |
[(1R,2R,4S,6S,9S,10S,11S,13S)-2,11-dihydroxy-5,5,9-trimethyl-14-methylidene-3,15-dioxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 11176780 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(=O)C2C1(C)C)O)C(=O)C4=C)O)C | 390.50 | unknown | https://doi.org/10.1248/CPB.52.767 |
[(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 CC(=O)OC1C2C(CCCC23COC1(C45C3C(CC(C4O)C(=C)C5O)O)O)(C)C | 408.50 | unknown |
https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1016/J.TET.2006.02.079 |
[(1R,2S,5S,7R,8R,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 | 101835386 | Click to see CC(=O)OC1C2C(CCCC23COC1(C45C3CCC(C4O)C(=C)C5OC(=O)C)O)(C)C | 434.50 | unknown |
https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1002/HLCA.200390077 https://doi.org/10.1016/S0031-9422(99)00578-6 https://doi.org/10.1016/J.TET.2006.02.079 |
[(1R,2S,5S,7R,8R,9S,10S,11R,18R)-7,9,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl] acetate | 163022518 | Click to see CC(=O)OC1C2C(CCCC23COC1(C45C3CCC(C4O)C(=C)C5O)O)(C)C | 392.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
[(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/10.1016/S0031-9422(01)00245-X |
[(1R,4S,6R,7S,10S,11S,13R)-6-acetyloxy-11,13-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-7-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 5321600 | Click to see CC(=O)OC1CC2(C(CCC34C2C(CC(C3)(C(=C)C4=O)O)O)C(C1OC(=O)C)(C)C)C | 434.50 | unknown | via CMAUP database |
[(1R,4S,6R,7S,9R,10S,11S,13R)-6-acetyloxy-11,13-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-7-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 102237435 | Click to see CC(=O)OC1CC2(C(CCC34C2C(CC(C3)(C(=C)C4=O)O)O)C(C1OC(=O)C)(C)C)C | 434.50 | unknown |
https://doi.org/10.1016/S0031-9422(01)00245-X https://doi.org/10.1016/S0031-9422(99)00578-6 |
[(1R,4S,6R,7S,9R,10S,11S,13R)-6-acetyloxy-7,13-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-11-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 163022447 | Click to see CC(=O)OC1CC2(CC3(C1C4(CC(C(C(C4CC3)(C)C)OC(=O)C)O)C)C(=O)C2=C)O | 434.50 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
[(1S,2R,5R,7S,8S,9R,10R,11S,18S)-7,10-diacetyloxy-9-hydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-18-yl] acetate | 162978904 | Click to see CC(=O)OC1C2CCC3C1(C(C2=C)OC(=O)C)C4(C(C5C3(CCCC5(C)C)CO4)OC(=O)C)O | 476.60 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
[(1S,2S,3S,6S,7S,8R,12S,16S,18S,20R)-6,20-dihydroxy-9,9,14,14-tetramethyl-19-methylidene-5,13,15-trioxahexacyclo[16.2.1.01,6.02,16.03,8.03,12]henicosan-7-yl] acetate | 163190618 | Click to see CC(=O)OC1C2C(CCC3C24COC1(C56C4C(CC(C5)C(=C)C6O)OC(O3)(C)C)O)(C)C | 448.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
[(1S,2S,5R,10S,11R,15S,18R)-9,10,18-trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl] acetate | 6325508 | Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4O)C(=C)C5=O)O)(C)C | 406.50 | unknown |
https://doi.org/10.1248/CPB.58.56 https://doi.org/10.1080/10286020310001608985 |
[(1S,2S,5R,7R,8S,9S,10S,11R,15R)-7-acetyloxy-9,15-dihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl] acetate | 101297736 | Click to see CC(=O)OC1C2C(CCC(C23COC1(C45C3CCC(C4)C(=C)C5OC(=O)C)O)O)(C)C | 434.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
[(1S,2S,5S,7R,8S,10S,11R,15R)-7-acetyloxy-9,15-dihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl] acetate | 102004540 | Click to see CC(=O)OC1C2C(CCC(C23COC1(C45C3CCC(C4)C(=C)C5OC(=O)C)O)O)(C)C | 434.50 | unknown | https://doi.org/10.1080/10286020310001608985 |
[(1S,2S,5S,8R,9S,10S,11R,15S,18R)-18-acetyloxy-9,10-dihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl] acetate | 102152318 | Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4OC(=O)C)C(=C)C5=O)O)(C)C | 448.50 | unknown | https://doi.org/10.1055/S-0029-1186002 |
[(1S,2S,5S,8R,9S,10S,11R,15S,18R)-9,10,15-trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-18-yl] acetate | 163004732 | Click to see CC(=O)OC1C2CCC3C1(C(=O)C2=C)C4(C(C5C3(CO4)C(CCC5(C)C)O)O)O | 406.50 | unknown | https://doi.org/10.1055/S-0029-1186002 |
[(1S,3R,4S,6R,7S,9R,10S,11S,13S)-6-acetyloxy-3,7-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-11-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 163009148 | Click to see CC(=O)OC1CC2CC3(C1C4(CC(C(C(C4C(C3)O)(C)C)OC(=O)C)O)C)C(=O)C2=C | 434.50 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
[(1S,3S,4S,6S,9R,10S,11R,12R,13R)-3,6,12-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-11-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 162939482 | Click to see CC(=O)OC1C(C2CC3(C1C4(CCC(C(C4C(C3)O)(C)C)O)C)C(=O)C2=C)O | 392.50 | unknown | https://doi.org/10.1248/CPB.52.767 |
[(1S,4S,6R,7S,10S,11S,13S)-6-acetyloxy-3,7-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-11-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 5321601 | Click to see CC(=O)OC1CC2CC3(C1C4(CC(C(C(C4C(C3)O)(C)C)OC(=O)C)O)C)C(=O)C2=C | 434.50 | unknown |
https://doi.org/10.1002/CHIN.200448154 https://doi.org/10.1016/S0031-9422(01)00245-X https://doi.org/10.1016/S0031-9422(99)00578-6 |
[(2S,5S,8R,9R,10S,11R)-7,9,10,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl] formate | 5321012 | Click to see CC1(CCCC23C1C(C(C45C2C(CC(C4O)C(=C)C5O)OC=O)(OC3)O)O)C | 394.50 | unknown | via CMAUP database |
[(2S,5S,9S,10R,11R,15R,18R)-9,10,18-trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl] acetate | 101306857 | Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4O)C(=C)C5=O)O)(C)C | 406.50 | unknown | https://doi.org/10.1080/10286020310001608985 |
[(2S,5S,9S,10R,11R,15S,18R)-7,9,10,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl] acetate | 102090489 | Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4O)C(=C)C5O)O)(C)C | 408.50 | unknown | via CMAUP database |
[2,11-Dihydroxy-14-(methoxymethyl)-5,5,9-trimethyl-3,15-dioxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 72757956 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(=O)C2C1(C)C)O)C(=O)C4COC)O)C | 422.50 | unknown | https://doi.org/10.1248/CPB.52.767 |
[2,16-Dihydroxy-5-(hydroxymethyl)-5-methyl-14-methylidene-15-oxo-9-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate | 75220896 | Click to see CC(=O)OCC12CCCC(C1CC(C34C2CCC(C3O)C(=C)C4=O)O)(C)CO | 392.50 | unknown |
https://doi.org/10.1002/CHIN.200332121 https://doi.org/10.1021/NP100110U |
1,20,21-Trihydroxy-10,10-dimethyl-17-methylidene-5-[1-(9,10,15,18-tetrahydroxy-12,12-dimethyl-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-6-yl)propan-2-yl]-2,4,6-trioxahexacyclo[9.8.1.116,19.03,12.07,12.013,19]henicosan-18-one | 72998324 | Click to see CC(CC1C2CCC3C45COC(C3(C2O)C1=O)(C(C4C(CCC5O)(C)C)O)O)C6OC7CCC(C8C79C1CCC2C(C1(C(=O)C2=C)C(C8O)(OC9O6)O)O)(C)C | 784.90 | unknown | https://doi.org/10.1021/OL0531379 |
12,12-Dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-3,7,9,10,18-pentol | 163033255 | Click to see CC(C)CCOC1C23CCCC(C2C(C(O1)(C45C3C(CC(C4O)C(=C)C5O)O)O)O)(C)C | 452.60 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
12,12-Dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-3,7,9,10,15-pentol | 72988819 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(=C)C5O)O)(OC3)O)O)O)C | 366.40 | unknown |
https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1016/J.TET.2006.02.079 |
12,12-Dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-3,7,9,10,18-pentol | 13146007 | Click to see CC1(CCCC23C1C(C(C45C2C(CC(C4O)C(=C)C5O)O)(OC3)O)O)C | 366.40 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
12,12-Dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol | 73744636 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3)O)O)O)C | 366.40 | unknown |
https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1002/CHIN.200332121 https://doi.org/10.1016/J.TET.2006.02.079 https://doi.org/10.1021/NP100110U |
15,18-Dihydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 13945517 | Click to see CC1(CCC(C23C1CC(C45C2CCC(C4O)C(=C)C5=O)OC3OC)O)C | 362.50 | unknown | https://doi.org/10.1248/CPB.58.56 |
16-[(7-Hydroxy-6,9a-dimethyl-1-methylidene-3a,5,5a,7,8,9,9b,10,11,11a-decahydronaphtho[1,2-g][1]benzofuran-6-yl)methoxy]-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol | 72818713 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3OCC6(C(CCC7(C6CC=C8C7CCC9C8OCC9=C)C)O)C)O)O)O)C | 682.90 | unknown |
https://doi.org/10.1016/S0031-9422(99)00578-6 https://doi.org/10.1002/HLCA.200490072 |
16-Methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15,18-pentol | 73023947 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3OC)O)O)O)C | 396.50 | unknown |
https://doi.org/10.1002/HLCA.200390077 https://doi.org/10.1016/J.TET.2006.02.079 |
16-Methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,18-tetrol | 72991537 | Click to see CC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3OC)O)O)C | 380.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
1alpha,6beta,7beta,14beta,15beta-Pentahydroxy-7alpha,20-epoxy-ent-kaur-16-ene | 139078207 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3)O)O)O)C | 366.40 | unknown |
https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1016/J.TET.2006.02.079 |
2,11,16-Trihydroxy-9-(hydroxymethyl)-5,5-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-15-one | 13945509 | Click to see CC1(CCCC2(C1CC(C34C2C(CC(C3O)C(=C)C4=O)O)O)CO)C | 350.40 | unknown | https://doi.org/10.1002/CHIN.200332121 |
2,6,11-Trihydroxy-14-(methoxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-3,15-dione | 85432721 | Click to see CC1(C(CCC2(C1C(=O)C(C34C2C(CC(C3)C(C4=O)COC)O)O)C)O)C | 380.50 | unknown | https://doi.org/10.1248/CPB.52.767 |
2,6,11-Trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-3,15-dione | 72829904 | Click to see CC1(C(CCC2(C1C(=O)C(C34C2C(CC(C3)C(=C)C4=O)O)O)C)O)C | 348.40 | unknown | https://doi.org/10.1248/CPB.52.767 |
3,6,9,10,15-Pentahydroxy-6-(hydroxymethyl)-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 85414189 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(C5=O)(CO)O)O)(OC3)O)O)O)C | 398.40 | unknown | https://doi.org/10.1248/CPB.51.790 |
3,9,10,15-Tetrahydroxy-12,12-dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 162844653 | Click to see CC(C)CCOC1C23C(CCC(C2C(C(O1)(C45C3C(CC(C4)C(=C)C5=O)O)O)O)(C)C)O | 450.60 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
3,9,10,15-Tetrahydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 162991285 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(=C)C5=O)O)(OC3OC)O)O)O)C | 394.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
3,9,10,15-Tetrahydroxy-6-(methoxymethyl)-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 75038448 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(C5=O)COC)O)(OC3)O)O)O)C | 396.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
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 CC1(CCCC23C1C(C(C45C2C(CC(C4O)C(=C)C5=O)O)(OC3)O)O)C | 364.40 | unknown | https://doi.org/10.1055/S-0029-1186002 |
7,11,14-Trihydroxy-15-oxokaur-16-en-20-yl acetate | 500085 | Click to see CC(=O)OCC12CCCC(C1CC(C34C2C(CC(C3O)C(=C)C4=O)O)O)(C)C | 392.50 | unknown |
https://doi.org/10.1002/CHIN.200332121 https://doi.org/10.1021/NP100110U |
8,11,16-Trihydroxy-2-methoxy-13,13-dimethyl-7-methylidene-3-oxapentacyclo[7.7.1.16,9.01,12.04,17]octadecan-10-one | 85134497 | Click to see CC1(CCC(C23C1C(C(=O)C45C2C(CC(C4)C(=C)C5O)OC3OC)O)O)C | 378.50 | unknown | https://doi.org/10.1055/S-2004-827165 |
9,10,15,18-Tetrahydroxy-12,12-dimethyl-16-(3-methylbutoxy)-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 162964436 | Click to see CC(C)CCOC1C23C4CCC5C(C4(C(=O)C5=C)C(O1)(C(C2C(CCC3O)(C)C)O)O)O | 450.60 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
9,10,15,18-Tetrahydroxy-12,12-dimethyl-6-methylidene-16-(2-methylpropoxy)-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 162967715 | Click to see CC(C)COC1C23C4CCC5C(C4(C(=O)C5=C)C(O1)(C(C2C(CCC3O)(C)C)O)O)O | 436.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
9,15,16,17-Tetrahydroxy-12,12-dimethyl-6-methylidenepentacyclo[7.6.1.15,8.01,11.02,8]heptadecane-7,10-dione | 13241299 | Click to see CC1(CCC(C23C1C(=O)C(C2O)(C45C3CCC(C4O)C(=C)C5=O)O)O)C | 362.40 | unknown | https://doi.org/10.1016/0031-9422(92)80306-Y |
9,9,14,14-Tetramethyl-19-methylidene-5,13,15-trioxahexacyclo[16.2.1.01,6.02,16.03,8.03,12]henicosane-6,7,20-triol | 76837255 | Click to see CC1(CCC2C34C1C(C(C56C3C(CC(C5)C(=C)C6O)OC(O2)(C)C)(OC4)O)O)C | 406.50 | unknown |
https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1016/S0031-9422(99)00578-6 |
CID 101306849 | 101306849 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(=C)C5=O)O)(OC3)O)O)O)C | 364.40 | unknown |
https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1016/J.TET.2006.02.079 |
CID 171176 | 171176 | Click to see CC1(CCC(C23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)O)C | 362.40 | unknown | via CMAUP database |
CID 317640 | 317640 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown | via CMAUP database |
CID 3819 | 3819 | Click to see CC1(CCC(C2(C1CC(C34C2CCC(C3O)C(=C)C4=O)O)CO)O)C | 350.40 | unknown | https://doi.org/10.1248/CPB.58.56 |
CID 72999392 | 72999392 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3O)O)O)O)C | 380.40 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
CID 86280097 | 86280097 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown | via CMAUP database |
CID 92043456 | 92043456 | Click to see CC1(CCC(C23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)O)C | 362.40 | unknown | via CMAUP database |
Dawoensin A | 10412708 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)OC(=O)C)OC(=O)C)C(=O)C4=C)O)C | 476.60 | unknown |
https://doi.org/10.1248/CPB.52.767 https://doi.org/10.1002/CHIN.200447161 |
Effusanin E | 24721137 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(=C)C5=O)O)(OC3)O)O)O)C | 364.40 | unknown | https://doi.org/10.1055/S-0029-1186002 |
Enmenol | 46883404 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3)O)O)O)C | 366.40 | unknown | https://doi.org/10.1021/NP100110U |
Ent-Oridonin | 15923208 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown |
https://doi.org/10.1021/NP5006136 https://doi.org/10.1021/NP100110U |
flexicanlin A | 46906485 | Click to see CC(=O)OCC12CCCC(C1CC(C34C2C(CC(C3O)C(=C)C4=O)O)O)(C)C | 392.50 | unknown | https://doi.org/10.1021/NP100110U |
Isodonol | 34378 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown | via CMAUP database |
Isolushinin A | 46906410 | Click to see CC1(C2CCC34C1CC(C56C3CCC(C5)C(=C)C6O)OC4O2)C | 316.40 | unknown | https://doi.org/10.1021/NP100110U |
Isolushinin B | 46849176 | Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4)C(=C)C5O)(OC3)O)O)C | 392.50 | unknown | https://doi.org/10.1021/NP100110U |
Isolushinin D | 46906438 | Click to see CC(=O)OC1CC2C(C3(C1C45CCCC(C4CC3OC5OC)(C)C)C(=O)C2=C)O | 404.50 | unknown | https://doi.org/10.1021/NP100110U |
Isolushinin F | 46906439 | Click to see CC1(C(CCC23C1CC(C45C2C(CC(C4O)C(=C)C5=O)O)OC3OC)O)C | 378.50 | unknown | https://doi.org/10.1021/NP100110U |
Isolushinin G | 46849337 | Click to see CC(=O)OCC12CCCC(C1CC(C34C2C(C(C(C3O)C(=C)C4=O)O)O)O)(C)C | 408.50 | unknown | https://doi.org/10.1021/NP100110U |
Isolushinin H | 46849338 | Click to see CC(=O)OCC12CCCC(C1CC(C34C2CCC(C3O)C(=C)C4=O)O)(C)CO | 392.50 | unknown | https://doi.org/10.1021/NP100110U |
Kamebakaurinin | 13945510 | Click to see CC1(CCCC2(C1CC(C34C2C(CC(C3O)C(=C)C4=O)O)O)CO)C | 350.40 | unknown | https://doi.org/10.1021/NP100110U |
Kaur-16-en-15-one, 1-(acetyloxy)-7,20-epoxy-6,7,14-trihydroxy-, (1alpha,6beta,7alpha,14R)- | 12305580 | Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4O)C(=C)C5=O)O)(C)C | 406.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
Lasiodonin | 12305578 | Click to see CC1(CCC(C23C1C(C(C45C2C(CC(C4)C(=C)C5=O)O)(OC3)O)O)O)C | 364.40 | unknown |
https://doi.org/10.1016/J.TET.2006.02.079 https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1055/S-0029-1186002 |
Lasiodonin acetonide | 70697945 | Click to see CC1(CCC2C34C1C(C(C56C3C(CC(C5)C(=C)C6=O)OC(O2)(C)C)(OC4)O)O)C | 404.50 | unknown | https://doi.org/10.1080/10286020310001608985 |
Lasiokaurinol | 45272267 | Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4O)C(=C)C5O)O)(C)C | 408.50 | unknown | via CMAUP database |
Melissoidesin G | 10342874 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)OC(=O)C)O)C(=O)C4=C)O)C | 434.50 | unknown |
https://doi.org/10.1248/CPB.52.767 https://doi.org/10.1021/NP030418L https://doi.org/10.1016/J.TETLET.2004.02.051 |
N-[3-(1,20,21-trihydroxy-10,10-dimethyl-17-methylidene-18-oxo-2,4,6-trioxahexacyclo[9.8.1.116,19.03,12.07,12.013,19]henicosan-5-yl)propyl]acetamide | 73010317 | Click to see CC(=O)NCCCC1OC2CCC(C3C24C5CCC6C(C5(C(=O)C6=C)C(C3O)(OC4O1)O)O)(C)C | 491.60 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
N-[3-[(1R,3R,5S,7R,11S,12S,13R,16R,19S,20R,21S)-1,20,21-trihydroxy-10,10-dimethyl-17-methylidene-18-oxo-2,4,6-trioxahexacyclo[9.8.1.116,19.03,12.07,12.013,19]henicosan-5-yl]propyl]acetamide | 51006978 | Click to see CC(=O)NCCCC1OC2CCC(C3C24C5CCC6C(C5(C(=O)C6=C)C(C3O)(OC4O1)O)O)(C)C | 491.60 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
Oridonin | 5321010 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown |
https://doi.org/10.1016/J.TET.2006.02.079 https://doi.org/10.1248/CPB.48.148 https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1016/J.FITOTE.2011.03.003 https://doi.org/10.1055/S-0029-1186002 |
Oridonin (Isodonol) | 49867940 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown | via CMAUP database |
Oridonin, R. rubescens | 457846 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown | via CMAUP database |
phyllostachysin F | 16081680 | Click to see CC1(CCCC2(C1CC(C34C2C(CC(C3O)C(=C)C4=O)O)O)C)C | 334.40 | unknown | https://doi.org/10.1021/NP100110U |
PhyllostachysinH | 16081681 | Click to see CC1(CCC(C2(C1CCC34C2C(CC(C3O)C(=C)C4=O)O)C)O)C | 334.40 | unknown | https://doi.org/10.1021/NP100110U |
Ponicidin | 14564539 | Click to see CC1(CCC(C23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)O)C | 362.40 | unknown |
https://doi.org/10.1016/J.TET.2006.02.079 https://doi.org/10.1016/J.BBRC.2005.09.040 https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1016/J.FITOTE.2011.03.003 https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1080/07357900500524371 |
Rabdoternin C | 44445759 | Click to see CC(=O)OC1C2C(CCCC23COC1(C45C3CCC(C4O)C(=C)C5OC(=O)C)O)(C)C | 434.50 | unknown | via CMAUP database |
Rabdoternin F | 101663494 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3OC)O)O)O)C | 394.50 | unknown | https://doi.org/10.1002/HLCA.200390077 |
Rabdoternin F | 74317560 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3OC)O)O)O)C | 394.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
Rubescensin A | 3576890 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C | 364.40 | unknown |
https://doi.org/10.1111/J.1440-1746.2010.06500.X https://doi.org/10.1021/NP100110U https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1002/CHIN.200332121 https://doi.org/10.1016/J.FITOTE.2011.03.003 https://doi.org/10.1016/J.TET.2006.02.079 https://doi.org/10.1248/CPB.48.148 https://doi.org/10.1248/CPB.58.56 https://doi.org/10.1016/J.CANLET.2010.01.032 |
Taibairubescensin B | 102237436 | Click to see CC(=O)OC1CC2CC3(C1C4(CC(C(C(C4C(C3)O)(C)C)OC(=O)C)O)C)C(=O)C2=C | 434.50 | unknown |
https://doi.org/10.1016/S0031-9422(01)00245-X https://doi.org/10.1016/S0031-9422(99)00578-6 |
Tenuifolin J | 71577598 | Click to see CC(=O)OC1CCC2(C3C(C(C4CC3(CC(=O)C2C1(C)C)C(=O)C4=C)O)O)C | 390.50 | unknown | https://doi.org/10.1248/CPB.52.767 |
Trichokaurin | 12444495 | Click to see CC(=O)OC1C2C(CCC(C23COC1(C45C3CCC(C4)C(=C)C5OC(=O)C)O)O)(C)C | 434.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.079 |
Xindongnin B | 44584350 | Click to see CC(=O)OC1C2C(C(CCC2(C3C(CC4CC3(C1O)C(=O)C4=C)O)C)O)(C)C | 392.50 | unknown |
https://doi.org/10.1248/CPB.52.767 https://doi.org/10.1002/CHIN.200447161 |
Xindongnin C | 132494155 | Click to see CC(=O)OC1C2C(C(CCC2(C3C(CC4CC3(C1OC(=O)C)C(=O)C4=C)O)C)O)(C)C | 434.50 | unknown | https://doi.org/10.1002/CHIN.200447161 |
Xindongnin K | 11199864 | Click to see CC1(C(CCC2(C1C(=O)C(C34C2C(CC(C3)C(C4=O)COC)O)O)C)O)C | 380.50 | unknown | https://doi.org/10.1248/CPB.52.767 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Tigliane and ingenane diterpenoids | |||||
[(1S,4S,5R,6R,9S,14R)-4,5,6-trihydroxy-3,11,11,14-tetramethyl-15-oxo-7-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl]methyl hexadecanoate | 5318035 | Click to see CCCCCCCCCCCCCCCC(=O)OCC1=CC2C3C(C3(C)C)CC(C4(C2=O)C=C(C(C4(C1O)O)O)C)C | 586.80 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids | |||||
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 | |||||
beta-Pinene | 14896 | Click to see CC1(C2CCC(=C)C1C2)C | 136.23 | unknown | via CMAUP database |
> 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/10.1016/S0031-9422(99)00578-6 https://doi.org/10.1248/CPB.48.148 https://doi.org/10.1021/NP0304114 https://doi.org/10.1002/CHIN.200349162 https://doi.org/10.1080/10286020310001608985 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids | |||||
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 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Guaianes | |||||
(2S)-2-(3,8-dimethylazulen-5-yl)propanoic acid | 3083593 | Click to see CC1=C2C=CC(=C2C=C(C=C1)C(C)C(=O)O)C | 228.29 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Trichothecenes | |||||
(1R,3R,8R,12E,17R,18E,20E,24R,25S,26S)-17-[(1R)-1-hydroxyethyl]-5-(hydroxymethyl)-13,25-dimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,12,18,20-tetraene-26,2'-oxirane]-11,22-dione | 162999962 | Click to see CC1=CC(=O)OCC23CCC(=CC2OC4CC(C3(C45CO5)C)OC(=O)C=CC=CC(OCC1)C(C)O)CO | 530.60 | unknown |
https://doi.org/10.1002/CHIN.200349162 https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1016/S0031-9422(99)00578-6 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Diterpene glycosides | |||||
(1S,2S,5S,7R,8R,9S,10S,11R,15S,18R)-12,12-dimethyl-6-methylidene-15-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,18-tetrol | 163078499 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3)O)O)OC6C(C(C(C(O6)CO)O)O)O)C | 528.60 | unknown | https://doi.org/10.1055/S-0029-1186002 |
(1S,2S,5S,7S,8R,9S,10S,11R,15S,18R)-12,12-dimethyl-6-methylidene-15-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,18-tetrol | 163078500 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3)O)O)OC6C(C(C(C(O6)CO)O)O)O)C | 528.60 | unknown | https://doi.org/10.1248/CPB.48.148 |
12,12-Dimethyl-6-methylidene-15-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,18-tetrol | 73107188 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3)O)O)OC6C(C(C(C(O6)CO)O)O)O)C | 528.60 | unknown |
https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1248/CPB.48.148 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones | |||||
(3R,3aS,7R,10E,11aS)-7-hydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one | 13821246 | Click to see CC1C2CCC(=C)C(CCC(=CC2OC1=O)C)O | 250.33 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones | |||||
(-)-Rabdoternin A | 3086622 | Click to see CC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3=O)O)O)C | 364.40 | unknown |
https://doi.org/10.1016/J.TET.2006.02.079 https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1002/CHIN.200349162 https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1002/HLCA.200390077 |
(1R,2R,3R,7R,9S,10S,11S,12R,16S,17S)-10,11,16-trihydroxy-17-methoxy-13,13-dimethyl-6-methylidene-4,18-dioxapentacyclo[8.6.2.13,7.01,12.02,9]nonadecan-5-one | 162998755 | Click to see CC1(CCC(C23C1C(C(C4C2C5CC(C4)C(=C)C(=O)O5)(OC3OC)O)O)O)C | 394.50 | unknown | https://doi.org/10.1002/HLCA.200490102 |
(1R,2R,3S,5R,8R,11R,14S,17R,20S)-3-hydroxy-14-methyl-6-methylidene-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosane-7,9-dione | 133562823 | Click to see CC12CCC3C4(C1C(OC2)OC4)C5C(CC6CC5(C(=O)C6=C)C(=O)O3)O | 360.40 | unknown | https://doi.org/10.1002/CHIN.200332121 |
(1R,2R,5R,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 | 70698004 | Click to see CC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3=O)O)O)C | 362.40 | unknown | https://doi.org/10.1002/HLCA.200390077 |
(1R,2R,5S,6S,7R,10R,11S,15R,18R)-5-acetyl-6,15,18-trihydroxy-12,12-dimethyl-9,17-dioxapentacyclo[8.5.3.01,11.02,7.07,18]octadecan-8-one | 162961532 | Click to see CC(=O)C1CCC2C34COC5(C2(C1O)C(=O)OC5C3C(CCC4O)(C)C)O | 380.40 | unknown | https://doi.org/10.1002/HLCA.200490102 |
(1R,2R,5S,7R,8R,9S,10S,11R,18S)-7,9,10,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-16-one | 163015914 | Click to see CC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3=O)O)O)C | 364.40 | unknown | https://doi.org/10.1016/J.FITOTE.2011.03.003 |
(1R,4R,6R,7R,11S,12R,13S,16S,18R)-11,18-dihydroxy-6-methoxy-8,8-dimethyl-17-methylidene-3,5-dioxapentacyclo[14.2.1.01,13.04,12.07,12]nonadecan-2-one | 162978160 | Click to see CC1(CCC(C23C1C(OC2OC(=O)C45C3CCC(C4)C(=C)C5O)OC)O)C | 378.50 | unknown | https://doi.org/10.1016/J.FITOTE.2011.03.003 |
(1R,4R,9S,12S,13S)-12,13-dihydroxy-8,8-dimethyl-14-propan-2-yl-2-oxatetracyclo[10.4.0.01,4.04,9]hexadec-14-en-3-one | 52921236 | Click to see CC(C)C1=CCC23C4(CCCC(C4CCC2(C1O)O)(C)C)C(=O)O3 | 334.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3057937/ |
(1S,1'S,4'R,5S,6S,7'R,8'R,9R)-4'-methyl-10-methylidenespiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,9'-6,10-dioxatricyclo[5.2.1.04,8]decane]-2,11-dione | 11046182 | Click to see CC12CCC3C4(C1C(O3)OC2)COC(=O)C56C4CCC(C5)C(=C)C6=O | 344.40 | unknown | https://doi.org/10.1021/NP030165W |
(1S,2S,3R,5S,6R,8S,11S,14R,17S,20R)-3-hydroxy-6,14-dimethyl-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosan-9-one | 101235553 | Click to see CC1CC23CC1CC(C2C45COC6C4C(CCC5OC3=O)(CO6)C)O | 348.40 | unknown | https://doi.org/10.1002/CHIN.200332121 |
(1S,2S,3R,5S,6R,8S,11S,14R,17S,20R)-3-hydroxy-6,14-dimethyl-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosane-7,9-dione | 15922652 | Click to see CC1C2CC(C3C(C2)(C1=O)C(=O)OC4C35COC6C5C(CC4)(CO6)C)O | 362.40 | unknown | https://doi.org/10.3987/COM-02-9688 |
(1S,2S,3R,5S,7R,8S,11S,14R,17S,20R)-3,7-dihydroxy-14-methyl-6-methylidene-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosan-9-one | 20056294 | Click to see CC12CCC3C4(C1C(OC2)OC4)C5C(CC6CC5(C(C6=C)O)C(=O)O3)O | 362.40 | unknown |
https://doi.org/10.1002/CHIN.200332121 https://doi.org/10.1021/NP100110U |
(1S,2S,5R,6R,8S,11S,14R,17S,20R)-6,14-dimethyl-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosan-9-one | 101235551 | Click to see CC1CC23CC1CCC2C45COC6C4C(CCC5OC3=O)(CO6)C | 332.40 | unknown | https://doi.org/10.1002/CHIN.200332121 |
(1S,2S,5R,6R,8S,11S,14R,17S,20R)-6,14-dimethyl-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosane-7,9-dione | 15922650 | Click to see CC1C2CCC3C(C2)(C1=O)C(=O)OC4C35COC6C5C(CC4)(CO6)C | 346.40 | unknown | https://doi.org/10.3987/COM-02-9688 |
(1S,2S,5R,6S,8S,11S,14R,17S,20R)-6,14-dimethyl-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosan-9-one | 101235552 | Click to see CC1CC23CC1CCC2C45COC6C4C(CCC5OC3=O)(CO6)C | 332.40 | unknown | https://doi.org/10.1002/CHIN.200332121 |
(1S,2S,5R,6S,8S,11S,14R,17S,20R)-6,14-dimethyl-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosane-7,9-dione | 15922651 | Click to see CC1C2CCC3C(C2)(C1=O)C(=O)OC4C35COC6C5C(CC4)(CO6)C | 346.40 | unknown | https://doi.org/10.3987/COM-02-9688 |
(1S,3'aR,5R,6S,7R,7'aR,9S,10S)-7-hydroxy-3'a,10-dimethylspiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,7'-4,5,6,7a-tetrahydro-3H-2-benzofuran]-1',2,11-trione | 163036015 | Click to see CC1C2CC(C3C4(CCCC5(C4C(=O)OC5)C)COC(=O)C3(C2)C1=O)O | 362.40 | unknown | https://doi.org/10.1021/NP030165W |
(1S,4S,8R,9R,12S,13R,14R,16S)-9,14-dihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione | 162896913 | Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5=C)C(=O)O2)O)C | 362.40 | unknown | https://doi.org/10.1248/CPB.51.790 |
(1S,4S,8R,9R,12S,13R,14S,16S)-9,14-dihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione | 102004749 | Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5=C)C(=O)O2)O)C | 362.40 | unknown | https://doi.org/10.1002/CHIN.200349162 |
(1S,5R,7R,8S,11S,14R,20R)-7-hydroxy-14-methyl-6-methylidene-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosan-9-one | 11972463 | Click to see CC12CCC3C4(C1C(OC2)OC4)C5CCC6CC5(C(C6=C)O)C(=O)O3 | 346.40 | unknown | https://doi.org/10.1002/CHIN.200332121 |
(2'-Formyl-4',7-dihydroxy-1',1'-dimethyl-10-methylidene-2-oxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-11-yl) acetate | 85350824 | Click to see CC(=O)OC1C(=C)C2CC(C3C1(C2)C(=O)OCC34C(CCC(C4C=O)(C)C)O)O | 406.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
(2R,5S,9S,10R,11R,15S,18R)-7,9,10,15,18-pentahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-16-one | 101835385 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3=O)O)O)O)C | 380.40 | unknown |
https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1002/CHIN.200349162 https://doi.org/10.1002/HLCA.200390077 |
(3',7,11-Triacetyloxy-6',6'-dimethyl-10-methylidene-2-oxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl)methyl acetate | 13919278 | Click to see CC(=O)OCC1C(CCC(C12COC(=O)C34C2C(CC(C3)C(=C)C4OC(=O)C)OC(=O)C)OC(=O)C)(C)C | 534.60 | unknown | https://doi.org/10.1248/CPB.51.790 |
(8-Formyl-11-hydroxy-7,7-dimethyl-14-methylidene-2,15-dioxo-3-oxatetracyclo[11.2.1.01,10.04,9]hexadecan-9-yl)methyl acetate | 5088566 | Click to see CC(=O)OCC12C(CCC(C1C=O)(C)C)OC(=O)C34C2C(CC(C3)C(=C)C4=O)O | 404.50 | unknown | https://doi.org/10.1002/CHIN.200349162 |
[(1R,4R,8R,9R,10R,11S,13R)-11-hydroxy-8-(hydroxymethyl)-7,7-dimethyl-14-methylidene-2,15-dioxo-3-oxatetracyclo[11.2.1.01,10.04,9]hexadecan-9-yl]methyl acetate | 163050702 | Click to see CC(=O)OCC12C(CCC(C1CO)(C)C)OC(=O)C34C2C(CC(C3)C(=C)C4=O)O | 406.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
[(1S,1'R,3'S,5R,6S,7R,9S,11R)-3',7,11-triacetyloxy-6',6'-dimethyl-10-methylidene-2-oxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl]methyl acetate | 162996778 | Click to see CC(=O)OCC1C(CCC(C12COC(=O)C34C2C(CC(C3)C(=C)C4OC(=O)C)OC(=O)C)OC(=O)C)(C)C | 534.60 | unknown | https://doi.org/10.1248/CPB.51.790 |
[(1S,1'R,3'S,5S,6S,7R,9S,11R)-3',7,11-triacetyloxy-6',6'-dimethyl-10-methylidene-2-oxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl]methyl acetate | 101249035 | Click to see CC(=O)OCC1C(CCC(C12COC(=O)C34C2C(CC(C3)C(=C)C4OC(=O)C)OC(=O)C)OC(=O)C)(C)C | 534.60 | unknown | https://doi.org/10.1002/CHIN.200349162 |
[(1S,1'S,3'R,5R,6S,7S,9S)-7-hydroxy-3'-(hydroxymethyl)-4',4'-dimethyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl] acetate | 13919289 | Click to see CC(=O)OC1CCC(C(C12COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)CO)(C)C | 406.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
[(1S,1'S,3'R,5R,6S,9R)-3'-(hydroxymethyl)-4',4'-dimethyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl] acetate | 163026510 | Click to see CC(=O)OC1CCC(C(C12COC(=O)C34C2CCC(C3)C(=C)C4=O)CO)(C)C | 390.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
[(1S,2'R,4'S,5R,6S,7S,9S,11R)-2'-formyl-4',7-dihydroxy-1',1'-dimethyl-10-methylidene-2-oxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-11-yl] acetate | 162902174 | Click to see CC(=O)OC1C(=C)C2CC(C3C1(C2)C(=O)OCC34C(CCC(C4C=O)(C)C)O)O | 406.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
[(1S,2'R,4'S,5S,6S,7S,9S,11R)-2'-formyl-4',7-dihydroxy-1',1'-dimethyl-10-methylidene-2-oxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-11-yl] acetate | 10971528 | Click to see CC(=O)OC1C(=C)C2CC(C3C1(C2)C(=O)OCC34C(CCC(C4C=O)(C)C)O)O | 406.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
[(1S,2R,4S,6S,8S,9R,13S,16S,17R)-17-formyl-8-hydroxy-10,10-dimethyl-3-methylidene-15-oxo-7,14-dioxapentacyclo[7.6.2.11,4.06,16.013,17]octadecan-2-yl] acetate | 56834737 | Click to see CC(=O)OC1C(=C)C2CC3C4C1(C2)C(=O)OC5C4(C(C(O3)O)C(CC5)(C)C)C=O | 404.50 | unknown | https://doi.org/10.1016/J.FITOTE.2011.03.003 |
[(1S,4S,8R,9S,10S,11S,13S)-8-Formyl-11-hydroxy-7,7-dimethyl-14-methylidene-2,15-dioxo-3-oxatetracyclo[11.2.1.01,10.04,9]hexadecan-9-yl]methyl acetate | 442047 | Click to see CC(=O)OCC12C(CCC(C1C=O)(C)C)OC(=O)C34C2C(CC(C3)C(=C)C4=O)O | 404.50 | unknown |
https://doi.org/10.1002/CHIN.200349162 https://doi.org/10.1248/CPB.51.790 |
[3'-(Hydroxymethyl)-4',4'-dimethyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl] acetate | 74822294 | Click to see CC(=O)OC1CCC(C(C12COC(=O)C34C2CCC(C3)C(=C)C4=O)CO)(C)C | 390.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
10,11,16-Trihydroxy-17-methoxy-13,13-dimethyl-6-methylidene-4,18-dioxapentacyclo[8.6.2.13,7.01,12.02,9]nonadecan-5-one | 72966947 | Click to see CC1(CCC(C23C1C(C(C4C2C5CC(C4)C(=C)C(=O)O5)(OC3OC)O)O)O)C | 394.50 | unknown | https://doi.org/10.1002/HLCA.200490102 |
15|A-Hydroxy-20-oxo-6,7-seco-ent-kaur-16-en-1,7|A(6,11|A)-diolide | 163004991 | Click to see CC1(CCC2C3(C1C(=O)OC4C3C5(CC(C4)C(=C)C5O)C(=O)O2)C=O)C | 360.40 | unknown | https://doi.org/10.1016/J.FITOTE.2011.03.003 |
3-Hydroxy-6,14-dimethyl-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosane-7,9-dione | 162959554 | Click to see CC1C2CC(C3C(C2)(C1=O)C(=O)OC4C35COC6C5C(CC4)(CO6)C)O | 362.40 | unknown | https://doi.org/10.3987/COM-02-9688 |
3-Methoxy-7a-methyl-10'-methylidenespiro[1,3,3a,5,6,7-hexahydro-2-benzofuran-4,5'-3-oxatricyclo[7.2.1.01,6]dodecane]-2',11'-dione | 162876974 | Click to see CC12CCCC3(C1C(OC2)OC)COC(=O)C45C3CCC(C4)C(=C)C5=O | 360.40 | unknown | https://doi.org/10.1021/NP030165W |
3-Methoxy-7a,10'-dimethylspiro[1,3,3a,5,6,7-hexahydro-2-benzofuran-4,5'-3-oxatricyclo[7.2.1.01,6]dodecane]-2',11'-dione | 5247758 | Click to see CC1C2CCC3C4(CCCC5(C4C(OC5)OC)C)COC(=O)C3(C2)C1=O | 362.50 | unknown | https://doi.org/10.1021/NP030165W |
3'a,10-dimethylspiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,7'-4,5,6,7a-tetrahydro-3H-2-benzofuran]-1',2,11-trione | 5231449 | Click to see CC1C2CCC3C4(CCCC5(C4C(=O)OC5)C)COC(=O)C3(C2)C1=O | 346.40 | unknown | https://doi.org/10.1021/NP030165W |
5-Acetyl-6,15,18-trihydroxy-12,12-dimethyl-9,17-dioxapentacyclo[8.5.3.01,11.02,7.07,18]octadecan-8-one | 72816600 | Click to see CC(=O)C1CCC2C34COC5(C2(C1O)C(=O)OC5C3C(CCC4O)(C)C)O | 380.40 | unknown | https://doi.org/10.1002/HLCA.200490102 |
6-Epiangustifolin | 636522 | Click to see CC12CCCC3(C1C(OC2)OC)COC(=O)C45C3C(CC(C4)C(=C)C5=O)O | 376.40 | unknown | https://doi.org/10.1021/NP030165W |
6-Formyl-5'-hydroxy-5,5-dimethyl-8'-methylidene-1',9'-dioxohexahydro-1'H,3'H-spiro[cyclohexane-1,4'-[2]oxa[7,9a]methanocyclohepta[c]pyran]-2-yl acetate | 177797 | Click to see CC(=O)OC1CCC(C(C12COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)C=O)(C)C | 404.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
6,14-Dimethyl-10,16,18-trioxahexacyclo[12.5.1.15,8.01,11.02,8.017,20]henicosane-7,9-dione | 163017153 | Click to see CC1C2CCC3C(C2)(C1=O)C(=O)OC4C35COC6C5C(CC4)(CO6)C | 346.40 | unknown | https://doi.org/10.3987/COM-02-9688 |
7-Hydroxy-2a-methyl-8-methylidenedodecahydro-2H,6H,12H-6a,9-methano-1,5,13-trioxacyclohepta[a]pentaleno[1,6-hi]naphthalen-6-one | 174438 | Click to see CC12CCC3C4(C1C(OC2)OC4)C5CCC6CC5(C(C6=C)O)C(=O)O3 | 346.40 | unknown |
https://doi.org/10.1002/CHIN.200332121 https://doi.org/10.3987/COM-02-9688 |
7-hydroxy-3'a-methyl-10-methylidenespiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,7'-4,5,6,7a-tetrahydro-3H-2-benzofuran]-1',2,11-trione | 85080419 | Click to see CC12CCCC3(C1C(=O)OC2)COC(=O)C45C3C(CC(C4)C(=C)C5=O)O | 360.40 | unknown |
https://doi.org/10.1021/NP030165W https://doi.org/10.1002/CHIN.200332121 https://doi.org/10.1021/NP100110U |
7-hydroxy-3'a,10-dimethylspiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,7'-4,5,6,7a-tetrahydro-3H-2-benzofuran]-1',2,11-trione | 85433539 | Click to see CC1C2CC(C3C4(CCCC5(C4C(=O)OC5)C)COC(=O)C3(C2)C1=O)O | 362.40 | unknown | https://doi.org/10.1021/NP030165W |
7,11-dihydroxy-3'a-methyl-10-methylidenespiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,7'-4,5,6,7a-tetrahydro-3H-2-benzofuran]-1',2-dione | 14158942 | Click to see CC12CCCC3(C1C(=O)OC2)COC(=O)C45C3C(CC(C4)C(=C)C5O)O | 362.40 | unknown | https://doi.org/10.1021/NP030165W |
7,9,10,18-Tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-16-one | 14564527 | 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-0029-1186002 https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1016/J.TET.2006.02.079 |
9,14-Dihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione | 430943 | Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5=C)C(=O)O2)O)C | 362.40 | unknown |
https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1248/CPB.58.56 |
Angustifolin | 21575185 | Click to see CC12CCCC3(C1C(OC2)OC)COC(=O)C45C3C(CC(C4)C(=C)C5=O)O | 376.40 | unknown | https://doi.org/10.1021/NP030165W |
Augustifolin | 73802105 | Click to see CC12CCCC3(C1C(OC2)OC)COC(=O)C45C3C(CC(C4)C(=C)C5=O)O | 376.40 | unknown | https://doi.org/10.1021/NP030165W |
CID 14109026 | 14109026 | Click to see CC(=O)OCC1C(CCC(C12COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)OC(=O)C)(C)C | 448.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
Epinodosin | 9975896 | Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5=C)C(=O)O2)O)C | 362.40 | unknown | https://doi.org/10.1248/CPB.51.790 |
Guidongnin A | 12067312 | Click to see CC12CCCC3(C1C(=O)OC2)COC(=O)C45C3C(CC(C4)C(=C)C5O)O | 362.40 | unknown | https://doi.org/10.1021/NP030165W |
guidongnin B | 12067305 | Click to see CC1C2CCC3C4(CCCC5(C4C(=O)OC5)C)COC(=O)C3(C2)C1=O | 346.40 | unknown | https://doi.org/10.1021/NP030165W |
guidongnin C | 12067306 | Click to see CC1C2CC(C3C4(CCCC5(C4C(=O)OC5)C)COC(=O)C3(C2)C1=O)O | 362.40 | unknown | https://doi.org/10.1021/NP030165W |
Isodonal | 14395549 | Click to see CC(=O)OC1CCC(C(C12COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)C=O)(C)C | 404.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
ludongnin A | 9975782 | Click to see CC12CCCC3(C1C(=O)OC2)COC(=O)C45C3C(CC(C4)C(=C)C5=O)O | 360.40 | unknown |
https://doi.org/10.1002/CHIN.200332121 https://doi.org/10.1021/NP030165W https://doi.org/10.1021/NP100110U |
Ludongnin B | 15922657 | Click to see CC1C2CCC3C4(CCCC5(C4C(=O)OC5)C)COC(=O)C3(C2)C1=O | 346.40 | unknown | https://doi.org/10.1002/CHIN.200332121 |
ludongnin F | 11268457 | Click to see CC1C2CCC3C4(CCCC5(C4C(OC5)OC)C)COC(=O)C3(C2)C1=O | 362.50 | unknown | https://doi.org/10.1021/NP030165W |
ludongnin G | 11417148 | Click to see CC1C2CCC3C4(CCCC5(C4C(OC5)OC)C)COC(=O)C3(C2)C1=O | 362.50 | unknown |
https://doi.org/10.1021/NP030165W https://doi.org/10.1021/NP100110U |
ludongnin H | 11268458 | Click to see CC1C2CCC3C4(CCCC5(C4C(OC5)OC)C)COC(=O)C3(C2)C1=O | 362.50 | unknown | https://doi.org/10.1021/NP030165W |
Ludongnin I | 11245399 | Click to see CC1C2CCC3C4(CCCC5(C4C(OC5)OC)C)COC(=O)C3(C2)C1=O | 362.50 | unknown | https://doi.org/10.1021/NP030165W |
ludongnin J | 10089928 | Click to see CC12CCCC3(C1C(OC2)OC)COC(=O)C45C3CCC(C4)C(=C)C5=O | 360.40 | unknown | https://doi.org/10.1021/NP030165W |
Lushanrubescensin H | 10340349 | Click to see CC(=O)OC1CCC(C(C12COC(=O)C34C2CCC(C3)C(=C)C4=O)CO)(C)C | 390.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
Macrocalyxoformin A | 10247031 | Click to see CC12CCC3C4(C1C(OC2)OC4)C5CCC6CC5(C(C6=C)O)C(=O)O3 | 346.40 | unknown |
https://doi.org/10.1002/CHIN.200332121 https://doi.org/10.3987/COM-02-9688 |
macrocalyxoformin B | 15922654 | Click to see CC12CCC3C4(C1C(OC2)OC4)C5CCC6CC5(C(=O)C6=C)C(=O)O3 | 344.40 | unknown | https://doi.org/10.1002/CHIN.200332121 |
Maoyecrystal E | 13919287 | Click to see CC(=O)OC1CCC(C(C12COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)CO)(C)C | 406.50 | unknown | https://doi.org/10.1248/CPB.51.790 |
Rabdosin B | 14109027 | Click to see CC(=O)OCC1C(CCC(C12COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)OC(=O)C)(C)C | 448.50 | unknown |
https://doi.org/10.1002/CHIN.200349162 https://doi.org/10.1248/CPB.51.790 |
Rabdosin C | 158213 | Click to see CC(=O)OCC12C(CCC(C1CO)(C)C)OC(=O)C34C2C(CC(C3)C(=C)C4=O)O | 406.50 | unknown |
https://doi.org/10.1002/CHIN.200349162 https://doi.org/10.1248/CPB.58.56 |
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/10.1002/CHIN.200349162 https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1002/HLCA.200390077 |
Rabdoternin B | 3086623 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5O)(OC3=O)O)O)O)C | 380.40 | unknown |
https://doi.org/10.1016/J.TET.2006.02.079 https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1002/CHIN.200349162 https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1080/10286020310001608985 https://doi.org/10.1002/HLCA.200390077 |
sculponeatin J | 44566904 | Click to see CC12CCC3C4(C1C(O3)OC2)COC(=O)C56C4CCC(C5)C(=C)C6=O | 344.40 | unknown | https://doi.org/10.1021/NP030165W |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Eudesmanolides, secoeudesmanolides, and derivatives | |||||
(3R)-3abeta,4,5,5a,6,7,8,9,9abeta,9balpha-Decahydro-3alpha,5aalpha,9-trimethyl-6alpha,9beta-dihydroxynaphtho[1,2-b]furan-2(3H)-one | 14110909 | Click to see CC1C2CCC3(C(CCC(C3C2OC1=O)(C)O)O)C | 268.35 | unknown | via CMAUP database |
Dihydrosantamarin | 13895713 | Click to see CC1C2CCC3(C(CC=C(C3C2OC1=O)C)O)C | 250.33 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Germacranolides and derivatives | |||||
Costunolide derivative | 54607887 | Click to see CC1C2CCC(=CCC(C(=CC2OC1=O)C)O)C | 250.33 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
(10R)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | 45358157 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O | 456.70 | unknown | via CMAUP database |
(1S,1'S,2S,2'S,5S,5'R,8'R,9S,9'S,10'S,11'R,12R,13S,14S,15R,15'S,18'R,19S,22R)-9',10',13,14,15',18',19,22-octahydroxy-12',12',16,16-tetramethylspiro[10,21-dioxahexacyclo[11.6.2.15,12.01,15.02,12.06,11]docos-6(11)-ene-9,6'-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane]-7'-one | 102175443 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C6=C5OC7(CC6)C8CCC9C12COC(C9(C8O)C7=O)(C(C1C(CCC2O)(C)C)O)O)(OC3)O)O)O)C | 728.90 | unknown | https://doi.org/10.1021/OL0531379 |
(1S,2R,4aR,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | 45483617 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O | 456.70 | unknown | via CMAUP database |
(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 |
(E,6R)-2-methyl-4-oxo-6-[(5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]hept-2-enoic acid | 14830091 | Click to see CC(CC(=O)C=C(C)C(=O)O)C1CCC2(C1(CCC3=C2CCC4C3(CCC(=O)C4(C)C)C)C)C | 468.70 | unknown |
https://doi.org/10.1002/CHIN.200448154 https://doi.org/10.1016/S0031-9422(01)00245-X https://doi.org/10.1016/S0031-9422(99)00578-6 |
[(1R,2R,3R,4S,6S,9S,10S,11S,13S,14R)-14-[2-[(1R,2R,3R,4S,6S,9S,10S,11S,13R,14S)-3-acetyloxy-2,6-dihydroxy-5,5,9-trimethyl-16-oxo-12-oxapentacyclo[11.2.1.111,14.01,10.04,9]heptadecan-13-yl]ethyl]-2,6,11-trihydroxy-5,5,9-trimethyl-15-oxo-3-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 102349516 | Click to see CC(=O)OC1C2C(C(CCC2(C3C(CC4CC3(C1O)C(=O)C4CCC56C7CC(O5)C8C9(CCC(C(C9C(C(C8(C7)C6=O)O)OC(=O)C)(C)C)O)C)O)C)O)(C)C | 785.00 | unknown | https://doi.org/10.1002/HLCA.200590059 |
[(1R,2R,3R,4S,6S,9S,10S,11S,13S,14R)-3-acetyloxy-14-[2-[(1R,2R,3R,4S,6S,9S,10S,11S,13S,14S)-3,6-diacetyloxy-2,11,14-trihydroxy-5,5,9-trimethyl-15-oxo-14-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]ethyl]-2,11-dihydroxy-5,5,9-trimethyl-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 101344182 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)OC(=O)C)O)C(=O)C4CCC5(C6CC(C7C8(CCC(C(C8C(C(C7(C6)C5=O)O)OC(=O)C)(C)C)OC(=O)C)C)O)O)O)C | 887.10 | unknown | https://doi.org/10.1016/J.TETLET.2004.02.051 |
[(1R,2R,3R,4S,6S,9S,10S,11S,13S,14R)-3-acetyloxy-14-[2-[(1R,2R,4S,6S,9S,10S,11S,13S,14S)-2,6-diacetyloxy-11,14-dihydroxy-5,5,9-trimethyl-3,15-dioxo-14-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]ethyl]-2,11-dihydroxy-5,5,9-trimethyl-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 101344184 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)OC(=O)C)O)C(=O)C4CCC5(C6CC(C7C8(CCC(C(C8C(=O)C(C7(C6)C5=O)OC(=O)C)(C)C)OC(=O)C)C)O)O)O)C | 885.00 | unknown | https://doi.org/10.1016/J.TETLET.2004.02.051 |
[(1R,2R,3R,4S,6S,9S,10S,11S,13S,14S)-3-acetyloxy-14-[2-[(1R,2R,4S,6S,9S,10S,11S,13S,14R)-2,6-diacetyloxy-11-hydroxy-5,5,9-trimethyl-3,15-dioxo-14-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]ethyl]-2,11,14-trihydroxy-5,5,9-trimethyl-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 101344183 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)OC(=O)C)O)C(=O)C4(CCC5C6CC(C7C8(CCC(C(C8C(=O)C(C7(C6)C5=O)OC(=O)C)(C)C)OC(=O)C)C)O)O)O)C | 885.00 | unknown | https://doi.org/10.1016/J.TETLET.2004.02.051 |
[14-[2-(3-Acetyloxy-2,6-dihydroxy-5,5,9-trimethyl-16-oxo-12-oxapentacyclo[11.2.1.111,14.01,10.04,9]heptadecan-13-yl)ethyl]-2,6,11-trihydroxy-5,5,9-trimethyl-15-oxo-3-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 163062316 | Click to see CC(=O)OC1C2C(C(CCC2(C3C(CC4CC3(C1O)C(=O)C4CCC56C7CC(O5)C8C9(CCC(C(C9C(C(C8(C7)C6=O)O)OC(=O)C)(C)C)O)C)O)C)O)(C)C | 785.00 | unknown | https://doi.org/10.1002/HLCA.200590059 |
[3-Acetyloxy-14-[2-(2,6-diacetyloxy-11-hydroxy-5,5,9-trimethyl-3,15-dioxo-14-tetracyclo[11.2.1.01,10.04,9]hexadecanyl)ethyl]-2,11,14-trihydroxy-5,5,9-trimethyl-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 162974246 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)OC(=O)C)O)C(=O)C4(CCC5C6CC(C7C8(CCC(C(C8C(=O)C(C7(C6)C5=O)OC(=O)C)(C)C)OC(=O)C)C)O)O)O)C | 885.00 | unknown | https://doi.org/10.1016/J.TETLET.2004.02.051 |
[3-Acetyloxy-14-[2-(2,6-diacetyloxy-11,14-dihydroxy-5,5,9-trimethyl-3,15-dioxo-14-tetracyclo[11.2.1.01,10.04,9]hexadecanyl)ethyl]-2,11-dihydroxy-5,5,9-trimethyl-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate | 162972545 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)OC(=O)C)O)C(=O)C4CCC5(C6CC(C7C8(CCC(C(C8C(=O)C(C7(C6)C5=O)OC(=O)C)(C)C)OC(=O)C)C)O)O)O)C | 885.00 | unknown | https://doi.org/10.1016/J.TETLET.2004.02.051 |
2-[(2R,3R,3aR,6S,9bR)-6-(2-carboxyethyl)-2-hydroxy-3a,6,9b-trimethyl-7-prop-1-en-2-yl-1,2,3,4,7,8-hexahydrocyclopenta[a]naphthalen-3-yl]-6-methyl-5-methylideneheptanoic acid | 10028880 | Click to see CC(C)C(=C)CCC(C1C(CC2(C1(CC=C3C2=CCC(C3(C)CCC(=O)O)C(=C)C)C)C)O)C(=O)O | 498.70 | unknown | via CMAUP database |
6,9,10,15,18-Pentahydroxy-12,12-dimethyl-6-[2-(9,10,15,18-tetrahydroxy-12,12-dimethyl-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-6-yl)ethyl]-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one | 73073304 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(C5=O)CCC6(C7CCC8C91COC(C8(C7O)C6=O)(C(C9C(CCC1O)(C)C)O)O)O)(OC3)O)O)O)C | 746.90 | unknown | https://doi.org/10.1021/OL0531379 |
9',10',13,14,15',18',19,22-Octahydroxy-12',12',16,16-tetramethylspiro[10,21-dioxahexacyclo[11.6.2.15,12.01,15.02,12.06,11]docos-6(11)-ene-9,6'-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane]-7'-one | 73047018 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C6=C5OC7(CC6)C8CCC9C12COC(C9(C8O)C7=O)(C(C1C(CCC2O)(C)C)O)O)(OC3)O)O)O)C | 728.90 | unknown | https://doi.org/10.1021/OL0531379 |
Agn-PC-0LP4KQ | 5248166 | Click to see CC(=O)OC1CCC2(C3C(CC4CC3(C(C(C2C1(C)C)OC(=O)C)O)C(=O)C4CCC5(C6CC(C7C8(CCC(C(C8C(C(C7(C6)C5=O)O)OC(=O)C)(C)C)OC(=O)C)C)O)O)O)C | 887.10 | unknown | https://doi.org/10.1016/J.TETLET.2004.02.051 |
alpha-Amyrin | 73170 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C | 426.70 | unknown |
https://doi.org/10.1016/S0031-9422(99)00578-6 https://doi.org/10.1016/S0969-2126(01)00690-6 |
beta-Ursolic acid | 220774 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O | 456.70 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
Bisrubescensin B | 11721844 | Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(C5=O)CCC6(C7CCC8C91COC(C8(C7O)C6=O)(C(C9C(CCC1O)(C)C)O)O)O)(OC3)O)O)O)C | 746.90 | unknown | https://doi.org/10.1021/OL0531379 |
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 | via CMAUP database |
Ursolic Acid | 64945 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O | 456.70 | unknown |
https://doi.org/10.1016/S0969-2126(01)00690-6 https://doi.org/10.1016/S0031-9422(99)00578-6 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids | |||||
(1R,2R,4aR,4bR,7R,8S,8aR)-8-(hydroxymethyl)-2-(3-hydroxyprop-1-en-2-yl)-4b,8-dimethyl-1,2,3,4,4a,5,6,7,8a,9-decahydrophenanthrene-1,7-diol | 101733553 | Click to see CC12CCC(C(C1CC=C3C2CCC(C3O)C(=C)CO)(C)CO)O | 336.50 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
(1R,2S,4aS,4bS,7R,8S,8aS)-8-(hydroxymethyl)-2-(3-hydroxyprop-1-en-2-yl)-4b,8-dimethyl-1,2,3,4,4a,5,6,7,8a,9-decahydrophenanthrene-1,7-diol | 11244609 | Click to see CC12CCC(C(C1CC=C3C2CCC(C3O)C(=C)CO)(C)CO)O | 336.50 | unknown | https://doi.org/10.1002/HLCA.200490072 |
8-(Hydroxymethyl)-2-(3-hydroxyprop-1-en-2-yl)-4b,8-dimethyl-1,2,3,4,4a,5,6,7,8a,9-decahydrophenanthrene-1,7-diol | 72766804 | Click to see CC12CCC(C(C1CC=C3C2CCC(C3O)C(=C)CO)(C)CO)O | 336.50 | unknown | https://doi.org/10.1002/HLCA.200490072 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 3-hydroxysteroids | |||||
(3aR,5aR,6S,7R,9aR,9bR,11aR)-6-(hydroxymethyl)-6,9a-dimethyl-1-methylidene-3a,5,5a,7,8,9,9b,10,11,11a-decahydronaphtho[1,2-g][1]benzofuran-7-ol | 101733554 | Click to see CC12CCC(C(C1CC=C3C2CCC4C3OCC4=C)(C)CO)O | 318.40 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
6-(Hydroxymethyl)-6,9a-dimethyl-1-methylidene-3a,5,5a,7,8,9,9b,10,11,11a-decahydronaphtho[1,2-g][1]benzofuran-7-ol | 73095197 | Click to see CC12CCC(C(C1CC=C3C2CCC4C3OCC4=C)(C)CO)O | 318.40 | unknown | https://doi.org/10.1002/HLCA.200490072 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 3-hydroxysteroids / 3-alpha-hydroxysteroids | |||||
(3aR,5aS,6S,7R,9aS,9bS,11aS)-6-(hydroxymethyl)-6,9a-dimethyl-1-methylidene-3a,5,5a,7,8,9,9b,10,11,11a-decahydronaphtho[1,2-g][1]benzofuran-7-ol | 12114716 | Click to see CC12CCC(C(C1CC=C3C2CCC4C3OCC4=C)(C)CO)O | 318.40 | unknown | https://doi.org/10.1002/HLCA.200490072 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 6-hydroxysteroids | |||||
(1S,2R,4aS,4bS,7R,9S,10aS)-1-(hydroxymethyl)-7-(1-hydroxypropan-2-yl)-1,4a-dimethyl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-2,9-diol | 102588468 | Click to see CC(CO)C1CCC2C(=C1)C(CC3C2(CCC(C3(C)CO)O)C)O | 338.50 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
(1S,2R,4aS,4bS,7R,9S,10aS)-1-(hydroxymethyl)-7-(3-hydroxyprop-1-en-2-yl)-1,4a-dimethyl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-2,9-diol | 11221382 | Click to see CC12CCC(C(C1CC(C3=CC(CCC23)C(=C)CO)O)(C)CO)O | 336.50 | unknown | https://doi.org/10.1002/HLCA.200490072 |
1-(Hydroxymethyl)-7-(3-hydroxyprop-1-en-2-yl)-1,4a-dimethyl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-2,9-diol | 72756987 | Click to see CC12CCC(C(C1CC(C3=CC(CCC23)C(=C)CO)O)(C)CO)O | 336.50 | unknown | https://doi.org/10.1002/HLCA.200490072 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Oxasteroids and derivatives | |||||
(1S,2S,5R,9S,13S,14S,19R)-14,17,17-trimethyl-6-methylidene-8,16,18-trioxapentacyclo[11.8.0.02,10.05,9.014,19]henicos-10-ene | 163102183 | Click to see CC1(OCC2(C(O1)CCC3C2CC=C4C3CCC5C4OCC5=C)C)C | 344.50 | unknown | https://doi.org/10.1016/J.FITOTE.2011.03.003 |
(1S,2S,5S,9R,13S,14S,19R)-1,14,17,17-tetramethyl-6-methylidene-8,16,18-trioxapentacyclo[11.8.0.02,10.05,9.014,19]henicos-10-ene | 11485147 | Click to see CC1(OCC2(C(O1)CCC3(C2CC=C4C3CCC5C4OCC5=C)C)C)C | 358.50 | unknown | https://doi.org/10.1002/HLCA.200490072 |
1,14,17,17-Tetramethyl-6-methylidene-8,16,18-trioxapentacyclo[11.8.0.02,10.05,9.014,19]henicos-10-ene | 72979772 | Click to see CC1(OCC2(C(O1)CCC3(C2CC=C4C3CCC5C4OCC5=C)C)C)C | 358.50 | unknown | https://doi.org/10.1002/HLCA.200490072 |
N-[3-(1,14-dimethyl-6-methylidene-8,16,18-trioxapentacyclo[11.8.0.02,10.05,9.014,19]henicos-10-en-17-yl)propyl]acetamide | 85081638 | Click to see CC(=O)NCCCC1OCC2(C(O1)CCC3(C2CC=C4C3CCC5C4OCC5=C)C)C | 429.60 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Oxosteroids / 19-oxosteroids | |||||
(1R,4R,9S,12S,13R,15R)-12-hydroxy-8,8-dimethyl-15-propan-2-yl-2,14-dioxapentacyclo[10.5.0.01,4.04,9.013,15]heptadecan-3-one | 52921235 | Click to see CC(C)C12CCC34C5(CCCC(C5CCC3(C1O2)O)(C)C)C(=O)O4 | 334.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3057937/ |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal alkaloids / Cerveratrum-type alkaloids | |||||
Taipaienine | 192522 | Click to see CC1C2CCC3C(C2CN4C1CCC(C4)(C)O)CC5C3CC(=O)C6C5(CCC(C6)O)C | 429.60 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides | |||||
(2R,3R,4S,5S,6R)-2-[[(3aR,5aR,6S,7R,9aR,9bR,11aR)-7-hydroxy-6,9a-dimethyl-1-methylidene-3a,5,5a,7,8,9,9b,10,11,11a-decahydronaphtho[1,2-g][1]benzofuran-6-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 101733556 | Click to see CC12CCC(C(C1CC=C3C2CCC4C3OCC4=C)(C)COC5C(C(C(C(O5)CO)O)O)O)O | 480.60 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
(2R,3R,4S,5S,6R)-2-[[(3aR,5aS,6S,7R,9aS,9bS,11aS)-7-hydroxy-6,9a-dimethyl-1-methylidene-3a,5,5a,7,8,9,9b,10,11,11a-decahydronaphtho[1,2-g][1]benzofuran-6-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 162944755 | Click to see CC12CCC(C(C1CC=C3C2CCC4C3OCC4=C)(C)COC5C(C(C(C(O5)CO)O)O)O)O | 480.60 | unknown | https://doi.org/10.1002/HLCA.200490072 |
2-[(7-Hydroxy-6,9a-dimethyl-1-methylidene-3a,5,5a,7,8,9,9b,10,11,11a-decahydronaphtho[1,2-g][1]benzofuran-6-yl)methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 72980993 | Click to see CC12CCC(C(C1CC=C3C2CCC4C3OCC4=C)(C)COC5C(C(C(C(O5)CO)O)O)O)O | 480.60 | unknown | https://doi.org/10.1002/HLCA.200490072 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides / Steroidal saponins | |||||
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(1R,2S,4S,6R,7S,8R,9S,12S,13S,16S,18S)-6-hydroxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-16-yl]oxy]oxan-2-yl]methoxy]oxane-3,4,5-triol | 163013982 | Click to see CC1C2C(CC3C2(CCC4C3CCC5C4(CCC(C5)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)O)O)O)O)O)O)C)C)OC1(CCC(C)COC8C(C(C(C(O8)CO)O)O)O)O | 921.10 | unknown | https://doi.org/10.1016/J.JCHROMB.2011.07.046 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives | |||||
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 86821 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C | 414.70 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
24-Ethylcholest-5-en-3beta-ol | 22012 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C | 414.70 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
beta-Sitosterol 3-O-beta-D-galactopyranoside | 296119 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C | 576.80 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
Sitogluside | 5742590 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C | 576.80 | unknown | https://doi.org/10.1016/S0031-9422(99)00578-6 |
> Nucleosides, nucleotides, and analogues / Purine nucleosides | |||||
2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one | 6802 | Click to see C1=NC2=C(N1C3C(C(C(O3)CO)O)O)NC(=NC2=O)N | 283.24 | unknown | via CMAUP database |
> Nucleosides, nucleotides, and analogues / Purine nucleotides / Cyclic purine nucleotides / 3,5-cyclic purine nucleotides | |||||
(4aR,6S,7S,7aR)-6-(6-aminopurin-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol | 25322948 | Click to see C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)O | 329.21 | unknown | via CMAUP database |
9-[(4aR,6R,7R,7aS)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-amino-3H-purin-6-one | 24316 | Click to see C1C2C(C(C(O2)N3C=NC4=C3NC(=NC4=O)N)O)OP(=O)(O1)O | 345.21 | unknown | https://doi.org/10.1016/J.JCHROMB.2011.07.046 |
Acrasin | 274 | Click to see C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)O | 329.21 | unknown | via CMAUP database |
Adenosine cyclic phosphate | 6076 | Click to see C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)O | 329.21 | unknown | via CMAUP database |
> Nucleosides, nucleotides, and analogues / Purine nucleotides / Purine ribonucleotides / Purine ribonucleoside monophosphates | |||||
[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate | 6804 | Click to see C1=NC2=C(N1C3C(C(C(O3)COP(=O)(O)O)O)O)NC(=NC2=O)N | 363.22 | unknown | https://doi.org/10.1016/J.JCHROMB.2011.07.046 |
Adenosine Phosphate | 6083 | Click to see C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O)N | 347.22 | unknown | https://doi.org/10.1016/J.JCHROMB.2011.07.046 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids | |||||
Betaine | 247 | Click to see C[N+](C)(C)CC(=O)[O-] | 117.15 | unknown | via CMAUP database |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Proline and derivatives | |||||
(2S)-pyrrolidin-1-ium-2-carboxylate | 6971047 | Click to see C1CC([NH2+]C1)C(=O)[O-] | 115.13 | unknown | via CMAUP database |
Betonicine | 164642 | Click to see C[N+]1(CC(CC1C(=O)[O-])O)C | 159.18 | unknown | via CMAUP database |
Stachydrine | 115244 | Click to see C[N+]1(CCCC1C(=O)[O-])C | 143.18 | unknown | via CMAUP database |
> Organic acids and derivatives / Carboxylic acids and derivatives / Pentacarboxylic acids and derivatives | |||||
(1R,2R,3S,4R)-6-[(E)-3-[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]-3-oxoprop-1-enyl]-3-(3,4-dihydroxyphenyl)cyclohex-5-ene-1,2,4-tricarboxylic acid | 10531154 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(C(C(C2C(=O)O)C(=O)O)C3=CC(=C(C=C3)O)O)C(=O)O)O)O | 572.50 | unknown | via CMAUP database |
> Organic acids and derivatives / Carboxylic acids and derivatives / Tetracarboxylic acids and derivatives | |||||
(2S,1R)-1,2-Bis(3-(3,4-dihydroxyphenyl)prop-2-enoyloxy)ethane-1,2-dicarboxylic acid | 6450976 | Click to see C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)C(=O)O)O)O | 474.40 | unknown | via CMAUP database |
2,3-Bis[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]butanedioic acid | 5134221 | Click to see C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)C(=O)O)O)O | 474.40 | unknown | via CMAUP database |
Caffeoyl feruloyl tartaric acid | 50915790 | Click to see COC1=C(C=CC(=C1)C=CC(=O)OC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)C(=O)O)O | 488.40 | unknown | via CMAUP database |
Chicoric acid | 5281764 | Click to see C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)C(=O)O)O)O | 474.40 | unknown | via CMAUP database |
D-Chicoric acid | 5470299 | Click to see C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)C(=O)O)O)O | 474.40 | unknown | via CMAUP database |
> Organic nitrogen compounds / Organonitrogen compounds / Quaternary ammonium salts / Cholines | |||||
Choline | 305 | Click to see C[N+](C)(C)CCO | 104.17 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclic alcohols and derivatives | |||||
(1R,3S,4R,10S,13S,15R,16R)-3,15,16-trihydroxy-5,5-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadec-8-en-2-one | 11056251 | Click to see CC1(CCC=C2C1C(C(=O)C34C2CCC(C3O)C(=C)C4O)O)C | 318.40 | unknown | https://doi.org/10.1002/HLCA.200390077 |
(1S,3R,4S,10R,13R,15S,16S)-3,15,16-trihydroxy-5,5-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadec-8-en-2-one | 162913775 | Click to see CC1(CCC=C2C1C(C(=O)C34C2CCC(C3O)C(=C)C4O)O)C | 318.40 | unknown | https://doi.org/10.1002/HLCA.200390077 |
3,15,16-Trihydroxy-5,5-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadec-8-en-2-one | 85382637 | Click to see CC1(CCC=C2C1C(C(=O)C34C2CCC(C3O)C(=C)C4O)O)C | 318.40 | unknown | https://doi.org/10.1002/HLCA.200390077 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives | |||||
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 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes | |||||
Decanal | 8175 | Click to see CCCCCCCCCC=O | 156.26 | unknown | via CMAUP database |
Nonanal | 31289 | Click to see CCCCCCCCC=O | 142.24 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Xanthones | |||||
Gambospiroene | 45268894 | Click to see CC1=CCC2(CC1=O)C34C(CC=CC3C(=O)C5=C(C(=C(C(=C5O4)CC=C(C)C)O)CC=C(C)CCC=C(C)C)O)C(O2)(C)C | 600.80 | unknown |
https://doi.org/10.1055/S-0029-1186002 https://doi.org/10.1248/CPB.51.790 https://doi.org/10.1016/J.TET.2006.02.079 |
> Organoheterocyclic compounds / Cycloheptafurans | |||||
[(2S,5S,6R,7S,9S)-9-hydroxy-5,9,13-trimethyl-4-oxo-3,12-dioxatricyclo[8.3.0.02,6]trideca-1(13),10-dien-7-yl] (E)-2-methylbut-2-enoate | 102008485 | Click to see CC=C(C)C(=O)OC1CC(C2=COC(=C2C3C1C(C(=O)O3)C)C)(C)O | 348.40 | unknown | via CMAUP database |
[(2S,5S,6R,7S,9S)-9-hydroxy-5,9,13-trimethyl-4-oxo-3,12-dioxatricyclo[8.3.0.02,6]trideca-1(13),10-dien-7-yl] acetate | 15127111 | Click to see CC1C2C(CC(C3=COC(=C3C2OC1=O)C)(C)O)OC(=O)C | 308.33 | unknown | via CMAUP database |
2-Butenoic acid, 2-methyl-, (3S,3aR,4S,6S,9bS)-2,3,3a,5,6,9b-hexahydro-6-hydroxy-3,6,9-trimethyl-2-oxo-4H-cyclohepta(2,1-b:3,4-c')difuran-4-yl ester, (2Z)- | 102008484 | Click to see CC=C(C)C(=O)OC1CC(C2=COC(=C2C3C1C(C(=O)O3)C)C)(C)O | 348.40 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones | |||||
[(3R,3aR,4S,9aS,9bR)-3,6,9-trimethyl-2,7-dioxo-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-4-yl] acetate | 102014217 | Click to see CC1C2C(CC(=C3C(C2OC1=O)C(=CC3=O)C)C)OC(=O)C | 304.34 | unknown | via CMAUP database |
[(3S,3aR,4S,9aR,9bS)-9a-hydroxy-3,6,9-trimethyl-2,7-dioxo-3a,4,5,9b-tetrahydro-3H-azuleno[4,5-b]furan-4-yl] acetate | 76764466 | Click to see CC1C2C(CC(=C3C(=O)C=C(C3(C2OC1=O)O)C)C)OC(=O)C | 320.30 | unknown | via CMAUP database |
14-Deoxylactucin | 156302 | Click to see CC1=C2C(C3C(C(C1)O)C(=C)C(=O)O3)C(=CC2=O)C | 260.28 | unknown | via CMAUP database |
Austricin | 6713966 | Click to see CC1C2C(CC(=C3C(C2OC1=O)C(=CC3=O)C)C)O | 262.30 | unknown | via CMAUP database |
Dehydroleucodine | 73440 | Click to see CC1=C2C(C3C(CC1)C(=C)C(=O)O3)C(=CC2=O)C | 244.28 | unknown | via CMAUP database |
Hydroxyachillin | 10038339 | Click to see CC1C2C(CC(=C3C(C2OC1=O)C(=CC3=O)C)C)O | 262.30 | unknown | via CMAUP database |
Matricarin | 3083923 | Click to see CC1C2C(CC(=C3C(C2OC1=O)C(=CC3=O)C)C)OC(=O)C | 304.34 | unknown | via CMAUP database |
Matricin | 92265 | Click to see CC1C2C(CC(=C3C=CC(C3C2OC1=O)(C)O)C)OC(=O)C | 306.40 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Naphthopyrans | |||||
[9-(Acetyloxymethyl)-11-hydroxy-7,7-dimethyl-14-methylidene-2,15-dioxo-5-oxatetracyclo[11.2.1.01,10.04,9]hexadecan-8-yl]methyl acetate | 5320878 | Click to see CC(=O)OCC1C(COC2C1(C3C(CC4CC3(C(=O)C2)C(=O)C4=C)O)COC(=O)C)(C)C | 448.50 | unknown | https://doi.org/10.1002/CHIN.200349162 |
> Organoheterocyclic compounds / Oxanes | |||||
Eucalyptol | 2758 | Click to see CC1(C2CCC(O1)(CC2)C)C | 154.25 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Pyridines and derivatives | |||||
15-Azabicyclo[9.3.1]pentadeca-1(15),11,13-triene | 5320193 | Click to see C1CCCCC2=NC(=CC=C2)CCCC1 | 203.32 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Tetrapyrroles and derivatives / Chlorins | |||||
methyl (3R,21S,22S)-16-ethenyl-11-ethyl-12-formyl-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5(26),6,8,10,12,14,16,18,20(23)-decaene-3-carboxylate | 6602299 | Click to see CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C=O)N2)N6)C=C)C)C)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(=O)OC)C | 885.20 | unknown | via CMAUP database |
methyl 16-ethenyl-11-ethyl-12,17,21,26-tetramethyl-4-oxo-22-[3-oxo-3-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),5(26),7,9,11,13,15,17,19-decaene-3-carboxylate | 5351507 | Click to see CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(C(C(=N4)C5=C6C(=C(C(=N6)C=C1N2)C)C(=O)C5C(=O)OC)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C)C)C=C)C | 871.20 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids | |||||
(2R)-2-({(2E)-3-[(2R,3R)-3-{[1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl}-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyl}oxy)-3-(3,4-dihydroxyphenyl)propanoic acid | 6441188 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O | 718.60 | unknown | via CMAUP database |
(2R)-2-[(E)-3-[(3S)-3-[1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyl]oxy-3-(3,4-dihydroxyphenyl)propanoic acid | 45358152 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O | 718.60 | unknown | via CMAUP database |
(2R)-2-[(E)-3-[3-[(1R)-1-Carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyl]oxy-3-(3,4-dihydroxyphenyl)propanoic acid | 13991589 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O | 718.60 | unknown | via CMAUP database |
(2R)-2-[3-[(2R,3R)-3-[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyloxy]-3-(3,4-dihydroxyphenyl)propanoic acid | 92132738 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O | 718.60 | unknown | via CMAUP database |
(2S,3S)-4-[(E)-3-[(1S)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]-3-oxoprop-1-enyl]-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-3-carboxylic acid | 95359683 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)O)O)O | 538.50 | unknown | via CMAUP database |
(2S)-2-[(E)-3-[(3S)-3-[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyl]oxy-3-(3,4-dihydroxyphenyl)propanoic acid | 50914802 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O | 718.60 | unknown | via CMAUP database |
(2S)-2-[3-[(3S)-3-[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyloxy]-3-(3,4-dihydroxyphenyl)propanoic acid | 71433917 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O | 718.60 | unknown | via CMAUP database |
(R)-2-(((2R,3R)-4-((E)-3-((R)-1-Carboxy-2-(3,4-dihydroxyphenyl)ethoxy)-3-oxoprop-1-en-1-yl)-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydrobenzofuran-3-carbonyl)oxy)-3-(3,4-dihydroxyphenyl)propanoic acid | 11629084 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O | 718.60 | unknown | via CMAUP database |
CID 13991587 | 13991587 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O | 718.60 | unknown | via CMAUP database |
CID 5281302 | 5281302 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)O)O)O | 538.50 | unknown | via CMAUP database |
CID 6123454 | 6123454 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)O)O)O | 538.50 | unknown | via CMAUP database |
Lithospermic acid | 6441498 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)O)O)O | 538.50 | unknown | via CMAUP database |
Salvianic acid B | 119177 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O | 718.60 | unknown | via CMAUP database |
Salvianolic acid B | 6451084 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O | 718.60 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives | |||||
2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2-hydroxybutanedioic acid | 14707056 | Click to see C1=CC(=C(C=C1C=CC(=O)C(CC(=O)O)(C(=O)O)O)O)O | 296.23 | unknown | https://doi.org/10.1016/J.JCHROMB.2011.07.046 |
2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2,3-dihydroxybutanedioic acid | 18318655 | Click to see C1=CC(=C(C=C1C=CC(=O)C(C(C(=O)O)O)(C(=O)O)O)O)O | 312.23 | unknown | https://doi.org/10.1016/J.JCHROMB.2011.07.046 |
2,3-bis[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2,3-dihydroxybutanedioic acid | 23131559 | Click to see C1=CC(=C(C=C1C=CC(=O)C(C(=O)O)(C(C(=O)C=CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O)O)O | 474.40 | unknown | https://doi.org/10.1016/J.JCHROMB.2011.07.046 |
Caffeoyl-feruloyltartaric acid | 129724266 | Click to see COC1=C(C=CC(=C1)C=CC(=O)C(C(=O)O)(C(C(=O)C=CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O)O | 488.40 | unknown | https://doi.org/10.1016/J.JCHROMB.2011.07.046 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives | |||||
(-)-Phaselic acid | 4484594 | Click to see C1=CC(=C(C=C1C=CC(=O)OC(CC(=O)O)C(=O)O)O)O | 296.23 | unknown | via CMAUP database |
(S)-rosmarinic acid | 639655 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 360.30 | unknown | via CMAUP database |
2-[(E)-3-(3,4-Dimethoxyphenyl)prop-2-enoyl]oxybutanedioic acid | 90471964 | Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(CC(=O)O)C(=O)O)OC | 324.28 | unknown | via CMAUP database |
Caffeoylmalic Acid | 6124299 | Click to see C1=CC(=C(C=C1C=CC(=O)OC(CC(=O)O)C(=O)O)O)O | 296.23 | unknown | via CMAUP database |
Caffeoyltartaric acid | 9857913 | Click to see C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)O)C(=O)O)O)O | 312.23 | unknown | via CMAUP database |
Caftaric acid | 6440397 | Click to see C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)O)C(=O)O)O)O | 312.23 | unknown | via CMAUP database |
Fertaric acid | 22298372 | Click to see COC1=C(C=CC(=C1)C=CC(=O)OC(C(C(=O)O)O)C(=O)O)O | 326.25 | unknown | via CMAUP database |
Rosmarinate | 5315615 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 360.30 | unknown | via CMAUP database |
Rosmarinic acid | 5281792 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 360.30 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids | |||||
Caffeic Acid | 689043 | Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O | 180.16 | unknown | via CMAUP database |
cis-Caffeic acid | 1549111 | Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O | 180.16 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones / Flavanonols | |||||
(2S,3S)-3,5,7-trihydroxy-6-methyl-2-phenyl-2,3-dihydrochromen-4-one | 162978751 | Click to see CC1=C(C2=C(C=C1O)OC(C(C2=O)O)C3=CC=CC=C3)O | 286.28 | unknown | https://doi.org/10.1016/J.JCHROMB.2011.07.046 |
> Phenylpropanoids and polyketides / Flavonoids / Flavones | |||||
Luteolin | 5280445 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O | 286.24 | unknown | https://doi.org/10.1021/NP030165W |
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols | |||||
Isorhamnetin | 5281654 | Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O | 316.26 | unknown | via CMAUP database |
Quercetagetin-6,7-3',4'-tetramethyl Ether | 5316832 | Click to see COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC)O)O)OC | 374.30 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides | |||||
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one | 154497137 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O)O | 448.40 | unknown | https://doi.org/10.1248/CPB.51.790 |
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S,3R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one | 44257907 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O)O | 448.40 | unknown | via CMAUP database |
Isoschaftoside | 3084995 | Click to see C1C(C(C(C(O1)C2=C(C(=C3C(=C2O)C(=O)C=C(O3)C4=CC=C(C=C4)O)C5C(C(C(C(O5)CO)O)O)O)O)O)O)O | 564.50 | unknown | via CMAUP database |
Schaftoside | 442658 | Click to see C1C(C(C(C(O1)C2=C3C(=C(C(=C2O)C4C(C(C(C(O4)CO)O)O)O)O)C(=O)C=C(O3)C5=CC=C(C=C5)O)O)O)O | 564.50 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-7-O-glucuronides | |||||
Luteolin 7-glucuronide | 5280601 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O)O | 462.40 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides | |||||
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one | 26339717 | Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O | 448.40 | unknown | https://doi.org/10.1021/NP030165W |
Kaempferol-3-O-rutinoside | 5318767 | Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O | 594.50 | unknown | via CMAUP database |
Quercetin 3-O-rhamnoside | 5353915 | Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O | 448.40 | unknown | https://doi.org/10.1021/NP030165W |
Rutin | 5280805 | Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O | 610.50 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides | |||||
6-Hydroxyluteolin 7-glucoside | 185766 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O | 464.40 | unknown | via CMAUP database |
Apigetrin | 5280704 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O | 432.40 | unknown | via CMAUP database |
Isorhoifolin | 9851181 | Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)O)O)O)O)O)O)O)O | 578.50 | unknown | via CMAUP database |
Luteolin 7-O-glucoside | 5280637 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O | 448.40 | unknown | via CMAUP database |
Wushanicariin | 3082728 | Click to see CC(=CCC1=CC2=C(C=C1OC3C(C(C(C(O3)CO)O)O)O)OC(=CC2=O)C4=CC(=C(C(=C4)O)OC)O)C | 530.50 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 4-O-methylated flavonoids | |||||
Diosmetin | 5281612 | Click to see COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O | 300.26 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 6-O-methylated flavonoids | |||||
Centaureidin | 5315773 | Click to see COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C(=C3O)OC)O)OC)O | 360.30 | unknown | via CMAUP database |
Pectolinarigenin | 5320438 | Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C(=C3O)OC)O | 314.29 | unknown | via CMAUP database |
Santin | 5281695 | Click to see COC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C(=C3O)OC)O)OC | 344.30 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids | |||||
5-Hydroxy-3,6,7,4'-tetramethoxyflavone | 5318355 | Click to see COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC)O)OC | 358.30 | unknown | via CMAUP database |
Artemetin | 5320351 | Click to see COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC)O)OC)OC | 388.40 | unknown | via CMAUP database |
Eupatorin | 97214 | Click to see COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)O)O | 344.30 | unknown | via CMAUP database |
Pedalitin | 31161 | Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C=C3)O)O)O)O | 316.26 | unknown |
https://doi.org/10.1016/S0031-9422(99)00578-6 https://doi.org/10.1248/YAKUSHI.130.447 https://doi.org/10.1248/CPB.48.148 https://doi.org/10.1021/NP030165W |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 8-O-methylated flavonoids | |||||
Gardenin D | 3080750 | Click to see COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C(=C(C(=C3O2)OC)OC)OC)O)O | 374.30 | unknown | https://doi.org/10.1021/NP030165W |
Sideritoflavone | 155493 | Click to see COC1=C(C(=C2C(=C1O)C(=O)C=C(O2)C3=CC(=C(C=C3)O)O)OC)OC | 360.30 | unknown | https://doi.org/10.1021/NP030165W |
> Phenylpropanoids and polyketides / Isoflavonoids / Furanoisoflavonoids / Pterocarpans | |||||
(-)-Pisatin | 107880 | Click to see COC1=CC2=C(C=C1)C3C(CO2)(C4=CC5=C(C=C4O3)OCO5)O | 314.29 | unknown | via CMAUP database |
(1S,12S)-16-[[(6aS,11aS)-6a-hydroxy-9-methoxy-6,11a-dihydro-[1]benzofuro[3,2-c]chromen-3-yl]oxy]-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaen-1-ol | 49871045 | Click to see COC1=CC2=C(C=C1)C3(COC4=C(C3O2)C=CC(=C4)OC5=CC6=C(C=C5)C7C(CO6)(C8=CC9=C(C=C8O7)OCO9)O)O | 568.50 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Isoflavonoids / Pyranoisoflavonoids | |||||
5-Methoxy-8,8-dimethyl-3-(2,4,5-trimethoxyphenyl)pyrano[2,3-h]chromen-4-one | 14057037 | Click to see CC1(C=CC2=C3C(=C(C=C2O1)OC)C(=O)C(=CO3)C4=CC(=C(C=C4OC)OC)OC)C | 424.40 | unknown | via CMAUP database |
6-Methoxy-8,8-dimethyl-3-(2,4,5-trimethoxyphenyl)pyrano[2,3-h]chromen-4-one | 23874485 | Click to see CC1(C=CC2=C3C(=CC(=C2O1)OC)C(=O)C(=CO3)C4=CC(=C(C=C4OC)OC)OC)C | 424.40 | unknown | via CMAUP database |
Calopogoniumisoflavone B | 182342 | Click to see CC1(C=CC2=C(O1)C=CC3=C2OC=C(C3=O)C4=CC5=C(C=C4)OCO5)C | 348.30 | unknown | via CMAUP database |
Durmillone | 12309400 | Click to see CC1(C=CC2=C3C(=CC(=C2O1)OC)C(=O)C(=CO3)C4=CC5=C(C=C4)OCO5)C | 378.40 | unknown | via CMAUP database |
Ichthynone | 3428129 | Click to see CC1(C=CC2=C3C(=CC(=C2O1)OC)C(=O)C(=CO3)C4=CC5=C(C=C4OC)OCO5)C | 408.40 | unknown | via CMAUP database |
Jamaicin | 12304682 | Click to see CC1(C=CC2=C(O1)C=CC3=C2OC=C(C3=O)C4=CC5=C(C=C4OC)OCO5)C | 378.40 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Isoflavonoids / Rotenoids / Rotenones | |||||
Rotenone | 6758 | Click to see CC(=C)C1CC2=C(O1)C=CC3=C2OC4COC5=CC(=C(C=C5C4C3=O)OC)OC | 394.40 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Phenylpropanoic acids | |||||
3-(3,4-Dihydroxyphenyl)-2-hydroxypropanoic acid | 439435 | Click to see C1=CC(=C(C=C1CC(C(=O)O)O)O)O | 198.17 | unknown | via CMAUP database |
Danshensu | 11600642 | Click to see C1=CC(=C(C=C1CC(C(=O)O)O)O)O | 198.17 | unknown | via CMAUP database |
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