> Alkaloids and derivatives
|
[(4E)-7-acetyloxy-4-ethylidene-17-hydroxy-6,7,14-trimethyl-3,8-dioxo-2,9-dioxa-14-azoniatricyclo[9.5.1.014,17]heptadec-11-en-5-yl] acetate
|
5379437 |
Click to see
CC=C1C(C(C(C(=O)OCC2=CC[N+]3(C2(C(CC3)OC1=O)O)C)(C)OC(=O)C)C)OC(=O)C
|
466.50 |
unknown |
via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Gallic acids
|
Gallic Acid
|
370 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)O
|
170.12 |
unknown |
via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Diphenylethers
|
4-Methoxy[3,4'-oxybisbenzaldehyde]
|
11065027 |
Click to see
COC1=C(C=C(C=C1)C=O)OC2=CC=C(C=C2)C=O
|
256.25 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00894-7 https://doi.org/10.1016/S0031-9422(97)00493-7 |
> Benzenoids / Naphthalenes / Naphthalenecarboxylic acids and derivatives
|
Ligudentatin A
|
10490645 |
Click to see
CC(=C)C1CCC2=C(C1)C(=CC(=C2)O)C(=O)OC
|
246.30 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00894-7 https://doi.org/10.1016/S0031-9422(97)00493-7 |
Ligudentatin B
|
10491586 |
Click to see
CCOC(=O)C1=CC(=CC2=C1CC(CC2)C(=C)C)O
|
260.33 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00894-7 |
Methyl 3-hydroxy-7-prop-1-en-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxylate
|
85158083 |
Click to see
CC(=C)C1CCC2=C(C1)C(=CC(=C2)O)C(=O)OC
|
246.30 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00493-7 |
> Benzenoids / Phenanthrenes and derivatives
|
(2S,4aR,6aS,6aR,8R,14aR,14bS)-10,11-dihydroxy-8-(1-hydroxyethyl)-2,4a,6a,6a,9,14a-hexamethyl-3,4,5,6,8,13,14,14b-octahydro-1H-picene-2-carboxylic acid
|
133562386 |
Click to see
CC1=C2C(C=C3C(C2=CC(=C1O)O)(CCC4(C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C)C(C)O
|
496.70 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
> Benzenoids / Phenols / Benzenediols / Catechols
|
[(2R,3S,5S)-2-(2,3-dihydroxy-4-methylphenyl)-5-(2-methoxypropan-2-yl)-2-methyloxolan-3-yl] (Z)-2-methylbut-2-enoate
|
163189810 |
Click to see
CC=C(C)C(=O)OC1CC(OC1(C)C2=C(C(=C(C=C2)C)O)O)C(C)(C)OC
|
378.50 |
unknown |
https://doi.org/10.1002/HLCA.200790131 |
[2-(2,3-Dihydroxy-4-methylphenyl)-5-(2-methoxypropan-2-yl)-2-methyloxolan-3-yl] 2-methylbut-2-enoate
|
162946313 |
Click to see
CC=C(C)C(=O)OC1CC(OC1(C)C2=C(C(=C(C=C2)C)O)O)C(C)(C)OC
|
378.50 |
unknown |
https://doi.org/10.1002/HLCA.200790131 |
> Benzenoids / Phenols / Methoxyphenols
|
Vanillin
|
1183 |
Click to see
COC1=C(C=CC(=C1)C=O)O
|
152.15 |
unknown |
https://doi.org/10.1007/S11418-007-0156-5 |
> Benzenoids / Tetralins
|
(3S)-6-hydroxy-3-prop-1-en-2-yl-3,4-dihydro-2H-naphthalen-1-one
|
90474398 |
Click to see
CC(=C)C1CC2=C(C=CC(=C2)O)C(=O)C1
|
202.25 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00894-7 |
(3S)-6-hydroxy-5-methyl-3-prop-1-en-2-yl-3,4-dihydro-2H-naphthalen-1-one
|
5325815 |
Click to see
CC1=C(C=CC2=C1CC(CC2=O)C(=C)C)O
|
216.27 |
unknown |
https://doi.org/10.1246/BCSJ.63.2239 https://doi.org/10.1016/S0031-9422(97)00493-7 |
1-Methyl-7-prop-1-en-2-yl-5,6,7,8-tetrahydronaphthalen-2-ol
|
14681762 |
Click to see
CC1=C(C=CC2=C1CC(CC2)C(=C)C)O
|
202.29 |
unknown |
https://doi.org/10.1246/BCSJ.63.2239 https://doi.org/10.1016/S0031-9422(97)00493-7 |
3-Hydroxy-7-prop-1-en-2-yl-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde
|
14681763 |
Click to see
CC(=C)C1CCC2=C(C1)C(=CC(=C2)O)C=O
|
216.27 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00493-7 |
6-hydroxy-5-methyl-3-prop-1-en-2-yl-3,4-dihydro-2H-naphthalen-1-one
|
14681765 |
Click to see
CC1=C(C=CC2=C1CC(CC2=O)C(=C)C)O
|
216.27 |
unknown |
https://doi.org/10.1246/BCSJ.63.2239 https://doi.org/10.1055/S-2006-957734 https://doi.org/10.1016/S0031-9422(97)00894-7 https://doi.org/10.1016/S0031-9422(97)00493-7 https://doi.org/10.1002/CHIN.199050295 |
Ligudentatol
|
11009001 |
Click to see
CC1=C(C=CC2=C1CC(CC2)C(=C)C)O
|
202.29 |
unknown |
https://doi.org/10.1246/BCSJ.63.2239 https://doi.org/10.1016/S0031-9422(97)00894-7 https://doi.org/10.1016/S0031-9422(97)00493-7 https://doi.org/10.1002/CHIN.199050295 |
Liguhodgsonal
|
14681764 |
Click to see
CC(=C)C1CCC2=C(C1)C(=CC(=C2)O)C=O
|
216.27 |
unknown |
https://doi.org/10.1055/S-2006-957734 https://doi.org/10.1016/S0031-9422(97)00894-7 https://doi.org/10.1016/S0031-9422(97)00493-7 https://doi.org/10.1002/CHIN.199050295 https://doi.org/10.1248/CPB.32.475 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters
|
methyl (2S)-2-[(2R,4R)-4-ethyl-2-methyl-5-oxooxolan-2-yl]-2-hydroxypropanoate
|
162871474 |
Click to see
CCC1CC(OC1=O)(C)C(C)(C(=O)OC)O
|
230.26 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
Methyl 2-(4-ethyl-2-methyl-5-oxooxolan-2-yl)-2-hydroxypropanoate
|
162871473 |
Click to see
CCC1CC(OC1=O)(C)C(C)(C(=O)OC)O
|
230.26 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
[(1R,2R,3S,4R,6R)-3-[5,6-dihydroxy-6-methyl-3-[(Z)-2-methylbut-2-enoyl]oxyhept-1-en-2-yl]-6-methyl-4-[(Z)-2-methylbut-2-enoyl]oxy-5-oxo-7-oxabicyclo[4.1.0]heptan-2-yl] (Z)-2-methylbut-2-enoate
|
102427334 |
Click to see
CC=C(C)C(=O)OC1C(C(C(=O)C2(C1O2)C)OC(=O)C(=CC)C)C(=C)C(CC(C(C)(C)O)O)OC(=O)C(=CC)C
|
562.60 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00894-7 |
[(1R,2S,3R,4R,6R)-4-hydroxy-3-[(3R,5R)-5-hydroxy-6-methoxy-6-methyl-3-[(Z)-2-methylbut-2-enoyl]oxyhept-1-en-2-yl]-6-methyl-5-oxo-7-oxabicyclo[4.1.0]heptan-2-yl] (Z)-2-methylbut-2-enoate
|
163022820 |
Click to see
CC=C(C)C(=O)OC1C(C(C(=O)C2(C1O2)C)O)C(=C)C(CC(C(C)(C)OC)O)OC(=O)C(=CC)C
|
494.60 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
[(1R,3R,4R,6R)-4-[5-hydroxy-6-methoxy-6-methyl-3-[(Z)-2-methylbut-2-enoyl]oxyhept-1-en-2-yl]-1-methyl-2-oxo-7-oxabicyclo[4.1.0]heptan-3-yl] (Z)-2-methylbut-2-enoate
|
102427335 |
Click to see
CC=C(C)C(=O)OC1C(CC2C(C1=O)(O2)C)C(=C)C(CC(C(C)(C)OC)O)OC(=O)C(=CC)C
|
478.60 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00894-7 |
[(1R,3R,4S,5S,6S)-3,5-dihydroxy-6-[(3R,5R)-5-hydroxy-6-methoxy-6-methyl-3-[(Z)-2-methylbut-2-enoyl]oxyhept-1-en-2-yl]-3-methyl-4-[(Z)-2-methylbut-2-enoyl]oxy-2-oxocyclohexyl] (Z)-2-methylbut-2-enoate
|
162904587 |
Click to see
CC=C(C)C(=O)OC1C(C(C(C(C1=O)(C)O)OC(=O)C(=CC)C)O)C(=C)C(CC(C(C)(C)OC)O)OC(=O)C(=CC)C
|
594.70 |
unknown |
https://doi.org/10.1055/S-2006-957734 |
[(1R,3R,4S,5S,6S)-3,5-dihydroxy-6-[(3S,5R)-5-hydroxy-6-methyl-3-[(Z)-2-methylbut-2-enoyl]oxyhepta-1,6-dien-2-yl]-3-methyl-4-[(Z)-2-methylbut-2-enoyl]oxy-2-oxocyclohexyl] (Z)-2-methylbut-2-enoate
|
163000037 |
Click to see
CC=C(C)C(=O)OC1C(C(C(C(C1=O)(C)O)OC(=O)C(=CC)C)O)C(=C)C(CC(C(=C)C)O)OC(=O)C(=CC)C
|
562.60 |
unknown |
https://doi.org/10.1055/S-2006-957734 |
[(1R,3R,4S,5S,6S)-6-[(3S,5S)-5,6-dihydroxy-6-methyl-3-[(Z)-2-methylbut-2-enoyl]oxyhept-1-en-2-yl]-3,5-dihydroxy-3-methyl-4-[(Z)-2-methylbut-2-enoyl]oxy-2-oxocyclohexyl] (Z)-2-methylbut-2-enoate
|
162945226 |
Click to see
CC=C(C)C(=O)OC1C(C(C(C(C1=O)(C)O)OC(=O)C(=CC)C)O)C(=C)C(CC(C(C)(C)O)O)OC(=O)C(=CC)C
|
580.70 |
unknown |
https://doi.org/10.1055/S-2006-957734 |
[(1S,2S,3R,5R,6S)-6-[(3S)-4-[(2R)-3,3-dimethyloxiran-2-yl]-3-[(Z)-2-methylbut-2-enoyl]oxybut-1-en-2-yl]-2,3-dihydroxy-3-methyl-5-[(Z)-2-methylbut-2-enoyl]oxy-4-oxocyclohexyl] (Z)-2-methylbut-2-enoate
|
163034422 |
Click to see
CC=C(C)C(=O)OC1C(C(C(=O)C(C1O)(C)O)OC(=O)C(=CC)C)C(=C)C(CC2C(O2)(C)C)OC(=O)C(=CC)C
|
562.60 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
[(1S,3S,4R,5R,6R)-6-[(3S)-4-[(2S)-3,3-dimethyloxiran-2-yl]-3-[(Z)-2-methylbut-2-enoyl]oxybut-1-en-2-yl]-3,5-dihydroxy-3-methyl-4-[(Z)-2-methylbut-2-enoyl]oxy-2-oxocyclohexyl] (Z)-2-methylbut-2-enoate
|
162879453 |
Click to see
CC=C(C)C(=O)OC1C(C(C(C(C1=O)(C)O)OC(=O)C(=CC)C)O)C(=C)C(CC2C(O2)(C)C)OC(=O)C(=CC)C
|
562.60 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
[(2E,3S)-2-[(5R)-3-acetyloxy-5-hydroxy-4-methyl-2-oxocyclohex-3-en-1-ylidene]-6-methylhept-5-en-3-yl] (Z)-2-methylbut-2-enoate
|
163082181 |
Click to see
CC=C(C)C(=O)OC(CC=C(C)C)C(=C1CC(C(=C(C1=O)OC(=O)C)C)O)C
|
390.50 |
unknown |
https://doi.org/10.1002/HLCA.200790131 |
[(3R,5R)-2-(2,3-dihydroxy-4-methylphenyl)-5-hydroxy-6-methoxy-6-methylhept-1-en-3-yl] (Z)-2-methylbut-2-enoate
|
162879055 |
Click to see
CC=C(C)C(=O)OC(CC(C(C)(C)OC)O)C(=C)C1=C(C(=C(C=C1)C)O)O
|
378.50 |
unknown |
https://doi.org/10.1002/HLCA.200790131 |
[2-(2,3-Dihydroxy-4-methylphenyl)-5-hydroxy-6-methoxy-6-methylhept-1-en-3-yl] 2-methylbut-2-enoate
|
162879054 |
Click to see
CC=C(C)C(=O)OC(CC(C(C)(C)OC)O)C(=C)C1=C(C(=C(C=C1)C)O)O
|
378.50 |
unknown |
https://doi.org/10.1002/HLCA.200790131 |
[2-(3-Acetyloxy-5-hydroxy-4-methyl-2-oxocyclohex-3-en-1-ylidene)-6-methylhept-5-en-3-yl] 2-methylbut-2-enoate
|
163082180 |
Click to see
CC=C(C)C(=O)OC(CC=C(C)C)C(=C1CC(C(=C(C1=O)OC(=O)C)C)O)C
|
390.50 |
unknown |
https://doi.org/10.1002/HLCA.200790131 |
[3,5-Dihydroxy-6-[5-hydroxy-6-methoxy-6-methyl-3-(2-methylbut-2-enoyloxy)hept-1-en-2-yl]-3-methyl-4-(2-methylbut-2-enoyloxy)-2-oxocyclohexyl] 2-methylbut-2-enoate
|
162904586 |
Click to see
CC=C(C)C(=O)OC1C(C(C(C(C1=O)(C)O)OC(=O)C(=CC)C)O)C(=C)C(CC(C(C)(C)OC)O)OC(=O)C(=CC)C
|
594.70 |
unknown |
https://doi.org/10.1055/S-2006-957734 |
[3,5-Dihydroxy-6-[5-hydroxy-6-methyl-3-(2-methylbut-2-enoyloxy)hepta-1,6-dien-2-yl]-3-methyl-4-(2-methylbut-2-enoyloxy)-2-oxocyclohexyl] 2-methylbut-2-enoate
|
163000036 |
Click to see
CC=C(C)C(=O)OC1C(C(C(C(C1=O)(C)O)OC(=O)C(=CC)C)O)C(=C)C(CC(C(=C)C)O)OC(=O)C(=CC)C
|
562.60 |
unknown |
https://doi.org/10.1055/S-2006-957734 |
[4-Hydroxy-3-[5-hydroxy-6-methoxy-6-methyl-3-(2-methylbut-2-enoyloxy)hept-1-en-2-yl]-6-methyl-5-oxo-7-oxabicyclo[4.1.0]heptan-2-yl] 2-methylbut-2-enoate
|
163022819 |
Click to see
CC=C(C)C(=O)OC1C(C(C(=O)C2(C1O2)C)O)C(=C)C(CC(C(C)(C)OC)O)OC(=O)C(=CC)C
|
494.60 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
[6-[4-(3,3-Dimethyloxiran-2-yl)-3-(2-methylbut-2-enoyloxy)but-1-en-2-yl]-2,3-dihydroxy-3-methyl-5-(2-methylbut-2-enoyloxy)-4-oxocyclohexyl] 2-methylbut-2-enoate
|
163034421 |
Click to see
CC=C(C)C(=O)OC1C(C(C(=O)C(C1O)(C)O)OC(=O)C(=CC)C)C(=C)C(CC2C(O2)(C)C)OC(=O)C(=CC)C
|
562.60 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
[6-[4-(3,3-Dimethyloxiran-2-yl)-3-(2-methylbut-2-enoyloxy)but-1-en-2-yl]-3,5-dihydroxy-3-methyl-4-(2-methylbut-2-enoyloxy)-2-oxocyclohexyl] 2-methylbut-2-enoate
|
162879452 |
Click to see
CC=C(C)C(=O)OC1C(C(C(C(C1=O)(C)O)OC(=O)C(=CC)C)O)C(=C)C(CC2C(O2)(C)C)OC(=O)C(=CC)C
|
562.60 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
[6-[5,6-Dihydroxy-6-methyl-3-(2-methylbut-2-enoyloxy)hept-1-en-2-yl]-3,5-dihydroxy-3-methyl-4-(2-methylbut-2-enoyloxy)-2-oxocyclohexyl] 2-methylbut-2-enoate
|
162945225 |
Click to see
CC=C(C)C(=O)OC1C(C(C(C(C1=O)(C)O)OC(=O)C(=CC)C)O)C(=C)C(CC(C(C)(C)O)O)OC(=O)C(=CC)C
|
580.70 |
unknown |
https://doi.org/10.1055/S-2006-957734 |
Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, (1S,4E,9R)-
|
26318 |
Click to see
CC1=CCCC(=C)C2CC(C2CC1)(C)C
|
204.35 |
unknown |
https://doi.org/10.1246/BCSJ.63.2239 |
Caryophyllene
|
5281515 |
Click to see
CC1=CCCC(=C)C2CC(C2CC1)(C)C
|
204.35 |
unknown |
https://doi.org/10.1002/CHIN.199050295 https://doi.org/10.1246/BCSJ.63.2239 |
Cloven
|
11229486 |
Click to see
CC1(C=CC23C1CCC(C2)(CCC3)C)C
|
204.35 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Abscisic acids and derivatives
|
(2Z,4E)-methyl 5-((S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoate
|
10084943 |
Click to see
CC1=CC(=O)CC(C1(C=CC(=CC(=O)OC)C)O)(C)C
|
278.34 |
unknown |
https://doi.org/10.1007/S11418-007-0156-5 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
|
(1S,6S,8aS)-8a-(hydroxymethyl)-4-methyl-6-prop-1-en-2-yl-2,3,5,6,7,8-hexahydro-1H-naphthalen-1-ol
|
162973974 |
Click to see
CC1=C2CC(CCC2(C(CC1)O)CO)C(=C)C
|
236.35 |
unknown |
https://doi.org/10.1002/HLCA.200790131 |
4-Hydroxy-1,4a-dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one
|
14681769 |
Click to see
CC1=C2CC(CCC2(C(CC1=O)O)C)C(=C)C
|
234.33 |
unknown |
https://doi.org/10.1246/BCSJ.63.2239 |
8a-(hydroxymethyl)-4-methyl-6-prop-1-en-2-yl-2,3,5,6,7,8-hexahydro-1H-naphthalen-1-ol
|
162973973 |
Click to see
CC1=C2CC(CCC2(C(CC1)O)CO)C(=C)C
|
236.35 |
unknown |
https://doi.org/10.1002/HLCA.200790131 |
Ligucyperonol
|
14681770 |
Click to see
CC1=C2CC(CCC2(C(CC1=O)O)C)C(=C)C
|
234.33 |
unknown |
https://doi.org/10.1246/BCSJ.63.2239 https://doi.org/10.1002/CHIN.199050295 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
|
(20alpha)-2alpha,3beta,23-Trihydroxytaraxastera-12,19(29)-diene-28-oic acid beta-D-glucopyranosyl ester
|
101106492 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1=C)C)C(=O)OC6C(C(C(C(O6)CO)O)O)O
|
648.80 |
unknown |
via CMAUP database |
2alpha,3beta,19alpha-Trihydroxyurs-12-en-28-oic acid (6-O-methyl-beta-D-glucopyranosyl) ester
|
101615131 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)OC6C(C(C(C(O6)COC)O)O)O
|
664.90 |
unknown |
via CMAUP database |
kaji-ichigoside F1
|
14019178 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)OC6C(C(C(C(O6)CO)O)O)O
|
650.80 |
unknown |
via CMAUP database |
Niga-ichigoside F1
|
16118969 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1(C)O)C)C(=O)OC6C(C(C(C(O6)CO)O)O)O
|
666.80 |
unknown |
via CMAUP database |
Rosamultin
|
21122581 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)OC6C(C(C(C(O6)CO)O)O)O
|
650.80 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
(-)-Butyrospermol
|
12302182 |
Click to see
CC(CCC=C(C)C)C1CCC2(C1(CCC3C2=CCC4C3(CCC(C4(C)C)O)C)C)C
|
426.70 |
unknown |
https://doi.org/10.1007/S11418-007-0156-5 |
(1R,2R,4aS,6aR,6aS,6bR,8aS,10S,11R,12aR,14bR)-1,10,11-trihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
|
93961278 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)O
|
488.70 |
unknown |
via CMAUP database |
(1R,2R,4aS,6aR,6aS,6bR,8aS,9R,10R,11R,12aR,14bS)-1,10,11-trihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
|
95223073 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1(C)O)C)C(=O)O
|
504.70 |
unknown |
via CMAUP database |
(3S,10R,13R,14R,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
|
102004740 |
Click to see
CC(CCC=C(C)C)C1CCC2(C1(CCC3C2=CCC4C3(CCC(C4(C)C)O)C)C)C
|
426.70 |
unknown |
https://doi.org/10.1007/S11418-007-0156-5 |
(3S,5R,10R,13S,14S)-17-[(1R)-1,5-dimethylhex-4-enyl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
|
472759 |
Click to see
CC(CCC=C(C)C)C1CCC2(C1(CCC3C2=CCC4C3(CCC(C4(C)C)O)C)C)C
|
426.70 |
unknown |
https://doi.org/10.1007/S11418-007-0156-5 |
19Alpha-Hydroxyasiatic Acid
|
490367 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1(C)O)C)C(=O)O
|
504.70 |
unknown |
via CMAUP database |
2alpha,3alpha,23-Trihydroxyolean-12-en-28-oic acid
|
11504083 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1)C)C(=O)O)C
|
488.70 |
unknown |
via CMAUP database |
2alpha,3beta-Dihydroxyolean-13(18)-en-28-oic acid
|
52952429 |
Click to see
CC1(CCC2(CCC3(C(=C2C1)CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C)C(=O)O)C
|
472.70 |
unknown |
via CMAUP database |
2alpha,3beta,11alpha,19alpha-Tetrahydroxyurs-12-en-28-oic acid
|
101615130 |
Click to see
CC1CCC2(CCC3(C(=CC(C4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)O)C2C1(C)O)C)C(=O)O
|
504.70 |
unknown |
via CMAUP database |
2alpha,3beta,23-Trihydroxylup-20(29)-en-28-oic acid
|
70698002 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C(=O)O
|
488.70 |
unknown |
via CMAUP database |
3beta-Hydroxy-2alpha-methoxyurs-12-en-28-oic acid
|
101615129 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)OC)C)C)C2C1C)C)C(=O)O
|
486.70 |
unknown |
via CMAUP database |
Corosolic acid
|
6918774 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)O
|
472.70 |
unknown |
via CMAUP database |
Euscaphic acid
|
471426 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)O
|
488.70 |
unknown |
via CMAUP database |
Hederagenin
|
73299 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C2C1)C)C(=O)O)C
|
472.70 |
unknown |
via CMAUP database |
Lupeol
|
259846 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C
|
426.70 |
unknown |
https://doi.org/10.1007/S11418-007-0156-5 |
Maslinic Acid
|
73659 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C
|
472.70 |
unknown |
via CMAUP database |
Methyl acuminate
|
14314584 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)OC
|
502.70 |
unknown |
via CMAUP database |
Methyl corosolate
|
14109751 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)OC
|
486.70 |
unknown |
via CMAUP database |
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 |
Rel-2alpha,3alpha,19alpha,23-tetrahydroxyolean-12-en-28-oic acid
|
52952430 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1O)C)C(=O)O)C
|
504.70 |
unknown |
via CMAUP database |
Tormentic acid
|
73193 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)O
|
488.70 |
unknown |
via CMAUP database |
Tormentic acid methyl ester
|
14314585 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)OC
|
502.70 |
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 |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 12-hydroxysteroids / 12-beta-hydroxysteroids
|
(3S)-5-[(4aS,4bR,6aR,7R,8R,9R,10aR,10bR)-8,9-dihydroxy-7-(hydroxymethyl)-4a,4b,7,10a-tetramethyl-3,4,5,6,6a,8,9,10,10b,11-decahydrochrysen-2-yl]-3-methylpentan-2-one
|
52952318 |
Click to see
CC(CCC1=CC2=CCC3C(C2(CC1)C)(CCC4C3(CC(C(C4(C)CO)O)O)C)C)C(=O)C
|
458.70 |
unknown |
via CMAUP database |
Rel-2alpha,3beta,23-trihydroxy-12,17-dien-28-norursane
|
52952319 |
Click to see
CC1CCC2=C(C1C)C3=CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)CO)O)O)C)C
|
442.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Oxosteroids
|
(2S,4aS,4bR,6aR,7R,8S,9R,10aS,10bR)-8,9-dihydroxy-7-(hydroxymethyl)-4a,4b,7,10a-tetramethyl-2-[(3S)-3-methyl-4-oxopentyl]-4,5,6,6a,8,9,10,10b-octahydro-3H-chrysene-2-carboxylic acid
|
52952320 |
Click to see
CC(CCC1(CCC2(C(=C1)C=CC3C2(CCC4C3(CC(C(C4(C)CO)O)O)C)C)C)C(=O)O)C(=O)C
|
502.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
3beta-(beta-D-Glucopyranosyloxy)stigmast-5-en-7-one
|
101615132 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2C(=O)C=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
|
590.80 |
unknown |
via CMAUP database |
Sitogluside
|
5742590 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
|
576.80 |
unknown |
via CMAUP database |
Stigmast-4-en-3-one
|
5484202 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1007/S11418-007-0156-5 |
Stigmast-4-ene-3,6-dione
|
5490007 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC(=O)C4=CC(=O)CCC34C)C)C(C)C
|
426.70 |
unknown |
https://doi.org/10.1007/S11418-007-0156-5 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
|
(1R,4Z,6S,7S)-7-acetyloxy-4-ethenyl-6,7,14-trimethyl-3,8-dioxo-2,9-dioxa-14-azoniatricyclo[9.5.1.014,17]heptadeca-4,11-dien-17-olate
|
21606566 |
Click to see
CC1C=C(C(=O)OC2CC[N+]3(C2(C(=CC3)COC(=O)C1(C)OC(=O)C)[O-])C)C=C
|
405.40 |
unknown |
via CMAUP database |
(1S,4Z,6R,7R,17R)-7-acetyloxy-4-ethenyl-6,7,14-trimethyl-3,8-dioxo-2,9-dioxa-14-azoniatricyclo[9.5.1.014,17]heptadeca-4,11-dien-17-olate
|
133645845 |
Click to see
CC1C=C(C(=O)OC2CC[N+]3(C2(C(=CC3)COC(=O)C1(C)OC(=O)C)[O-])C)C=C
|
405.40 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
(4-Ethenyl-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadeca-4,11-dien-7-yl) acetate
|
5090286 |
Click to see
CC1C=C(C(=O)OC2CCN(CC=C(C2=O)COC(=O)C1(C)OC(=O)C)C)C=C
|
405.40 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
(4-Ethylidene-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl) acetate
|
526538 |
Click to see
CC=C1CC(C(C(=O)OCC2=CCN(CCC(C2=O)OC1=O)C)(C)OC(=O)C)C
|
407.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
[(1R,4E,6S,7R,11Z)-4-ethylidene-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl] acetate
|
163194992 |
Click to see
CC=C1CC(C(C(=O)OCC2=CCN(CCC(C2=O)OC1=O)C)(C)OC(=O)C)C
|
407.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
[(1R,4E,6S,7R)-4-ethylidene-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl] acetate
|
162935498 |
Click to see
CC=C1CC(C(C(=O)OCC2=CCN(CCC(C2=O)OC1=O)C)(C)OC(=O)C)C
|
407.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
[(1R,4E,6S,7S,11Z)-4-ethylidene-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl] acetate
|
134714986 |
Click to see
CC=C1CC(C(C(=O)OCC2=CCN(CCC(C2=O)OC1=O)C)(C)OC(=O)C)C
|
407.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
[(1R,4Z,6S,7S,11Z)-4-ethylidene-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl] acetate
|
134714982 |
Click to see
CC=C1CC(C(C(=O)OCC2=CCN(CCC(C2=O)OC1=O)C)(C)OC(=O)C)C
|
407.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
[(1R,4Z,6S,7S)-4-ethylidene-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl] acetate
|
162935496 |
Click to see
CC=C1CC(C(C(=O)OCC2=CCN(CCC(C2=O)OC1=O)C)(C)OC(=O)C)C
|
407.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
Clivoline
|
5284370 |
Click to see
CC1C=C(C(=O)OC2CCN(CC=C(C2=O)COC(=O)C1(C)OC(=O)C)C)C=C
|
405.40 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
Clivorine
|
5363807 |
Click to see
CC1C=C(C(=O)OC2CC[N+]3(C2(C(=CC3)COC(=O)C1(C)OC(=O)C)O)C)C=C
|
406.40 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
Ligularidine
|
6440207 |
Click to see
CC=C1CC(C(C(=O)OCC2=CCN(CCC(C2=O)OC1=O)C)(C)OC(=O)C)C
|
407.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
methyl (2S,4S,5R)-5-acetyloxy-2-[(1R)-1-methoxyethyl]-4,5-dimethyl-6-oxooxane-2-carboxylate
|
163023815 |
Click to see
CC1CC(OC(=O)C1(C)OC(=O)C)(C(C)OC)C(=O)OC
|
302.32 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
Methyl 5-acetyloxy-2-(1-methoxyethyl)-4,5-dimethyl-6-oxooxane-2-carboxylate
|
163023814 |
Click to see
CC1CC(OC(=O)C1(C)OC(=O)C)(C(C)OC)C(=O)OC
|
302.32 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
Neoligularidine
|
6440920 |
Click to see
CC=C1CC(C(C(=O)OCC2=CCN(CCC(C2=O)OC1=O)C)(C)OC(=O)C)C
|
407.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
|
2-(beta-D-Glucopyranosyloxy)-5-[(6S)-6,7-dihydroxy-3,7-dimethyl-2-octenyl]benzoic acid methyl ester
|
71660038 |
Click to see
CC(=CCC1=CC(=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CCC(C(C)(C)O)O
|
484.50 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Azaspirodecane derivatives
|
[(1R,3'R,4R,6R,7S,11Z)-3',6,7,14-tetramethyl-3,8,17-trioxospiro[2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-4,2'-oxirane]-7-yl] acetate
|
20839444 |
Click to see
CC1CC2(C(O2)C)C(=O)OC3CCN(CC=C(C3=O)COC(=O)C1(C)OC(=O)C)C
|
423.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
[(1R,3'R,4R,6R,7S)-3',6,7,14-tetramethyl-3,8,17-trioxospiro[2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-4,2'-oxirane]-7-yl] acetate
|
163004270 |
Click to see
CC1CC2(C(O2)C)C(=O)OC3CCN(CC=C(C3=O)COC(=O)C1(C)OC(=O)C)C
|
423.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
[(1R,3'R,4S,6R,7S,11Z)-3',6,7,14-tetramethyl-3,8,17-trioxospiro[2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-4,2'-oxirane]-7-yl] acetate
|
100925968 |
Click to see
CC1CC2(C(O2)C)C(=O)OC3CCN(CC=C(C3=O)COC(=O)C1(C)OC(=O)C)C
|
423.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
Florosenine
|
73717529 |
Click to see
CC1CC2(C(O2)C)C(=O)OC3CCN(CC=C(C3=O)COC(=O)C1(C)OC(=O)C)C
|
423.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
Ligularizine
|
6440921 |
Click to see
CC1CC2(C(O2)C)C(=O)OC3CCN(CC=C(C3=O)COC(=O)C1(C)OC(=O)C)C
|
423.50 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
> Organoheterocyclic compounds / Benzofurans
|
[(2R,3aS,4R,7aS)-2-[(2S)-3-hydroxy-3-methyl-2-[(Z)-2-methylbut-2-enoyl]oxybutyl]-7a-methoxy-6-methyl-3-methylidene-7-oxo-3a,4-dihydro-1-benzofuran-4-yl] (Z)-2-methylbut-2-enoate
|
163030601 |
Click to see
CC=C(C)C(=O)OC1C=C(C(=O)C2(C1C(=C)C(O2)CC(C(C)(C)O)OC(=O)C(=CC)C)OC)C
|
476.60 |
unknown |
https://doi.org/10.1002/HLCA.200790131 |
[2-[3-Hydroxy-3-methyl-2-(2-methylbut-2-enoyloxy)butyl]-7a-methoxy-6-methyl-3-methylidene-7-oxo-3a,4-dihydro-1-benzofuran-4-yl] 2-methylbut-2-enoate
|
163030600 |
Click to see
CC=C(C)C(=O)OC1C=C(C(=O)C2(C1C(=C)C(O2)CC(C(C)(C)O)OC(=O)C(=CC)C)OC)C
|
476.60 |
unknown |
https://doi.org/10.1002/HLCA.200790131 |
> Organoheterocyclic compounds / Benzofurans / Benzofuranones
|
2-Hydroxplatyphyllide
|
14681767 |
Click to see
CC(=C)C1CCC2=C3C1OC(=O)C3=CC(=C2)O
|
230.26 |
unknown |
https://doi.org/10.1246/BCSJ.63.2239 https://doi.org/10.1016/S0031-9422(97)00493-7 |
2-Hydroxyplatyphyllide
|
14681768 |
Click to see
CC(=C)C1CCC2=C3C1OC(=O)C3=CC(=C2)O
|
230.26 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00894-7 |
4-Hydroxy-3-(1-methylethylidene)-6,7,8,8a-tetrahydro-1-oxaacenaphthylen-2-one
|
14681766 |
Click to see
CC(=C)C1CCC2=C3C1OC(=O)C3=CC(=C2)O
|
230.26 |
unknown |
https://doi.org/10.1246/BCSJ.63.2239 https://doi.org/10.1016/S0031-9422(97)00493-7 |
> Organoheterocyclic compounds / Benzoxepines
|
[(2S,4R)-7,9-dihydroxy-2-(2-hydroxypropan-2-yl)-8-methyl-5-methylidene-3,4-dihydro-2H-1-benzoxepin-4-yl] (Z)-2-methylbut-2-enoate
|
162893319 |
Click to see
CC=C(C)C(=O)OC1CC(OC2=C(C(=C(C=C2C1=C)O)C)O)C(C)(C)O
|
362.40 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
[(7S,9R)-5-hydroxy-7-(2-hydroxypropan-2-yl)-4-methyl-10-methylidene-8,9-dihydro-7H-oxepino[2,3-g][1,3]benzothiazol-9-yl] (Z)-2-methylbut-2-enoate
|
163095042 |
Click to see
CC=C(C)C(=O)OC1CC(OC2=C(C(=C3C(=C2C1=C)SC=N3)C)O)C(C)(C)O
|
403.50 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
[5-hydroxy-7-(2-hydroxypropan-2-yl)-4-methyl-10-methylidene-8,9-dihydro-7H-oxepino[2,3-g][1,3]benzothiazol-9-yl] 2-methylbut-2-enoate
|
163095040 |
Click to see
CC=C(C)C(=O)OC1CC(OC2=C(C(=C3C(=C2C1=C)SC=N3)C)O)C(C)(C)O
|
403.50 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
[7,9-dihydroxy-2-(2-hydroxypropan-2-yl)-8-methyl-5-methylidene-3,4-dihydro-2H-1-benzoxepin-4-yl] 2-methylbut-2-enoate
|
162893317 |
Click to see
CC=C(C)C(=O)OC1CC(OC2=C(C(=C(C=C2C1=C)O)C)O)C(C)(C)O
|
362.40 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
> Organoheterocyclic compounds / Indoles and derivatives / Indolecarboxylic acids and derivatives
|
Methyl indole-3-carboxylate
|
589098 |
Click to see
COC(=O)C1=CNC2=CC=CC=C21
|
175.18 |
unknown |
https://doi.org/10.1007/S11418-007-0156-5 |
> Organoheterocyclic compounds / Lactones / Delta valerolactones
|
2,3alpha-Dimethyl-5-[(E)-ethylidene]-6-oxotetrahydro-2H-pyran-2alpha-carboxylic acid methyl ester
|
10889206 |
Click to see
CC=C1CC(C(OC1=O)(C)C(=O)OC)C
|
212.24 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
Methyl 5-ethylidene-2,3-dimethyl-6-oxooxane-2-carboxylate
|
85303809 |
Click to see
CC=C1CC(C(OC1=O)(C)C(=O)OC)C
|
212.24 |
unknown |
https://doi.org/10.1002/HLCA.200790086 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
|
Methyl ferulate
|
5357283 |
Click to see
COC1=C(C=CC(=C1)C=CC(=O)OC)O
|
208.21 |
unknown |
https://doi.org/10.1007/S11418-007-0156-5 |
> 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 |
https://doi.org/10.1007/S11418-007-0156-5 |
Ferulic acid
|
445858 |
Click to see
COC1=C(C=CC(=C1)C=CC(=O)O)O
|
194.18 |
unknown |
https://doi.org/10.1007/S11418-007-0156-5 |
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
|
Procyanidin B3
|
146798 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O
|
578.50 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
|
(+)-Epicatechin
|
182232 |
Click to see
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
|
290.27 |
unknown |
via CMAUP database |
Cianidanol
|
9064 |
Click to see
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
|
290.27 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Macrolides and analogues
|
(1R,4E,7R,11S,17R)-4-ethylidene-7-hydroxy-6,7-dimethyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadecane-3,8-dione
|
133568461 |
Click to see
CC=C1CC(C(C(=O)OCC2CCN3C2C(CC3)OC1=O)(C)O)C
|
337.40 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
(1R,4Z,6R,7S,11S,17R)-4-ethylidene-7-hydroxy-6,7-dimethyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadecane-3,8-dione
|
6347543 |
Click to see
CC=C1CC(C(C(=O)OCC2CCN3C2C(CC3)OC1=O)(C)O)C
|
337.40 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
Hastacine
|
163587 |
Click to see
CC=C1CC(C(C(=O)OCC2CCN3C2C(CC3)OC1=O)(C)O)C
|
337.40 |
unknown |
https://doi.org/10.1248/CPB.32.475 |
> Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins
|
2-[2,3-Dihydroxy-5-[[[2-O,3-O-[[(aS)-4,4',5,5',6,6'-hexahydroxy-1,1'-biphenyl-2,2'-diyl]dicarbonyl]-alpha-D-glucopyranosyl]oxy]carbonyl]phenoxy]-3,4,5-trihydroxybenzoyl 2-O,3-O:4-O,6-O-bis[[4,4',5,5',6,6'-hexahydroxy-1,1'-biphenyl-2,2'-diyl]dicarbonyl]-alpha-D-glucopyranoside
|
16138866 |
Click to see
C1C2C(C3C(C(O2)OC(=O)C4=CC(=C(C(=C4OC5=CC(=CC(=C5O)O)C(=O)OC6C7C(C(C(O6)CO)O)OC(=O)C8=CC(=C(C(=C8C9=C(C(=C(C=C9C(=O)O7)O)O)O)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O3)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O1)O)O)O)O)O)O
|
1569.10 |
unknown |
via CMAUP database |
4'-O-Arabinofuranosylellagic acid
|
101129362 |
Click to see
C1=C2C3=C(C(=C1O)O)OC(=O)C4=CC(=C(C(=C43)OC2=O)O)OC5C(C(C(O5)CO)O)O
|
434.30 |
unknown |
via CMAUP database |
Agrimoniin
|
16129621 |
Click to see
C1C2C(C3C(C(O2)OC(=O)C4=CC(=C(C(=C4)OC5=C(C(=C(C=C5C(=O)OC6C7C(C8C(O6)COC(=O)C9=CC(=C(C(=C9C2=C(C(=C(C=C2C(=O)O8)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O7)O)O)O)O)O)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O3)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O1)O)O)O)O)O)O
|
1871.30 |
unknown |
via CMAUP database |
alpha-Pedunculagin
|
13834142 |
Click to see
C1C2C(C3C(C(O2)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O3)O)O)O)O)O)O)OC(=O)C6=CC(=C(C(=C6C7=C(C(=C(C=C7C(=O)O1)O)O)O)O)O)O
|
784.50 |
unknown |
via CMAUP database |
Casuarictin
|
73644 |
Click to see
C1C2C(C3C(C(O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O3)O)O)O)O)O)O)OC(=O)C7=CC(=C(C(=C7C8=C(C(=C(C=C8C(=O)O1)O)O)O)O)O)O
|
936.60 |
unknown |
via CMAUP database |
Ellagic Acid
|
5281855 |
Click to see
C1=C2C3=C(C(=C1O)O)OC(=O)C4=CC(=C(C(=C43)OC2=O)O)O
|
302.19 |
unknown |
via CMAUP database |
Laevigatin A
|
14374737 |
Click to see
C1=C(C=C(C(=C1O)O)OC2=C(C(=C(C=C2C(=O)O)O)O)O)C(=O)OC3C4C(C(C(O3)CO)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O4)O)O)O)O)O)O
|
802.60 |
unknown |
via CMAUP database |
Laevigatin C
|
16169194 |
Click to see
C1C2C(C3C(C(O2)OC(=O)C4=CC(=C(C(=C4)OC5=C(C(=C(C=C5C(=O)OC6C7C(C(C(O6)CO)O)OC(=O)C8=CC(=C(C(=C8C9=C(C(=C(C=C9C(=O)O7)O)O)O)O)O)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O3)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O1)O)O)O)O)O)O
|
1569.10 |
unknown |
via CMAUP database |
Laevigatin F
|
16182828 |
Click to see
C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3OC4=CC(=CC(=C4O)O)C(=O)OC5C6C(C7C(O5)COC(=O)C8=CC(=C(C(=C8C9=C(C(=C(C=C9C(=O)O7)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O6)O)O)O)O)O)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O1)O)O)O)O)O)O
|
1569.10 |
unknown |
via CMAUP database |
Potentillin
|
5315734 |
Click to see
C1C2C(C3C(C(O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O3)O)O)O)O)O)O)OC(=O)C7=CC(=C(C(=C7C8=C(C(=C(C=C8C(=O)O1)O)O)O)O)O)O
|
936.60 |
unknown |
via CMAUP database |
Sanguiin H-4
|
13917514 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OC2C3C(C(C(O2)CO)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O3)O)O)O)O)O)O
|
634.50 |
unknown |
via CMAUP database |