> Benzenoids / Phenols / Methoxyphenols
|
Coniferyl Alcohol
|
1549095 |
Click to see
COC1=C(C=CC(=C1)C=CCO)O
|
180.20 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
> Lignans, neolignans and related compounds / Furanoid lignans
|
(+/-)-Pinoresinol
|
234817 |
Click to see
COC1=C(C=CC(=C1)C2C3COC(C3CO2)C4=CC(=C(C=C4)O)OC)O
|
358.40 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
(1R,2S)-2-[4-[(3R,3aR,6R,6aS)-3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenoxy]-1-(4-hydroxy-3-methoxyphenyl)propane-1,3-diol
|
162891019 |
Click to see
COC1=CC(=CC(=C1OC(CO)C(C2=CC(=C(C=C2)O)OC)O)OC)C3C4COC(C4CO3)C5=CC(=C(C=C5)O)OC
|
584.60 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
2-[4-[(3aS,6aR)-6-[4-[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy-3,5-dimethoxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2,6-dimethoxyphenoxy]-1-(4-hydroxy-3-methoxyphenyl)propane-1,3-diol
|
137705295 |
Click to see
COC1=CC(=CC(=C1OC(CO)C(C2=CC(=C(C=C2)O)OC)O)OC)C3C4COC(C4CO3)C5=CC(=C(C(=C5)OC)OC(CO)C(C6=CC(=C(C=C6)O)OC)O)OC
|
810.80 |
unknown |
https://doi.org/10.1248/CPB.32.5066 |
4-[3-(4-Hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenol
|
4546425 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C=C4)O)OC
|
388.40 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
buddlenol E
|
50909266 |
Click to see
COC1=CC(=CC(=C1OC(CO)C(C2=CC(=C(C=C2)O)OC)O)OC)C3C4COC(C4CO3)C5=CC(=C(C=C5)O)OC
|
584.60 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
Hedyotisol B
|
15628159 |
Click to see
COC1=CC(=CC(=C1OC(CO)C(C2=CC(=C(C=C2)O)OC)O)OC)C3C4COC(C4CO3)C5=CC(=C(C(=C5)OC)OC(CO)C(C6=CC(=C(C=C6)O)OC)O)OC
|
810.80 |
unknown |
https://doi.org/10.1248/CPB.32.5066 |
Hedyotol C
|
21636185 |
Click to see
COC1=CC(=CC(=C1OC(CO)C(C2=CC(=C(C=C2)O)OC)O)OC)C3C4COC(C4CO3)C5=CC(=C(C=C5)O)OC
|
584.60 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
Medioresinol
|
181681 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C=C4)O)OC
|
388.40 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
Pinoresinol
|
73399 |
Click to see
COC1=C(C=CC(=C1)C2C3COC(C3CO2)C4=CC(=C(C=C4)O)OC)O
|
358.40 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
Syringaresinol
|
100067 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC
|
418.40 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
Syringaresinol, (+)-
|
443023 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC
|
418.40 |
unknown |
https://doi.org/10.1248/CPB.32.5066 https://doi.org/10.1248/CPB.33.1444 |
> Lipids and lipid-like molecules / Fatty Acyls / Eicosanoids / Prostaglandins and related compounds
|
(5Z)-9,15-Dioxoprosta-5,8(12)-diene-1-oic acid methyl ester
|
21609756 |
Click to see
CCCCCC(=O)CCC1=C(C(=O)CC1)CC=CCCCC(=O)OC
|
348.50 |
unknown |
via CMAUP database |
methyl (Z)-7-[2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopenten-1-yl]hept-5-enoate
|
21160888 |
Click to see
CCCCCC(C=CC1=C(C(=O)CC1)CC=CCCCC(=O)OC)O
|
348.50 |
unknown |
via CMAUP database |
prostaglandin B2
|
5280881 |
Click to see
CCCCCC(C=CC1=C(C(=O)CC1)CC=CCCCC(=O)O)O
|
334.40 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
|
Arachidonic Acid
|
444899 |
Click to see
CCCCCC=CCC=CCC=CCC=CCCCC(=O)O
|
304.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Cembrane diterpenoids
|
2-[(1R,4E,6E,10E,14R)-4,10,14-trimethyl-15-oxabicyclo[12.1.0]pentadeca-4,6,10-trien-7-yl]propan-2-ol
|
23247586 |
Click to see
CC1=CCCC2(C(O2)CCC(=CC=C(CC1)C(C)(C)O)C)C
|
304.50 |
unknown |
via CMAUP database |
dimethyl (1S,4E,6Z,10Z,14S)-14-methyl-7-propan-2-yl-15-oxabicyclo[12.1.0]pentadeca-4,6,10-triene-4,10-dicarboxylate
|
16091634 |
Click to see
CC(C)C1=CC=C(CCC2C(O2)(CCC=C(CC1)C(=O)OC)C)C(=O)OC
|
376.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
Secogorgosterol
|
386853 |
Click to see
CC(C)C(C)C1(CC1C(C)C2CCC(C2(C)CCO)C3CC=C4CC(CCC4(C3=O)C)O)C
|
458.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Diterpene glycosides
|
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aR,5S,6R,8aS)-5,6,8a-trimethyl-5-[2-(5-oxo-2H-furan-3-yl)ethyl]-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylate
|
44477937 |
Click to see
CC1CCC2(C(C1(C)CCC3=CC(=O)OC3)CCC=C2C(=O)OC4C(C(C(C(O4)COC5C(C(CO5)(CO)O)O)O)O)O)C
|
626.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
|
methyl (1S,2S,5E,7E)-2-acetyloxy-1-methyl-16-oxo-8-propan-2-yl-15-oxabicyclo[9.3.2]hexadeca-5,7,11-triene-5-carboxylate
|
16059808 |
Click to see
CC(C)C1=CC=C(CCC(C2(CCC=C(CC1)C(=O)O2)C)OC(=O)C)C(=O)OC
|
404.50 |
unknown |
via CMAUP database |
Sarcrassin E
|
16091635 |
Click to see
CC(C)C1=CC=C(CCC(=O)C2(CCC=C(CC1)C(=O)O2)C)C(=O)OC
|
360.40 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones / Cembranolides
|
Crassocolide B
|
11995280 |
Click to see
CC1=CCCC(C(CC2C(C(C(=CCC1)C)OC(=O)C)OC(=O)C2=C)OC(=O)C)(C)O
|
434.50 |
unknown |
via CMAUP database |
Crassocolide C
|
11995174 |
Click to see
CC1=CCCC(C(CC2C(CC(=CCC1)C)OC(=O)C2=C)OC(=O)C)(C)O
|
376.50 |
unknown |
via CMAUP database |
Crassocolide D
|
11995281 |
Click to see
CC1=CCCC(C(CC2C(CC(=CCC1)C)OC(=O)C2=C)O)(C)O
|
334.40 |
unknown |
via CMAUP database |
Crassolide A
|
11995173 |
Click to see
CC1=CCCC(C(CC2C(C(C(=CCC1)C)OC(=O)C)OC(=O)C2=C)O)(C)O
|
392.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
(4aS,6aS,6bR,8S,10S,12aR)-8,10-dihydroxy-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
|
86574170 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CC(C5C4(CCC(C5(C)C)O)C)O)C)C2C1)C)C(=O)O)C
|
472.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
(4aS,6bR,8R,10S,12aR)-8,10-dihydroxy-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
|
5321562 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CC(C5C4(CCC(C5(C)C)O)C)O)C)C2C1)C)C(=O)O)C
|
472.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
[(1R,3aS,5aS,5bR,7aR,9S,11aR,11bR,13bS)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13b-tetradecahydrocyclopenta[a]chrysen-9-yl] acetate
|
163189057 |
Click to see
CC(=C)C1CCC2(C1C3=CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)OC(=O)C)C)CO
|
482.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
[3a-(Hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13b-tetradecahydrocyclopenta[a]chrysen-9-yl] acetate
|
162971082 |
Click to see
CC(=C)C1CCC2(C1C3=CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)OC(=O)C)C)CO
|
482.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
2,24-Dihydroxyursolic acid
|
69570833 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)O
|
488.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
24-Hydroxyursolic Acid
|
44568920 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C2C1C)C)C(=O)O
|
472.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
3-Hydroxyolean-12-en-28-oic acid
|
619166 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
3-Oxo-12-ursen-28-oic acid
|
13893949 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1C)C)C(=O)O
|
454.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
3-Oxo-olean-12-en-28-oic acid
|
12313702 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1)C)C(=O)O)C
|
454.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
3Alpha-Hydroxyurs-12-En-28-Oic Acid
|
7163177 |
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/10.1248/CPB.32.3906 |
Arjunolic acid
|
73641 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1)C)C(=O)O)C
|
488.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Asiatic Acid
|
119034 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)O
|
488.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Benthamic acid methyl ester
|
601647 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1(C)O)C)C(=O)OC
|
486.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
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/10.1248/CPB.32.3906 |
Betulin
|
72326 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)CO
|
442.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Betulinic Acid
|
64971 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O
|
456.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
CID 3838010
|
3838010 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1(C)O)C)C(=O)O
|
472.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
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 |
https://doi.org/10.1248/CPB.32.3906 |
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 |
https://doi.org/10.1248/CPB.32.3906 |
Hederagenin
|
73299 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C2C1)C)C(=O)O)C
|
472.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (1R,2R,4aS,6aR,6aS,6bR,8aR,10S,11R,12aR,14bS)-10,11-diacetyloxy-1-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
102240517 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)OC(=O)C)OC(=O)C)C)C)C2C1(C)O)C)C(=O)OC
|
586.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (1R,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-1,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
457300 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1(C)O)C)C(=O)OC
|
486.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (1R,3aS,5aS,5bR,7aR,9S,11aR,11bR,13bS)-9-acetyloxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13b-tetradecahydrocyclopenta[a]chrysene-3a-carboxylate
|
162929111 |
Click to see
CC(=C)C1CCC2(C1C3=CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)OC(=O)C)C)C(=O)OC
|
510.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (1S,2R,4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-10,11-diacetyloxy-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-carboxylate
|
14313547 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)OC(=O)C)OC(=O)C)C)C)C2C1C)C)C(=O)OC
|
570.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (1S,2R,4aS,6aR,6aS,6bR,8aR,10S,11R,12aR,14bS)-10,11-diacetyloxy-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-carboxylate
|
21629442 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)OC(=O)C)OC(=O)C)C)C)C2C1C)C)C(=O)OC
|
570.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (1S,2R,4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-10,11-diacetyloxy-9-(acetyloxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate
|
163067561 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)COC(=O)C)OC(=O)C)OC(=O)C)C)C)C2C1C)C)C(=O)OC
|
628.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (1S,2R,4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-acetyloxy-9-(acetyloxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate
|
13890859 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)COC(=O)C)OC(=O)C)C)C)C2C1C)C)C(=O)OC
|
570.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (1S,2R,4aS,6aR,6aS,6bR,8aR,9S,10R,11R,12aR,14bS)-10,11-diacetyloxy-9-(acetyloxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate
|
163067562 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)COC(=O)C)OC(=O)C)OC(=O)C)C)C)C2C1C)C)C(=O)OC
|
628.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (1S,2R,4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-10-acetyloxy-9-(acetyloxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate
|
13890860 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)COC(=O)C)OC(=O)C)C)C)C2C1C)C)C(=O)OC
|
570.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-10,11-diacetyloxy-9-(acetyloxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
21594189 |
Click to see
CC(=O)OCC1(C2CCC3(C(C2(CC(C1OC(=O)C)OC(=O)C)C)CC=C4C3(CCC5(C4CC(CC5)(C)C)C(=O)OC)C)C)C
|
628.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-acetyloxy-9-(acetyloxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
21594160 |
Click to see
CC(=O)OCC1(C2CCC3(C(C2(CCC1OC(=O)C)C)CC=C4C3(CCC5(C4CC(CC5)(C)C)C(=O)OC)C)C)C
|
570.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl (4aS,6aR,6aS,6bR,8S,8aR,10S,12aR,14bS)-10-acetyloxy-8-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
162978140 |
Click to see
CC(=O)OC1CCC2(C3CC=C4C5CC(CCC5(CCC4(C3(CC(C2C1(C)C)O)C)C)C(=O)OC)(C)C)C
|
528.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Methyl 10-acetyloxy-8-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
162978139 |
Click to see
CC(=O)OC1CCC2(C3CC=C4C5CC(CCC5(CCC4(C3(CC(C2C1(C)C)O)C)C)C(=O)OC)(C)C)C
|
528.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl 10-acetyloxy-9-(acetyloxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate
|
13890857 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)COC(=O)C)OC(=O)C)C)C)C2C1C)C)C(=O)OC
|
570.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Methyl 10-acetyloxy-9-(acetyloxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
14191855 |
Click to see
CC(=O)OCC1(C2CCC3(C(C2(CCC1OC(=O)C)C)CC=C4C3(CCC5(C4CC(CC5)(C)C)C(=O)OC)C)C)C
|
570.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Methyl 10,11-diacetyloxy-1-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
14314587 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)OC(=O)C)OC(=O)C)C)C)C2C1(C)O)C)C(=O)OC
|
586.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl 10,11-diacetyloxy-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-carboxylate
|
14313542 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)OC(=O)C)OC(=O)C)C)C)C2C1C)C)C(=O)OC
|
570.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
methyl 10,11-diacetyloxy-9-(acetyloxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate
|
15602006 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)COC(=O)C)OC(=O)C)OC(=O)C)C)C)C2C1C)C)C(=O)OC
|
628.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Methyl 10,11-diacetyloxy-9-(acetyloxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
13918373 |
Click to see
CC(=O)OCC1(C2CCC3(C(C2(CC(C1OC(=O)C)OC(=O)C)C)CC=C4C3(CCC5(C4CC(CC5)(C)C)C(=O)OC)C)C)C
|
628.80 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Methyl 3-hydroxyurs-12-en-28-oate
|
621719 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)OC
|
470.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Methyl 9-acetyloxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13b-tetradecahydrocyclopenta[a]chrysene-3a-carboxylate
|
162929110 |
Click to see
CC(=C)C1CCC2(C1C3=CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)OC(=O)C)C)C(=O)OC
|
510.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Methyl Ursolate
|
636516 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)OC
|
470.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Oleanolic Acid
|
10494 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
Oleanonic acid
|
12313704 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1)C)C(=O)O)C
|
454.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
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 |
https://doi.org/10.1248/CPB.32.3906 |
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/10.1248/CPB.32.3906 |
Ursonic Acid
|
9890209 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1C)C)C(=O)O
|
454.70 |
unknown |
https://doi.org/10.1248/CPB.32.3906 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
|
(3S,5R,6R,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5,6-triol
|
44558918 |
Click to see
CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC(C4(C3(CCC(C4)O)C)O)O)C
|
434.70 |
unknown |
via CMAUP database |
25-Acetoxy-ergosta-3beta,5alpha,6beta-triol
|
14034721 |
Click to see
CC(CCC(C)C(C)(C)OC(=O)C)C1CCC2C1(CCC3C2CC(C4(C3(CCC(C4)O)C)O)O)C
|
492.70 |
unknown |
via CMAUP database |
Campesterol
|
173183 |
Click to see
CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
|
400.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Furospirostanes and derivatives
|
(1S,2S,3'S,4S,6R,7R,8R,9S,12S,13R,16S)-2',2',3',7,9,13-hexamethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,5'-oxolane]-7,16-diol
|
101007150 |
Click to see
CC1CC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)(C)O)OC1(C)C
|
444.60 |
unknown |
via CMAUP database |
(1S,2S,3'S,4S,6S,7R,8R,9S,12S,13R,16S)-2',2',3',7,9,13-hexamethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,5'-oxolane]-7,16-diol
|
54586888 |
Click to see
CC1CC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)(C)O)OC1(C)C
|
444.60 |
unknown |
via CMAUP database |
(22R,24S)-24-Methyl-22,25-epoxyfurosta-5-ene-3beta,20-diol 3-acetate
|
101007149 |
Click to see
CC1CC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC(=O)C)C)C)(C)O)OC1(C)C
|
486.70 |
unknown |
via CMAUP database |
[(1S,2S,3'S,4S,6S,7R,8R,9S,12S,13R,16S)-7-hydroxy-2',2',3',7,9,13-hexamethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,5'-oxolane]-16-yl] acetate
|
101007148 |
Click to see
CC1CC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC(=O)C)C)C)(C)O)OC1(C)C
|
486.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Gorgostanes and derivatives
|
11alpha-Hydroxygorgosterol
|
10599347 |
Click to see
CC(C)C(C)C1(CC1C(C)C2CCC3C2(CC(C4C3CC=C5C4(CCC(C5)O)C)O)C)C
|
442.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives
|
Pregnenolone
|
8955 |
Click to see
CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
|
316.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
24-Propylidenecholest-5-en-3beta-ol
|
193212 |
Click to see
CCC=C(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
426.70 |
unknown |
via CMAUP database |
Fucosterol
|
5281328 |
Click to see
CC=C(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
412.70 |
unknown |
via CMAUP database |
Isofucosterol
|
5281326 |
Click to see
CC=C(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
412.70 |
unknown |
via CMAUP database |
> Organic acids and derivatives / Carboxylic acids and derivatives / Hexacarboxylic acids and derivatives
|
[(2S,3R)-2-[4-[(3R,3aS,6R,6aS)-6-[4-[(1R,2S)-1,3-diacetyloxy-1-(4-acetyloxy-3-methoxyphenyl)propan-2-yl]oxy-3,5-dimethoxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2,6-dimethoxyphenoxy]-3-acetyloxy-3-(4-acetyloxy-3-methoxyphenyl)propyl] acetate
|
162961503 |
Click to see
CC(=O)OCC(C(C1=CC(=C(C=C1)OC(=O)C)OC)OC(=O)C)OC2=C(C=C(C=C2OC)C3C4COC(C4CO3)C5=CC(=C(C(=C5)OC)OC(COC(=O)C)C(C6=CC(=C(C=C6)OC(=O)C)OC)OC(=O)C)OC)OC
|
1063.10 |
unknown |
https://doi.org/10.1248/CPB.32.5066 |
[(2S,3R)-2-[4-[(3R,3aS,6R,6aS)-6-[4-[(1S,2S)-1,3-diacetyloxy-1-(4-acetyloxy-3-methoxyphenyl)propan-2-yl]oxy-3,5-dimethoxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2,6-dimethoxyphenoxy]-3-acetyloxy-3-(4-acetyloxy-3-methoxyphenyl)propyl] acetate
|
162961502 |
Click to see
CC(=O)OCC(C(C1=CC(=C(C=C1)OC(=O)C)OC)OC(=O)C)OC2=C(C=C(C=C2OC)C3C4COC(C4CO3)C5=CC(=C(C(=C5)OC)OC(COC(=O)C)C(C6=CC(=C(C=C6)OC(=O)C)OC)OC(=O)C)OC)OC
|
1063.10 |
unknown |
https://doi.org/10.1248/CPB.32.5066 |
[(2S,3S)-2-[4-[(3R,3aS,6R,6aS)-6-[4-[(1S,2S)-1,3-diacetyloxy-1-(4-acetyloxy-3-methoxyphenyl)propan-2-yl]oxy-3,5-dimethoxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2,6-dimethoxyphenoxy]-3-acetyloxy-3-(4-acetyloxy-3-methoxyphenyl)propyl] acetate
|
162961501 |
Click to see
CC(=O)OCC(C(C1=CC(=C(C=C1)OC(=O)C)OC)OC(=O)C)OC2=C(C=C(C=C2OC)C3C4COC(C4CO3)C5=CC(=C(C(=C5)OC)OC(COC(=O)C)C(C6=CC(=C(C=C6)OC(=O)C)OC)OC(=O)C)OC)OC
|
1063.10 |
unknown |
https://doi.org/10.1248/CPB.32.5066 |
[3-Acetoxy-2-[4-[6-[4-[2-acetoxy-2-(4-acetoxy-3-methoxy-phenyl)-1-(acetoxymethyl)ethoxy]-3,5-dimethoxy-phenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2,6-dimethoxy-phenoxy]-3-(4-acetoxy-3-methoxy-phenyl)propyl] acetate
|
50909247 |
Click to see
CC(=O)OCC(C(C1=CC(=C(C=C1)OC(=O)C)OC)OC(=O)C)OC2=C(C=C(C=C2OC)C3C4COC(C4CO3)C5=CC(=C(C(=C5)OC)OC(COC(=O)C)C(C6=CC(=C(C=C6)OC(=O)C)OC)OC(=O)C)OC)OC
|
1063.10 |
unknown |
https://doi.org/10.1248/CPB.32.5066 |
> Organoheterocyclic compounds / Dihydrofurans
|
(1R,2E,6R,8S,11E)-3,8,12,16-tetramethyl-7,18-dioxatricyclo[13.3.0.06,8]octadeca-2,11,15-triene
|
54585297 |
Click to see
CC1=CCCC2(C(O2)CCC(=CC3C(=C(CO3)C)CC1)C)C
|
302.50 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
|
Sarcocrassocolide A
|
70691856 |
Click to see
CC1=CCCC(=C)C2CCC(O2)(C(CC3C(C1OC(=O)C)OC(=O)C3=C)O)C
|
390.50 |
unknown |
via CMAUP database |
Sarcocrassocolide B
|
70696020 |
Click to see
CC1=CCCC(=C)C2CCC(O2)(C(CC3C(C1OC(=O)C)OC(=O)C3=C)O)C
|
390.50 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
|
(+)-Dehydrodiconiferyl alcohol
|
11824478 |
Click to see
COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)C=CCO
|
358.40 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
4-[(3S,3aR,6S,6aR)-3-[(2S,3S)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenol
|
162862877 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC5=C(C(=C4)OC)OC(C5CO)C6=CC(=C(C=C6)O)OC
|
566.60 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
4-[(3S,3aS,6S,6aS)-6-[(2S,3S)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol
|
163025638 |
Click to see
COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)C4C5COC(C5CO4)C6=CC(=C(C=C6)O)OC
|
536.60 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
4-[3-[2-(4-Hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxyphenol
|
90477848 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC5=C(C(=C4)OC)OC(C5CO)C6=CC(=C(C=C6)O)OC
|
566.60 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
4-[6-[2-(4-Hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol
|
73657223 |
Click to see
COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)C4C5COC(C5CO4)C6=CC(=C(C=C6)O)OC
|
536.60 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
5-O-Methylhierochin D
|
188976 |
Click to see
COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)C=CCO
|
358.40 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
Dehydrodiconiferyl alcohol
|
5372367 |
Click to see
COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)C=CCO
|
358.40 |
unknown |
https://doi.org/10.1248/CPB.33.1444 |
> Phenylpropanoids and polyketides / Macrolides and analogues
|
(1aS,4E,8E,10aR,13aR,14aS)-4,8,14a-trimethyl-11-methylene-1a,3,6,7,10,10a,11,13a,14,14a-decahydrooxireno(12,13)cyclotetradeca(1,2-b)furan-12(2H)-one
|
643720 |
Click to see
CC1=CCCC(=CCC2C(CC3(C(O3)CC1)C)OC(=O)C2=C)C
|
316.40 |
unknown |
via CMAUP database |
(1R,2E,6R,8R,11E)-3,8,12,16-tetramethyl-7,18-dioxatricyclo[13.3.0.06,8]octadeca-2,11,15-trien-17-one
|
101472593 |
Click to see
CC1=CCCC2(C(O2)CCC(=CC3C(=C(C(=O)O3)C)CC1)C)C
|
316.40 |
unknown |
via CMAUP database |
(1R,3R,5R,8E,12E,14S,15R)-14-hydroxy-5,9,13-trimethyl-18-methylidene-4,16-dioxatricyclo[13.3.0.03,5]octadeca-8,12-dien-17-one
|
21574172 |
Click to see
CC1=CCCC2(C(O2)CC3C(C(C(=CCC1)C)O)OC(=O)C3=C)C
|
332.40 |
unknown |
via CMAUP database |
(1R,3R,5R,8E,12E,15S)-5,9,13-trimethyl-18-methylidene-4,16-dioxatricyclo[13.3.0.03,5]octadeca-8,12-dien-17-one
|
643718 |
Click to see
CC1=CCCC2(C(O2)CC3C(CC(=CCC1)C)OC(=O)C3=C)C
|
316.40 |
unknown |
via CMAUP database |
[(1R,3R,5R,8E,12E,14S,15R)-5,9,13-trimethyl-18-methylidene-17-oxo-4,16-dioxatricyclo[13.3.0.03,5]octadeca-8,12-dien-14-yl] acetate
|
21638415 |
Click to see
CC1=CCCC2(C(O2)CC3C(C(C(=CCC1)C)OC(=O)C)OC(=O)C3=C)C
|
374.50 |
unknown |
via CMAUP database |
13-Acetoxysarcocrassolide
|
21775908 |
Click to see
CC1=CCCC2(C(O2)CC3C(C(C(=CCC1)C)OC(=O)C)OC(=O)C3=C)C
|
374.50 |
unknown |
via CMAUP database |
Crassocolide E
|
11995175 |
Click to see
CC1=CCCC(=CCC2C(CC3(C(O3)CC1)C)OC(=O)C2=C)C
|
316.40 |
unknown |
via CMAUP database |
Crassocolide F
|
11995282 |
Click to see
CC1=CCC(C(=CCC2C(CC3(C(O3)CC1)C)OC(=O)C2=C)C)OC(=O)C
|
374.50 |
unknown |
via CMAUP database |
Crassocolide N
|
54764414 |
Click to see
CC1=CCCC(=CC2C(CC3C(O3)(C(=O)CC1)C)C(=C)C(=O)O2)C
|
330.40 |
unknown |
via CMAUP database |
Lobophytolide
|
23425511 |
Click to see
CC1=CCCC(=CCC2C(CC3(C(O3)CC1)C)OC(=O)C2=C)C
|
316.40 |
unknown |
via CMAUP database |
Sarcocrassocolide C
|
46233394 |
Click to see
CC1=CCCC(=C)C2CCC(O2)(C(CC3C(C1)OC(=O)C3=C)O)C
|
332.40 |
unknown |
via CMAUP database |
Sarcocrassocolide D
|
46233452 |
Click to see
CC1=CCCC(=C)C2CCC(O2)(C(CC3C(C1)OC(=O)C3=C)O)C
|
332.40 |
unknown |
via CMAUP database |
Sarcocrassolide
|
643719 |
Click to see
CC1=CCCC2(C(O2)CC3C(CC(=CCC1)C)OC(=O)C3=C)C
|
316.40 |
unknown |
via CMAUP database |