> 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 / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Galloyl esters
|
5-Galloylshikimic acid
|
460897 |
Click to see
C1C(C(C(C=C1C(=O)O)O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O
|
326.25 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
|
(1R,4R,6R,9E,12S,13Z,15R)-12-hydroxy-4,9,16,16-tetramethyl-5-oxatricyclo[13.1.0.04,6]hexadeca-9,13-diene-13-carbaldehyde
|
72707965 |
Click to see
CC1=CCC(C(=CC2C(C2(C)C)CCC3(C(O3)CC1)C)C=O)O
|
318.40 |
unknown |
via CMAUP database |
(1R,4R,6R,9E,12S,13Z,15R)-12-hydroxy-4,9,16,16-tetramethyl-5-oxatricyclo[13.1.0.04,6]hexadeca-9,13-diene-13-carboxylic acid
|
72707966 |
Click to see
CC1=CCC(C(=CC2C(C2(C)C)CCC3(C(O3)CC1)C)C(=O)O)O
|
334.40 |
unknown |
via CMAUP database |
[(1R,3S,4S,5R,7S,8R,9R,10E,12S,13S,14S)-8,9,13-trihydroxy-3,6,6,10,14-pentamethyl-2-oxo-16-oxatetracyclo[10.3.1.01,12.05,7]hexadec-10-en-4-yl] acetate
|
11811636 |
Click to see
CC1CC23C(=O)C(C(C4C(C4(C)C)C(C(C(=CC2(C1O)O3)C)O)O)OC(=O)C)C
|
408.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Cembrane diterpenoids
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(1R,2E,4R,6E,10E,14R)-4-hydroxy-7,11,15,15-tetramethylbicyclo[12.1.0]pentadeca-2,6,10-triene-3-carbaldehyde
|
42623960 |
Click to see
CC1=CCCC(=CCC(C(=CC2C(C2(C)C)CC1)C=O)O)C
|
302.50 |
unknown |
via CMAUP database |
(1R,2E,6E,10E,14R)-3-(hydroxymethyl)-7,11,15,15-tetramethylbicyclo[12.1.0]pentadeca-2,6,10-trien-4-one
|
53496644 |
Click to see
CC1=CCCC(=CCC(=O)C(=CC2C(C2(C)C)CC1)CO)C
|
302.50 |
unknown |
via CMAUP database |
(1R,2Z,4S,6E,10E,14R)-4-hydroxy-7,11,15,15-tetramethylbicyclo[12.1.0]pentadeca-2,6,10-triene-3-carbaldehyde
|
72707210 |
Click to see
CC1=CCCC(=CCC(C(=CC2C(C2(C)C)CC1)C=O)O)C
|
302.50 |
unknown |
via CMAUP database |
(1R,2Z,4S,6E,10E,14R)-4-methoxy-7,11,15,15-tetramethylbicyclo[12.1.0]pentadeca-2,6,10-triene-3-carboxylic acid
|
53496645 |
Click to see
CC1=CCCC(=CCC(C(=CC2C(C2(C)C)CC1)C(=O)O)OC)C
|
332.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
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(4aS,6aR,6aR,6bR,8aR,10R,12aR,14aS)-10-acetyloxy-2,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydropicene-4a-carboxylic acid
|
21580169 |
Click to see
CC(=O)OC1CCC2(C3CCC4C5=CC(CCC5(CCC4(C3(CCC2C1(C)C)C)C)C(=O)O)(C)C)C
|
498.70 |
unknown |
https://doi.org/10.1021/NP040058H |
(4aS,6aR,6aR,6bR,8aR,10R,12aR,14aS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydropicene-4a-carboxylic acid
|
21580168 |
Click to see
CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1021/NP040058H |
(4aS,6aR,6aR,6bR,8aR,9S,12aR,14aS)-9-(acetyloxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid
|
21580166 |
Click to see
CC(=O)OCC1(C2CCC3(C(C2(CCC1=O)C)CCC4C3(CCC5(C4=CC(CC5)(C)C)C(=O)O)C)C)C
|
512.70 |
unknown |
https://doi.org/10.1021/NP040058H |
(4aS,6aR,6aR,6bR,8aR,9S,12aR,14aS)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid
|
21580165 |
Click to see
CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(=O)C5(C)CO)C)C)C)C(=O)O)C
|
470.70 |
unknown |
https://doi.org/10.1021/NP040058H |
(4aS,6aR,6aR,6bR,8aR,9S,12aR,14aS)-9-formyl-2,2,6a,6b,9,12a-hexamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid
|
21580167 |
Click to see
CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(=O)C5(C)C=O)C)C)C)C(=O)O)C
|
468.70 |
unknown |
https://doi.org/10.1021/NP040058H |
(4aS,6aR,6bR,8aR,9S,12aR,14aS)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid
|
163186619 |
Click to see
CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(=O)C5(C)CO)C)C)C)C(=O)O)C
|
470.70 |
unknown |
https://doi.org/10.1021/NP040058H |
(4aS,6aS,6aS,6bR,8aS,10S,12aR,14bR)-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
|
51892422 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1021/NP040058H |
10-Hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydropicene-4a-carboxylic acid
|
5319898 |
Click to see
CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1021/NP040058H |
2,2,6a,6b,9,9,12a-heptamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid
|
14345396 |
Click to see
CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C)C(=O)O)C
|
454.70 |
unknown |
https://doi.org/10.1021/NP040058H |
3-(Acetyloxy)olean-18-en-28-oic acid
|
635110 |
Click to see
CC(=O)OC1CCC2(C3CCC4C5=CC(CCC5(CCC4(C3(CCC2C1(C)C)C)C)C(=O)O)(C)C)C
|
498.70 |
unknown |
https://doi.org/10.1021/NP040058H |
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/10.1021/NP040058H |
3beta-Acetoxyolean-18-en-28-oic acid
|
21594125 |
Click to see
CC(=O)OC1CCC2(C3CCC4C5=CC(CCC5(CCC4(C3(CCC2C1(C)C)C)C)C(=O)O)(C)C)C
|
498.70 |
unknown |
https://doi.org/10.1021/NP040058H |
9-(acetyloxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid
|
72753809 |
Click to see
CC(=O)OCC1(C2CCC3(C(C2(CCC1=O)C)CCC4C3(CCC5(C4=CC(CC5)(C)C)C(=O)O)C)C)C
|
512.70 |
unknown |
https://doi.org/10.1021/NP040058H |
9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid
|
72807962 |
Click to see
CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(=O)C5(C)CO)C)C)C)C(=O)O)C
|
470.70 |
unknown |
https://doi.org/10.1021/NP040058H |
9-formyl-2,2,6a,6b,9,12a-hexamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid
|
72812748 |
Click to see
CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(=O)C5(C)C=O)C)C)C)C(=O)O)C
|
468.70 |
unknown |
https://doi.org/10.1021/NP040058H |
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/10.1021/NP040058H |
Morolic acid
|
489944 |
Click to see
CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1021/NP040058H |
Moronic acid
|
489941 |
Click to see
CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C)C(=O)O)C
|
454.70 |
unknown |
https://doi.org/10.1021/NP040058H |
Oleanolic Acid
|
10494 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1021/NP040058H |
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/10.1021/NP040058H |
Ursolic acid acetate
|
6475119 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC(=O)C)C)C)C2C1C)C)C(=O)O
|
498.70 |
unknown |
https://doi.org/10.1021/NP040058H |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclic alcohols and derivatives
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(2S,4aS,6aR,6bR,10R,12aR)-10-hydroxy-2,6a,6b,9,9,12a-hexamethyl-3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydro-2H-picene-4a-carboxylic acid
|
86575976 |
Click to see
CC1CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C)C(=O)O
|
442.70 |
unknown |
https://doi.org/10.1021/NP040058H |
> Organoheterocyclic compounds / Benzofurans / Dibenzofurans
|
3,11-Dihydroxy-4,10-dimethoxy-7,16-dioxatetracyclo[11.2.1.05,15.09,14]hexadeca-1(15),2,4,9,11,13-hexaene-6,8-dione
|
5316855 |
Click to see
COC1=C2C3=C(C=C1O)OC4=C3C(=C(C(=C4)O)OC)C(=O)OC2=O
|
330.24 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
|
Octadecyl ferulate
|
5320256 |
Click to see
CCCCCCCCCCCCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)O)OC
|
446.70 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins
|
Isofraxidin
|
5318565 |
Click to see
COC1=C(C(=C2C(=C1)C=CC(=O)O2)OC)O
|
222.19 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
[(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-chromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl] 3,4,5-trihydroxybenzoate
|
5480249 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)O)O
|
616.50 |
unknown |
via CMAUP database |
4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-((2-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranosyl)oxy)-
|
5488619 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)O
|
600.50 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids
|
Genkwanin
|
5281617 |
Click to see
COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O
|
284.26 |
unknown |
https://doi.org/10.1021/NP040058H |
Velutin
|
5464381 |
Click to see
COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C=C3)O)OC)O
|
314.29 |
unknown |
https://doi.org/10.1021/NP040058H |
> Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins
|
Corilagin
|
73568 |
Click to see
C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O1)O)O)O)O)O)O)O
|
634.50 |
unknown |
via CMAUP database |