> Benzenoids / Anthracenes / Anthracenecarboxylic acids and derivatives / Anthracenecarboxylic acids
|
Rhein
|
10168 |
Click to see
C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)C(=O)O
|
284.22 |
unknown |
via CMAUP database |
> Benzenoids / Anthracenes / Anthraquinones
|
Anthraquinone
|
6780 |
Click to see
C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=O
|
208.21 |
unknown |
via CMAUP database |
Chrysophanic acid
|
10208 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O
|
254.24 |
unknown |
via CMAUP database |
Fallacinol
|
3083633 |
Click to see
COC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)CO
|
300.26 |
unknown |
via CMAUP database |
Physcion 8-glucoside
|
5319323 |
Click to see
CC1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)OC
|
446.40 |
unknown |
via CMAUP database |
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 |
Rheochrysin
|
168938 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)OC
|
446.40 |
unknown |
via CMAUP database |
> Benzenoids / Anthracenes / Anthraquinones / Hydroxyanthraquinones
|
Citreorosein
|
361512 |
Click to see
C1=C(C=C(C2=C1C(=O)C3=C(C2=O)C(=CC(=C3)O)O)O)CO
|
286.24 |
unknown |
via CMAUP database |
Emodin
|
3220 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)O
|
270.24 |
unknown |
via CMAUP database |
Emodin 1-O-beta-D-glucoside
|
5319333 |
Click to see
CC1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)O
|
432.40 |
unknown |
via CMAUP database |
Emodin-8-glucoside
|
99649 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)O
|
432.40 |
unknown |
via CMAUP database |
Questin
|
160717 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC)O
|
284.26 |
unknown |
via CMAUP database |
Questinol
|
147621 |
Click to see
COC1=CC(=CC2=C1C(=O)C3=C(C2=O)C=C(C=C3O)CO)O
|
300.26 |
unknown |
via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives
|
3,4-Dihydroxybenzoic acid
|
72 |
Click to see
C1=CC(=C(C=C1C(=O)O)O)O
|
154.12 |
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 / Benzoic acids and derivatives / Salicylic acid and derivatives / Salicylic acids
|
2,6-Dihydroxybenzoic acid
|
9338 |
Click to see
C1=CC(=C(C(=C1)O)C(=O)O)O
|
154.12 |
unknown |
via CMAUP database |
> Benzenoids / Naphthalenes / Naphthoquinones
|
2-Methoxystypandrone
|
158739 |
Click to see
CC1=CC2=C(C(=O)C=C(C2=O)OC)C(=C1C(=O)C)O
|
260.24 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
(+)-delta-Cadinene
|
441005 |
Click to see
CC1=CC2C(CCC(=C2CC1)C)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
(+)-Gamma-cadinene
|
6432404 |
Click to see
CC1=CC2C(CC1)C(=C)CCC2C(C)C
|
204.35 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
[(2R)-2-[(1R,4aS,7S,7aR)-4,7-dimethyl-3-(3-methylbutanoyl)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl]-4-methyl-3-oxo-1-benzofuran-2-yl] acetate
|
162900082 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)CC(C)C)C3(C(=O)C4=C(C=CC=C4O3)C)OC(=O)C
|
440.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
[(2S)-2-[(1R,4aS,7S,7aR)-4,7-dimethyl-3-(3-methylbutanoyl)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl]-4-methyl-3-oxo-1-benzofuran-2-yl] acetate
|
162900081 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)CC(C)C)C3(C(=O)C4=C(C=CC=C4O3)C)OC(=O)C
|
440.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
[2-[4,7-Dimethyl-3-(3-methylbutanoyl)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl]-4-methyl-3-oxo-1-benzofuran-2-yl] acetate
|
14108752 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)CC(C)C)C3(C(=O)C4=C(C=CC=C4O3)C)OC(=O)C
|
440.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
1-(13-Hydroxy-8,13,17-trimethyl-3,11,19-trioxapentacyclo[10.6.1.02,10.04,9.014,18]nonadeca-2(10),4,6,8-tetraen-12-yl)-3-methylbut-2-en-1-one
|
14134079 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5O4)C)OC(C2(C)O)(O3)C(=O)C=C(C)C
|
396.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
1-[(1S,12R,13S,14R,17S,18R)-13-hydroxy-8,13,17-trimethyl-3,11,19-trioxapentacyclo[10.6.1.02,10.04,9.014,18]nonadeca-2(10),4,6,8-tetraen-12-yl]-3-methylbut-2-en-1-one
|
162901711 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5O4)C)OC(C2(C)O)(O3)C(=O)C=C(C)C
|
396.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
1-[(1S,12R,13S,14R,17S,18S)-13-hydroxy-8,13,17-trimethyl-3,11,19-trioxapentacyclo[10.6.1.02,10.04,9.014,18]nonadeca-2(10),4,6,8-tetraen-12-yl]-3-methylbut-2-en-1-one
|
162901713 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5O4)C)OC(C2(C)O)(O3)C(=O)C=C(C)C
|
396.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
1-[(1S,4aS,7S,7aR)-1-[2-(2-hydroxy-6-methylphenyl)-2-oxoethyl]-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-3-yl]-3-methylbutan-1-one
|
14134086 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)CC(C)C)CC(=O)C3=C(C=CC=C3O)C
|
384.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
1-[1-[2-(2-Hydroxy-6-methylphenyl)-2-oxoethyl]-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-3-yl]-3-methylbutan-1-one
|
14134085 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)CC(C)C)CC(=O)C3=C(C=CC=C3O)C
|
384.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
beta-CARYOPHYLLENE OXIDE
|
1742210 |
Click to see
CC1(CC2C1CCC3(C(O3)CCC2=C)C)C
|
220.35 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
Cadina-1(10),4-diene
|
10223 |
Click to see
CC1=CC2C(CCC(=C2CC1)C)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
Caryophyllene epoxide
|
14350 |
Click to see
CC1(CC2C1CCC3(C(O3)CCC2=C)C)C
|
220.35 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
Cedrelanol
|
160799 |
Click to see
CC1=CC2C(CCC(C2CC1)(C)O)C(C)C
|
222.37 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
gamma-Cadinene
|
15094 |
Click to see
CC1=CC2C(CC1)C(=C)CCC2C(C)C
|
204.35 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids
|
(1aS,4aS,7S,7aR,7bS)-1,1,7-trimethyl-4-methylidene-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-ol
|
97032059 |
Click to see
CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C
|
220.35 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
(7aR)-1,1,7-trimethyl-4-methylidene-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-ol
|
5321422 |
Click to see
CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C
|
220.35 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
beta-Spathulenol
|
522266 |
Click to see
CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C
|
220.35 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
Spathulenol
|
92231 |
Click to see
CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C
|
220.35 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
|
(1R,13R,14S,15R,18S,19S)-9,14,18-trimethyl-13-(3-methylbutanoyl)-4,12,20-trioxapentacyclo[11.6.1.02,11.05,10.015,19]icosa-2(11),5,7,9-tetraen-3-one
|
163194232 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC(C2C)(O3)C(=O)CC(C)C
|
410.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
(1R,13S,14R,15S,18S,19R)-13-[(2S)-2-hydroxy-3-methylbutanoyl]-9,14,18-trimethyl-4,12,20-trioxapentacyclo[11.6.1.02,11.05,10.015,19]icosa-2(11),5,7,9-tetraen-3-one
|
162959136 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC(C2C)(O3)C(=O)C(C(C)C)O
|
426.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
(1R,13S,14R,15S,18S,19R)-9,14,18-trimethyl-13-(3-methylbut-2-enoyl)-4,12,20-trioxapentacyclo[11.6.1.02,11.05,10.015,19]icosa-2(11),5,7,9-tetraen-3-one
|
162937783 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC(C2C)(O3)C(=O)C=C(C)C
|
408.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
(1S,13S,14R,15S,18S,19R)-13-[(2R)-2-hydroxy-3-methylbutanoyl]-9,14,18-trimethyl-4,12,20-trioxapentacyclo[11.6.1.02,11.05,10.015,19]icosa-2(11),5,7,9-tetraen-3-one
|
162959137 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC(C2C)(O3)C(=O)C(C(C)C)O
|
426.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
(1S,13S,14R,15S,18S,19R)-9,14,18-trimethyl-13-(3-methylbut-2-enoyl)-4,12,20-trioxapentacyclo[11.6.1.02,11.05,10.015,19]icosa-2(11),5,7,9-tetraen-3-one
|
162937782 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC(C2C)(O3)C(=O)C=C(C)C
|
408.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
(1S,13S,14R,15S,18S,19R)-9,14,18-trimethyl-13-(3-methylbutanoyl)-4,12,20-trioxapentacyclo[11.6.1.02,11.05,10.015,19]icosa-2(11),5,7,9-tetraen-3-one
|
162933596 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC(C2C)(O3)C(=O)CC(C)C
|
410.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
(1S,13S,14S,15R,18S,19S)-9,14,18-trimethyl-13-(3-methylbutanoyl)-4,12,20-trioxapentacyclo[11.6.1.02,11.05,10.015,19]icosa-2(11),5,7,9-tetraen-3-one
|
162933594 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC(C2C)(O3)C(=O)CC(C)C
|
410.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
[(2R)-1-[(1R,4aS,7S,7aR)-1-(4-hydroxy-5-methyl-2-oxochromen-3-yl)-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-3-yl]-3-methyl-1-oxobutan-2-yl] acetate
|
162874773 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)C(C(C)C)OC(=O)C)C3=C(C4=C(C=CC=C4OC3=O)C)O
|
468.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
[(2R)-1-[(1S,4aS,7S,7aR)-1-(4-hydroxy-5-methyl-2-oxochromen-3-yl)-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-3-yl]-3-methyl-1-oxobutan-2-yl] acetate
|
162874772 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)C(C(C)C)OC(=O)C)C3=C(C4=C(C=CC=C4OC3=O)C)O
|
468.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
[1-[1-(4-Hydroxy-5-methyl-2-oxochromen-3-yl)-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-3-yl]-3-methyl-1-oxobutan-2-yl] acetate
|
162874771 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)C(C(C)C)OC(=O)C)C3=C(C4=C(C=CC=C4OC3=O)C)O
|
468.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
13-(2-Hydroxy-3-methylbutanoyl)-9,14,18-trimethyl-4,12,20-trioxapentacyclo[11.6.1.02,11.05,10.015,19]icosa-2(11),5,7,9-tetraen-3-one
|
14134077 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC(C2C)(O3)C(=O)C(C(C)C)O
|
426.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
3-[(1R,4aS,7S,7aR)-3-[(2R)-2-hydroxy-3-methylbutanoyl]-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl]-4-hydroxy-5-methylchromen-2-one
|
162943902 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)C(C(C)C)O)C3=C(C4=C(C=CC=C4OC3=O)C)O
|
426.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
3-[(1R,4aS,7S,7aR)-4,7-dimethyl-3-(3-methylbut-2-enoyl)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl]-4-hydroxy-5-methylchromen-2-one
|
163021284 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)C=C(C)C)C3=C(C4=C(C=CC=C4OC3=O)C)O
|
408.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
3-[(1S,4aS,7S,7aR)-3-[(2R)-2-hydroxy-3-methylbutanoyl]-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl]-4-hydroxy-5-methylchromen-2-one
|
163193661 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)C(C(C)C)O)C3=C(C4=C(C=CC=C4OC3=O)C)O
|
426.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
3-[[(3S,3aR,4S)-4-hydroxy-3,6-dimethyl-4-(2-methylpropyl)-5-oxo-2,3-dihydro-1H-pentalen-3a-yl]methyl]-4-hydroxy-5-methylchromen-2-one
|
163103400 |
Click to see
CC1CCC2=C(C(=O)C(C12CC3=C(C4=C(C=CC=C4OC3=O)C)O)(CC(C)C)O)C
|
410.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
3-[[(3S,3aS,4R)-4-hydroxy-4-[(1S)-1-hydroxy-2-methylpropyl]-3,6-dimethyl-5-oxo-2,3-dihydro-1H-pentalen-3a-yl]methyl]-4-hydroxy-5-methylchromen-2-one
|
163105317 |
Click to see
CC1CCC2=C(C(=O)C(C12CC3=C(C4=C(C=CC=C4OC3=O)C)O)(C(C(C)C)O)O)C
|
426.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
4-Hydroxy-3-(9-hydroxy-3,7,11-trimethyl-8-oxododeca-2,6,10-trienyl)-5-methylchromen-2-one
|
75669493 |
Click to see
CC1=C2C(=CC=C1)OC(=O)C(=C2O)CC=C(C)CCC=C(C)C(=O)C(C=C(C)C)O
|
410.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
4-hydroxy-3-[(2E,6E,9R)-9-hydroxy-3,7,11-trimethyl-8-oxododeca-2,6,10-trienyl]-5-methylchromen-2-one
|
162892895 |
Click to see
CC1=C2C(=CC=C1)OC(=O)C(=C2O)CC=C(C)CCC=C(C)C(=O)C(C=C(C)C)O
|
410.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
4-hydroxy-3-[[4-hydroxy-3,6-dimethyl-4-(2-methylpropyl)-5-oxo-2,3-dihydro-1H-pentalen-3a-yl]methyl]-5-methylchromen-2-one
|
163103399 |
Click to see
CC1CCC2=C(C(=O)C(C12CC3=C(C4=C(C=CC=C4OC3=O)C)O)(CC(C)C)O)C
|
410.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
4-Hydroxy-3-[3-(2-hydroxy-3-methylbutanoyl)-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl]-5-methylchromen-2-one
|
162943901 |
Click to see
CC1CCC2C1C(OC(=C2C)C(=O)C(C(C)C)O)C3=C(C4=C(C=CC=C4OC3=O)C)O
|
426.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
4-Hydroxy-5-methyl-3-(3,7,11-trimethyl-8-oxododeca-2,6,10-trienyl)chromen-2-one
|
163099310 |
Click to see
CC1=C2C(=CC=C1)OC(=O)C(=C2O)CC=C(C)CCC=C(C)C(=O)CC=C(C)C
|
394.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
4-Hydroxy-5-methyl-3-[8'-oxo-farnesyl]-coumarin
|
163184478 |
Click to see
CC1=C2C(=CC=C1)OC(=O)C(=C2O)CC=C(C)CCC=C(C)C(=O)CC=C(C)C
|
394.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
9,14,18-Trimethyl-13-(3-methylbut-2-enoyl)-4,12,20-trioxapentacyclo[11.6.1.02,11.05,10.015,19]icosa-2(11),5,7,9-tetraen-3-one
|
14134075 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC(C2C)(O3)C(=O)C=C(C)C
|
408.50 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Germacranolides and derivatives
|
Methyl 5-hydroxy-10-(hydroxymethyl)-4-(2-methylbut-2-enoyloxy)-3-methylidene-2-oxo-3a,4,5,8,9,10,11,11a-octahydrocyclodeca[b]furan-6-carboxylate
|
162882539 |
Click to see
CC=C(C)C(=O)OC1C2C(CC(CCC=C(C1O)C(=O)OC)CO)OC(=O)C2=C
|
408.40 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
Lup-20(29)-en-3-ol, (3beta)-
|
521518 |
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/10.1016/0031-9422(88)80708-8 |
Lupenone
|
92158 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C5(CCC(=O)C(C5CCC4(C3(CC2)C)C)(C)C)C)C
|
424.70 |
unknown |
https://doi.org/10.1016/0031-9422(88)80708-8 |
Lupeol Acetate
|
92157 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)OC(=O)C)C)C
|
468.80 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
|
2-(Carboxymethyl)-2-hydroxybutanedioate;hydron
|
88113319 |
Click to see
[H+].[H+].C(C(=O)O)C(CC(=O)[O-])(C(=O)[O-])O
|
192.12 |
unknown |
via CMAUP database |
> Organic acids and derivatives / Hydroxy acids and derivatives / Beta hydroxy acids and derivatives
|
(2S)-2-Hydroxybutanedioic acid
|
222656 |
Click to see
C(C(C(=O)O)O)C(=O)O
|
134.09 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
|
1-[3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenyl]ethanone
|
71593490 |
Click to see
CC(=O)C1=CC(=C(C(=C1)OC2C(C(C(C(O2)CO)O)O)O)O)O
|
330.29 |
unknown |
via CMAUP database |
Tachioside
|
11962143 |
Click to see
COC1=C(C=CC(=C1)OC2C(C(C(C(O2)CO)O)O)O)O
|
302.28 |
unknown |
via CMAUP database |
Torachrysone 8-O-Glucoside
|
11972479 |
Click to see
CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC3C(C(C(C(O3)CO)O)O)O)OC
|
408.40 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives
|
L-Tartaric acid
|
444305 |
Click to see
C(C(C(=O)O)O)(C(=O)O)O
|
150.09 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Chromones
|
7-Hydroxy-2,5-dimethyl-4H-1-benzopyran-4-one
|
5316891 |
Click to see
CC1=CC(=CC2=C1C(=O)C=C(O2)C)O
|
190.19 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Bi- and oligothiophenes
|
Arctinal
|
13779265 |
Click to see
CC#CC1=CC=C(S1)C2=CC=C(S2)C=O
|
232.30 |
unknown |
https://doi.org/10.1016/0031-9422(88)80708-8 |
> Organoheterocyclic compounds / Indoles and derivatives / Indolyl carboxylic acids and derivatives
|
(2S)-2-ammonio-3-(1H-indol-3-yl)propanoate
|
6923516 |
Click to see
C1=CC=C2C(=C1)C(=CN2)CC(C(=O)[O-])[NH3+]
|
204.22 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Coumarins and derivatives
|
(1R,13R,14R,17S,18S)-9,13,17-trimethyl-4,12,19-trioxapentacyclo[11.5.2.02,11.05,10.014,18]icosa-2(11),5,7,9-tetraene-3,20-dione
|
163029047 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC2(C(=O)O3)C
|
340.40 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
(1R,13R,14S,17S,18R)-9,13,17-trimethyl-4,12,19-trioxapentacyclo[11.5.2.02,11.05,10.014,18]icosa-2(11),5,7,9-tetraene-3,20-dione
|
122368494 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC2(C(=O)O3)C
|
340.40 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
9,13,17-Trimethyl-4,12,19-trioxapentacyclo[11.5.2.02,11.05,10.014,18]icosa-2(11),5,7,9-tetraene-3,20-dione
|
14108762 |
Click to see
CC1CCC2C1C3C4=C(C5=C(C=CC=C5OC4=O)C)OC2(C(=O)O3)C
|
340.40 |
unknown |
https://doi.org/10.1016/0031-9422(88)80452-7 |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins
|
7-Hydroxy-4-methoxy-5-methylchromen-2-one
|
5318268 |
Click to see
CC1=CC(=CC2=C1C(=CC(=O)O2)OC)O
|
206.19 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Diarylheptanoids / Linear diarylheptanoids
|
[(1S,8S,9R,11S,17R,18R,19S)-17-(3,4-dihydroxyphenyl)-3,11-dihydroxy-9-(4-hydroxyphenyl)-13-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-10,16-dioxapentacyclo[9.7.1.02,7.08,19.015,19]nonadeca-2(7),3,5,14-tetraen-18-yl] 3,4,5-trihydroxybenzoate
|
72195698 |
Click to see
C1C(=O)C=C2C34C1(OC(C3C5=C(C4C(C(O2)C6=CC(=C(C=C6)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O)C(=CC(=C5)OC8C(C(C(C(O8)CO)O)O)O)O)C9=CC=C(C=C9)O)O
|
846.70 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
|
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 / Flavonoids / Flavones
|
Apigenin
|
5280443 |
Click to see
C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O
|
270.24 |
unknown |
https://doi.org/10.1016/0031-9422(88)80708-8 |
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
|
Quercetin
|
5280343 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O
|
302.23 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
|
(+)-Catechin-5-O-I(2)-D-glucopyranoside
|
6324898 |
Click to see
C1C(C(OC2=C1C(=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C=C4)O)O)O
|
452.40 |
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-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-[[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
|
46936193 |
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 |
Guaijaverin
|
5481224 |
Click to see
C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O
|
434.30 |
unknown |
via CMAUP database |
Isoquercetin
|
5280804 |
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)O)O)O
|
464.40 |
unknown |
via CMAUP database |
Quercetin 3-O-beta-D-xylopyranoside
|
5320861 |
Click to see
C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O
|
434.30 |
unknown |
via CMAUP database |
Quercitrin
|
5280459 |
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 |
via CMAUP database |
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
|
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 |
> Phenylpropanoids and polyketides / Stilbenes
|
cis-Resveratrol
|
1548910 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)O
|
228.24 |
unknown |
via CMAUP database |
Resveratrol
|
445154 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)O
|
228.24 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Stilbenes / Stilbene glycosides
|
(2R,3S,4R,5R,6S)-2-[4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
71528811 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)OC3C(C(C(C(O3)CO)O)O)O
|
390.40 |
unknown |
via CMAUP database |
(2S,3R,4S,5S,6R)-2-[3-[(1S,2S,3S,4S)-2,3-bis(4-hydroxyphenyl)-4-[3-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]cyclobutyl]-5-hydroxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
10327899 |
Click to see
C1=CC(=CC=C1C2C(C(C2C3=CC(=CC(=C3)OC4C(C(C(C(O4)CO)O)O)O)O)C5=CC(=CC(=C5)OC6C(C(C(C(O6)CO)O)O)O)O)C7=CC=C(C=C7)O)O
|
780.80 |
unknown |
via CMAUP database |
(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(1R,2S)-1-hydroxy-2-[4-hydroxy-2-[(E)-2-(4-hydroxyphenyl)ethenyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2-(4-hydroxyphenyl)ethyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
21586804 |
Click to see
C1=CC(=CC=C1C=CC2=C(C(=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)O)C(C4=CC=C(C=C4)O)C(C5=CC(=CC(=C5)OC6C(C(C(C(O6)CO)O)O)O)O)O)O
|
796.80 |
unknown |
via CMAUP database |
(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
73642 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O
|
390.40 |
unknown |
via CMAUP database |
(E)-Resveratrol 3-(6''-Galloyl)-O-Beta-D-Glucopyranoside
|
11330189 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)COC(=O)C4=CC(=C(C(=C4)O)O)O)O)O)O)O)O
|
542.50 |
unknown |
via CMAUP database |
2,3,5,4'-tetrahydroxystilbene-2-O-beta-D-glucoside
|
5321884 |
Click to see
C1=CC(=CC=C1C=CC2=C(C(=CC(=C2)O)O)OC3C(C(C(C(O3)CO)O)O)O)O
|
406.40 |
unknown |
via CMAUP database |
cis-Piceid
|
10178463 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O
|
390.40 |
unknown |
via CMAUP database |
Piceatannol 3'-O-glucoside
|
11968990 |
Click to see
C1=CC(=C(C=C1C=CC2=CC(=CC(=C2)O)O)OC3C(C(C(C(O3)CO)O)O)O)O
|
406.40 |
unknown |
via CMAUP database |
Polydatin
|
5281718 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O
|
390.40 |
unknown |
via CMAUP database |
Resveratroloside
|
5322089 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)OC3C(C(C(C(O3)CO)O)O)O
|
390.40 |
unknown |
via CMAUP database |