> Benzenoids / Phenols / Methoxyphenols
|
Eugenol
|
3314 |
Click to see
COC1=C(C=CC(=C1)CC=C)O
|
164.20 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
Maesol
|
128958 |
Click to see
CC1=C(C=C(C=C1OC)CCCCCCCCCCCCC2=CC(=C(C(=C2)OC)C)O)O
|
442.60 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
|
1-Hexanol
|
8103 |
Click to see
CCCCCCO
|
102.17 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
|
(2R,4R,4aS,8S,8aR)-8-(hydroxymethyl)-4-[(E)-5-hydroxy-3-methylpent-3-enyl]-4a,8-dimethyl-3-methylidene-2,4,5,6,7,8a-hexahydro-1H-naphthalen-2-ol
|
101967048 |
Click to see
CC(=CCO)CCC1C(=C)C(CC2C1(CCCC2(C)CO)C)O
|
322.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
(3R,4R,4aS,8S,8aR)-3-hydroxy-8-(hydroxymethyl)-4-[(E)-5-hydroxy-3-methylpent-3-enyl]-3,4a,8-trimethyl-1,4,5,6,7,8a-hexahydronaphthalen-2-one
|
101967049 |
Click to see
CC(=CCO)CCC1C2(CCCC(C2CC(=O)C1(C)O)(C)CO)C
|
338.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
(3S,4S,4aR,8S,8aR)-8-(hydroxymethyl)-4-[(E)-5-hydroxy-3-methylpent-3-enyl]-3,4a,8-trimethyl-3,4,5,6,7,8a-hexahydro-1H-naphthalen-2-one
|
101967050 |
Click to see
CC1C(C2(CCCC(C2CC1=O)(C)CO)C)CCC(=CCO)C
|
322.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
(E)-5-[(1S,4aR,5S,8aR)-5-(hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-methylpent-2-en-1-ol
|
21582485 |
Click to see
CC1=CCC2C(CCCC2(C1CCC(=CCO)C)C)(C)CO
|
306.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
[(1S,4aR,5S,6S,8aR)-5-[(E)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-7-oxo-3,4,5,6,8,8a-hexahydro-2H-naphthalen-1-yl]methyl acetate
|
162903571 |
Click to see
CC1C(C2(CCCC(C2CC1=O)(C)COC(=O)C)C)CCC(=CCO)C
|
364.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
[(1S,4aR,5S,8aR)-5-[(E)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-2,3,4,5,8,8a-hexahydronaphthalen-1-yl]methyl acetate
|
163013364 |
Click to see
CC1=CCC2C(CCCC2(C1CCC(=CCO)C)C)(C)COC(=O)C
|
348.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
[(1S,4aS,5R,7R,8aR)-7-hydroxy-5-[(E)-5-hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl acetate
|
162938822 |
Click to see
CC(=CCO)CCC1C(=C)C(CC2C1(CCCC2(C)COC(=O)C)C)O
|
364.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
[5-(5-Hydroxy-3-methylpent-3-enyl)-1,4a,6-trimethyl-2,3,4,5,8,8a-hexahydronaphthalen-1-yl]methyl acetate
|
163013362 |
Click to see
CC1=CCC2C(CCCC2(C1CCC(=CCO)C)C)(C)COC(=O)C
|
348.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
[5-(5-hydroxy-3-methylpent-3-enyl)-1,4a,6-trimethyl-7-oxo-3,4,5,6,8,8a-hexahydro-2H-naphthalen-1-yl]methyl acetate
|
162903570 |
Click to see
CC1C(C2(CCCC(C2CC1=O)(C)COC(=O)C)C)CCC(=CCO)C
|
364.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
[7-hydroxy-5-(5-hydroxy-3-methylpent-3-enyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl acetate
|
162938821 |
Click to see
CC(=CCO)CCC1C(=C)C(CC2C1(CCCC2(C)COC(=O)C)C)O
|
364.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
3-Hydroxy-8-(hydroxymethyl)-4-(5-hydroxy-3-methylpent-3-enyl)-3,4a,8-trimethyl-1,4,5,6,7,8a-hexahydronaphthalen-2-one
|
162874036 |
Click to see
CC(=CCO)CCC1C2(CCCC(C2CC(=O)C1(C)O)(C)CO)C
|
338.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
5-[5-(Hydroxymethyl)-2,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-methylpent-2-en-1-ol
|
73805519 |
Click to see
CC1=CCC2C(CCCC2(C1CCC(=CCO)C)C)(C)CO
|
306.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
8-(hydroxymethyl)-4-(5-hydroxy-3-methylpent-3-enyl)-3,4a,8-trimethyl-3,4,5,6,7,8a-hexahydro-1H-naphthalen-2-one
|
163076588 |
Click to see
CC1C(C2(CCCC(C2CC1=O)(C)CO)C)CCC(=CCO)C
|
322.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
8-(hydroxymethyl)-4-(5-hydroxy-3-methylpent-3-enyl)-4a,8-dimethyl-3-methylidene-2,4,5,6,7,8a-hexahydro-1H-naphthalen-2-ol
|
162971648 |
Click to see
CC(=CCO)CCC1C(=C)C(CC2C1(CCCC2(C)CO)C)O
|
322.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94165-7 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
|
Linalool, (+)-
|
67179 |
Click to see
CC(=CCCC(C)(C=C)O)C
|
154.25 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
Linalool, (+/-)-
|
6549 |
Click to see
CC(=CCCC(C)(C=C)O)C
|
154.25 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
Myrcene
|
31253 |
Click to see
CC(=CCCC(=C)C=C)C
|
136.23 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
|
p-CYMENE
|
7463 |
Click to see
CC1=CC=C(C=C1)C(C)C
|
134.22 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
|
(-)-beta-Pinene
|
440967 |
Click to see
CC1(C2CCC(=C)C1C2)C
|
136.23 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
(+)-Fenchone
|
1201521 |
Click to see
CC1(C2CCC(C2)(C1=O)C)C
|
152.23 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
(1S,2S,4R)-1,3,3-Trimethylbicyclo[2.2.1]heptan-2-YL acetate
|
14019266 |
Click to see
CC(=O)OC1C(C2CCC1(C2)C)(C)C
|
196.29 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
Fenchone
|
14525 |
Click to see
CC1(C2CCC(C2)(C1=O)C)C
|
152.23 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
Sabinen
|
18818 |
Click to see
CC(C)C12CCC(=C)C1C2
|
136.23 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
Sabinene
|
10887971 |
Click to see
CC(C)C12CCC(=C)C1C2
|
136.23 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
|
3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, 1-acetate, (1R)-
|
11469649 |
Click to see
CC1=CCC(CC1)C(C)(C)OC(=O)C
|
196.29 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
Alpha-Terpineol
|
17100 |
Click to see
CC1=CCC(CC1)C(C)(C)O
|
154.25 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
alpha-Terpinyl acetate
|
111037 |
Click to see
CC1=CCC(CC1)C(C)(C)OC(=O)C
|
196.29 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
(-)-beta-Bourbonene
|
324224 |
Click to see
CC(C)C1CCC2(C1C3C2CCC3=C)C
|
204.35 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
beta-Bourbonene
|
62566 |
Click to see
CC(C)C1CCC2(C1C3C2CCC3=C)C
|
204.35 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
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/10.1016/S0031-9422(00)80325-8 |
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/S0031-9422(00)80325-8 |
Caryophyllene epoxide
|
14350 |
Click to see
CC1(CC2C1CCC3(C(O3)CCC2=C)C)C
|
220.35 |
unknown |
https://doi.org/10.1016/S0031-9422(00)80325-8 |
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
|
(1S,2R,3R,9R,10R,17S)-3-(3,5-dihydroxyphenyl)-2,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol
|
101103994 |
Click to see
C1=CC(=CC=C1C2C3C(C4=C(C=C(C=C4O)O)C5C(OC6=C5C3=C(C2C7=CC(=CC(=C7)O)O)C(=C6)O)C8=CC=C(C=C8)O)C9=CC=C(C=C9)O)O
|
680.70 |
unknown |
via CMAUP database |
(1S,2R,3R,9S,10S,17S)-3-[(2S,3S)-3-(3,5-dihydroxyphenyl)-2-(4-hydroxyphenyl)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1-benzofuran-4-yl]-2,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol
|
21606280 |
Click to see
C1=CC(=CC=C1C2C3C(C4=C(C=C(C=C4O)O)C5C(OC6=C5C3=C(C2C7=C8C(C(OC8=CC(=C7)OC9C(C(C(C(O9)CO)O)O)O)C1=CC=C(C=C1)O)C1=CC(=CC(=C1)O)O)C(=C6)O)C1=CC=C(C=C1)O)C1=CC=C(C=C1)O)O
|
1069.10 |
unknown |
via CMAUP database |
(1S,4R,5R,11R,12R,15R,16R,22S)-4,15-bis(3,5-dihydroxyphenyl)-5,11,16,22-tetrakis(4-hydroxyphenyl)-6,17-dioxahexacyclo[10.9.1.02,10.03,7.013,21.014,18]docosa-2(10),3(7),8,13(21),14(18),19-hexaene-9,20-diol
|
101053432 |
Click to see
C1=CC(=CC=C1C2C3C(C4=C(C2C5=C3C6=C(C=C5O)OC(C6C7=CC(=CC(=C7)O)O)C8=CC=C(C=C8)O)C9=C(C=C4O)OC(C9C1=CC(=CC(=C1)O)O)C1=CC=C(C=C1)O)C1=CC=C(C=C1)O)O
|
906.90 |
unknown |
via CMAUP database |
(1S,4R,5R,11R,12R,15R,16S,22S)-4,15-bis(3,5-dihydroxyphenyl)-5,11,16,22-tetrakis(4-hydroxyphenyl)-6,17-dioxahexacyclo[10.9.1.02,10.03,7.013,21.014,18]docosa-2(10),3(7),8,13(21),14(18),19-hexaene-9,20-diol
|
101103995 |
Click to see
C1=CC(=CC=C1C2C3C(C4=C(C2C5=C3C6=C(C=C5O)OC(C6C7=CC(=CC(=C7)O)O)C8=CC=C(C=C8)O)C9=C(C=C4O)OC(C9C1=CC(=CC(=C1)O)O)C1=CC=C(C=C1)O)C1=CC=C(C=C1)O)O
|
906.90 |
unknown |
via CMAUP database |
(2R,9S,10S,11S,12S)-12-(3,5-dihydroxyphenyl)-2-[(R)-[(1S,2R,3R,9S,10S,17S)-3-(3,5-dihydroxyphenyl)-5,13,15-trihydroxy-2,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaen-6-yl]-(4-hydroxyphenyl)methyl]-9,11-bis(4-hydroxyphenyl)tetracyclo[8.6.1.03,8.013,17]heptadeca-1(16),3(8),4,6,13(17),14-hexaene-5,7,14,16-tetrol
|
16149368 |
Click to see
C1=CC(=CC=C1C2C3C(C4=C(C=C(C=C4O)O)C5C(OC6=C5C3=C(C2C7=CC(=CC(=C7)O)O)C(=C6C(C8C9=C(C(C1C(C(C2=C1C8=C(C=C2O)O)C1=CC(=CC(=C1)O)O)C1=CC=C(C=C1)O)C1=CC=C(C=C1)O)C(=CC(=C9)O)O)C1=CC=C(C=C1)O)O)C1=CC=C(C=C1)O)C1=CC=C(C=C1)O)O
|
1361.40 |
unknown |
via CMAUP database |
(2R,9S,10S,11S,12S)-12-(3,5-dihydroxyphenyl)-2-[(R)-[(1S,2R,3R,9S,10S,17S)-3-[(2R,3R)-3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-4-yl]-5,13,15-trihydroxy-2,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaen-6-yl]-(4-hydroxyphenyl)methyl]-9,11-bis(4-hydroxyphenyl)tetracyclo[8.6.1.03,8.013,17]heptadeca-1(16),3(8),4,6,13(17),14-hexaene-5,7,14,16-tetrol
|
16151489 |
Click to see
C1=CC(=CC=C1C2C3C(C4=C(C=C(C=C4O)O)C(C5=C(C=C(C(=C35)C2C6=CC(=CC(=C6)O)O)O)O)C(C7=CC=C(C=C7)O)C8=C(C9=C1C(C(C9C2=C3C(C(OC3=CC(=C2)O)C2=CC=C(C=C2)O)C2=CC(=CC(=C2)O)O)C2=CC=C(C=C2)O)C(C2=C(C=C(C=C2O)O)C2C1=C8OC2C1=CC=C(C=C1)O)C1=CC=C(C=C1)O)O)C1=CC=C(C=C1)O)O
|
1587.60 |
unknown |
via CMAUP database |
1beta,11alpha-Bis(4-hydroxyphenyl)-2alpha-[2alpha-(4-hydroxyphenyl)-3beta-[3-(beta-D-glucopyranosyloxy)-5-hydroxyphenyl]-6-hydroxy-2,3-dihydrobenzofuran-4-yl]-3-hydroxy-5,6beta-[(S)-2-(4-hydroxyphenyl)-1-oxaethane-1,2-diyl]-1,2,11,11abeta-tetrahydro-6H-dibenzo[cd,g]azulene-8,10-diol
|
21606279 |
Click to see
C1=CC(=CC=C1C2C3C(C4=C(C=C(C=C4O)O)C5C(OC6=C5C3=C(C2C7=C8C(C(OC8=CC(=C7)O)C9=CC=C(C=C9)O)C1=CC(=CC(=C1)OC1C(C(C(C(O1)CO)O)O)O)O)C(=C6)O)C1=CC=C(C=C1)O)C1=CC=C(C=C1)O)O
|
1069.10 |
unknown |
via CMAUP database |
5-[(2R,3S)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol
|
5315234 |
Click to see
C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=CC(=CC(=C5)O)O)O
|
454.50 |
unknown |
via CMAUP database |
Epsilon-viniferin
|
5281728 |
Click to see
C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=CC(=CC(=C5)O)O)O
|
454.50 |
unknown |
via CMAUP database |
Vaticanol A
|
44566412 |
Click to see
C1=CC(=CC=C1C2C3C(C4=C(C=C(C=C4O)O)C5C(OC6=C5C3=C(C2C7=CC(=CC(=C7)O)O)C(=C6)O)C8=CC=C(C=C8)O)C9=CC=C(C=C9)O)O
|
680.70 |
unknown |
via CMAUP database |
Vaticanol B
|
10010985 |
Click to see
C1=CC(=CC=C1C2C3C(C4=C(C=C(C=C4O)O)C5C(OC6=C5C3=C(C2C7=C8C(C(OC8=CC(=C7)O)C9=CC=C(C=C9)O)C1=CC(=CC(=C1)O)O)C(=C6)O)C1=CC=C(C=C1)O)C1=CC=C(C=C1)O)O
|
906.90 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Stilbenes
|
1,3-Benzenediol, 5-[(1Z)-2-(4-hydroxyphenyl)ethenyl]-
|
5056 |
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
|
(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 |
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 |