> Benzenoids / Benzene and substituted derivatives
|
2-Methyl-1-phenylpropene
|
13030 |
Click to see
CC(=CC1=CC=CC=C1)C
|
132.20 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Benzenoids / Phenols / Methoxyphenols
|
Eugenol
|
3314 |
Click to see
COC1=C(C=CC(=C1)CC=C)O
|
164.20 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
|
gamma-Terpinene
|
7461 |
Click to see
CC1=CCC(=CC1)C(C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters
|
Methyl palmitate
|
8181 |
Click to see
CCCCCCCCCCCCCCCC(=O)OC
|
270.50 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
|
2-Hexen-1-OL
|
5318042 |
Click to see
CCCC=CCO
|
100.16 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
|
[(1S,3R,4aS,5R,7R,8aR)-3,7-dihydroxy-1,4a-dimethyl-6-methylidene-5-[(Z)-3-methyl-5-oxopent-3-enyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl acetate
|
21672195 |
Click to see
CC(=CC=O)CCC1C(=C)C(CC2C1(CC(CC2(C)COC(=O)C)O)C)O
|
378.50 |
unknown |
https://doi.org/10.1021/NP980222Z |
[(1S,3R,4aS,5R,7R,8aR)-3,7-dihydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl acetate
|
21672193 |
Click to see
CC(=CCO)CCC1C(=C)C(CC2C1(CC(CC2(C)COC(=O)C)O)C)O
|
380.50 |
unknown |
https://doi.org/10.1021/NP980222Z |
[(1S,4aS,5R,7R,8aR)-7-hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3-oxo-2,4,5,7,8,8a-hexahydronaphthalen-1-yl]methyl acetate
|
21672196 |
Click to see
CC(=CCO)CCC1C(=C)C(CC2C1(CC(=O)CC2(C)COC(=O)C)C)O
|
378.50 |
unknown |
https://doi.org/10.1021/NP980222Z |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Kaurane diterpenoids
|
(5R,9S,13S)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
|
49775756 |
Click to see
CC12CCCC(C1CCC34C2CCC(C3)C(=C)C4)(C)C(=O)O
|
302.50 |
unknown |
https://doi.org/10.1021/NP980222Z |
Kaurenoic acid
|
73062 |
Click to see
CC12CCCC(C1CCC34C2CCC(C3)C(=C)C4)(C)C(=O)O
|
302.50 |
unknown |
https://doi.org/10.1021/NP980222Z |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
|
beta-OCIMENE, (3E)-
|
5281553 |
Click to see
CC(=CCC=C(C)C=C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
Linalool, (+/-)-
|
6549 |
Click to see
CC(=CCCC(C)(C=C)O)C
|
154.25 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
Myrcene
|
31253 |
Click to see
CC(=CCCC(=C)C=C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
|
Thymol
|
6989 |
Click to see
CC1=CC(=C(C=C1)C(C)C)O
|
150.22 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
|
(3R)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol
|
42626428 |
Click to see
CC(C)C12CC1C(=C)C(C2)O
|
152.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
3-Carene
|
26049 |
Click to see
CC1=CCC2C(C1)C2(C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
alpha-PINENE
|
6654 |
Click to see
CC1=CCC2CC1C2(C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
beta-Pinene
|
14896 |
Click to see
CC1(C2CCC(=C)C1C2)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
Camphene
|
6616 |
Click to see
CC1(C2CCC(C2)C1=C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
Sabinen
|
18818 |
Click to see
CC(C)C12CCC(=C)C1C2
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
|
alpha-PHELLANDRENE
|
7460 |
Click to see
CC1=CCC(C=C1)C(C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
alpha-Terpinene
|
7462 |
Click to see
CC1=CC=C(CC1)C(C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
Alpha-Terpineol
|
17100 |
Click to see
CC1=CCC(CC1)C(C)(C)O
|
154.25 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
Pulegone
|
442495 |
Click to see
CC1CCC(=C(C)C)C(=O)C1
|
152.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
Terpinolene
|
11463 |
Click to see
CC1=CCC(=C(C)C)CC1
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
(+)-gamma-Cadinene
|
6432404 |
Click to see
CC1=CC2C(CC1)C(=C)CCC2C(C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
1,2,4a,5,6,8a-Hexahydro-1-isopropyl-4,7-dimethylnaphthalene
|
101708 |
Click to see
CC1=CC2C(CC1)C(=CCC2C(C)C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
alpha-Muurolene
|
12306047 |
Click to see
CC1=CC2C(CC1)C(=CCC2C(C)C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
Caryophyllene
|
5281515 |
Click to see
CC1=CCCC(=C)C2CC(C2CC1)(C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 https://doi.org/10.1002/FFJ.2730050209 |
Epicubenol
|
12046149 |
Click to see
CC1CCC(C2C1(CCC(=C2)C)O)C(C)C
|
222.37 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
gamma-Cadinene
|
15094 |
Click to see
CC1=CC2C(CC1)C(=C)CCC2C(C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
Humulene
|
5281520 |
Click to see
CC1=CCC(C=CCC(=CCC1)C)(C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aristolane sesquiterpenoids
|
1H-Cyclopropa(a)naphthalene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-, (1aR-(1aalpha,7alpha,7aalpha,7balpha))-
|
15560278 |
Click to see
CC1CCC=C2C1(C3C(C3(C)C)CC2)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
Calarene
|
28481 |
Click to see
CC1CCC=C2C1(C3C(C3(C)C)CC2)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> 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/10.1080/10412905.1993.9698206 |
(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/10.1080/10412905.1993.9698206 |
Alloaromadendren
|
91746537 |
Click to see
CC1CCC2C1C3C(C3(C)C)CCC2=C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
Ledum camphor
|
22297324 |
Click to see
CC1CCC2C1C3C(C3(C)C)CCC2(C)O
|
222.37 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids
|
Beta-Elemene
|
6918391 |
Click to see
CC(=C)C1CCC(C(C1)C(=C)C)(C)C=C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
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/NP980222Z |
> Organic acids and derivatives / Carboxylic acids and derivatives / Pentacarboxylic acids and derivatives
|
[3,4,5-Triacetyloxy-7-(6-oxo-2,3-dihydropyran-2-yl)hept-6-en-2-yl] acetate
|
433420 |
Click to see
CC(C(C(C(C=CC1CC=CC(=O)O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
|
426.40 |
unknown |
https://doi.org/10.1016/S0040-4020(00)00987-X |
Spicigeroide
|
10251859 |
Click to see
CC(C(C(C(C=CC1CC=CC(=O)O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
|
426.40 |
unknown |
https://doi.org/10.1016/S0040-4020(00)00987-X |
> Organoheterocyclic compounds / Heteroaromatic compounds
|
2-Pentylfuran
|
19602 |
Click to see
CCCCCC1=CC=CO1
|
138.21 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |
> Organoheterocyclic compounds / Naphthopyrans / Naphthopyranones
|
(1R,3S)-5,9,10-trihydroxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g]isochromene-6,7-dione
|
11109030 |
Click to see
CC1CC2=C(C(O1)C)C(=C3C(=CC(=O)C(=O)C3=C2O)O)O
|
290.27 |
unknown |
https://doi.org/10.1080/10412905.1993.9698206 |