> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives
|
p-Anisaldehyde
|
31244 |
Click to see
COC1=CC=C(C=C1)C=O
|
136.15 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
> Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes
|
Methyleugenol
|
7127 |
Click to see
COC1=C(C=C(C=C1)CC=C)OC
|
178.23 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
> Benzenoids / Benzene and substituted derivatives / Phenylpropanes
|
2-(4-Methylphenyl)propan-2-ol
|
14529 |
Click to see
CC1=CC=C(C=C1)C(C)(C)O
|
150.22 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
4-Methoxyphenylacetone
|
31231 |
Click to see
CC(=O)CC1=CC=C(C=C1)OC
|
164.20 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
> Benzenoids / Phenol ethers / Anisoles
|
Anethole
|
637563 |
Click to see
CC=CC1=CC=C(C=C1)OC
|
148.20 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1055/S-2006-959548 |
Elemicin
|
10248 |
Click to see
COC1=CC(=CC(=C1OC)OC)CC=C
|
208.25 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
Estragole
|
8815 |
Click to see
COC1=CC=C(C=C1)CC=C
|
148.20 |
unknown |
https://doi.org/10.1055/S-2006-959548 https://doi.org/10.1055/S-0028-1099750 https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1016/S0031-9422(99)00158-2 |
Methoxy-4-propenylbenzene
|
7703 |
Click to see
CC=CC1=CC=C(C=C1)OC
|
148.20 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
> Benzenoids / Phenols / Methoxyphenols
|
Eugenol
|
3314 |
Click to see
COC1=C(C=CC(=C1)CC=C)O
|
164.20 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
|
gamma-Terpinene
|
7461 |
Click to see
CC1=CCC(=CC1)C(C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1055/S-2006-959548 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters
|
Citronellyl acetate
|
9017 |
Click to see
CC(CCC=C(C)C)CCOC(=O)C
|
198.30 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty aldehydes
|
Octadecanal
|
12533 |
Click to see
CCCCCCCCCCCCCCCCCC=O
|
268.50 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
|
2,6-Dimethyl-2,4,6-octatriene
|
5368821 |
Click to see
CC=C(C)C=CC=C(C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
beta-CITRONELLOL, (+/-)-
|
8842 |
Click to see
CC(CCC=C(C)C)CCO
|
156.26 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
Citronellal
|
7794 |
Click to see
CC(CCC=C(C)C)CC=O
|
154.25 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
Linalool, (+/-)-
|
6549 |
Click to see
CC(=CCCC(C)(C=C)O)C
|
154.25 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1055/S-2006-959548 |
Myrcene
|
31253 |
Click to see
CC(=CCCC(=C)C=C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1055/S-2006-959548 |
Nerol
|
643820 |
Click to see
CC(=CCCC(=CCO)C)C
|
154.25 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
|
Carvacrol
|
10364 |
Click to see
CC1=C(C=C(C=C1)C(C)C)O
|
150.22 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
p-CYMENE
|
7463 |
Click to see
CC1=CC=C(C=C1)C(C)C
|
134.22 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1055/S-2006-959548 |
Thymol
|
6989 |
Click to see
CC1=CC(=C(C=C1)C(C)C)O
|
150.22 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
|
(5S)-4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane
|
6429260 |
Click to see
CC(C)C12CCC(=C)C1C2
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol
|
64685 |
Click to see
CC1(C2CCC1(C(C2)O)C)C
|
154.25 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
alpha-PINENE
|
6654 |
Click to see
CC1=CCC2CC1C2(C)C
|
136.23 |
unknown |
https://doi.org/10.1055/S-2006-959548 https://doi.org/10.1080/10412905.1995.9698530 |
beta-Pinene
|
14896 |
Click to see
CC1(C2CCC(=C)C1C2)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1055/S-2006-959548 |
Camphene
|
6616 |
Click to see
CC1(C2CCC(C2)C1=C)C
|
136.23 |
unknown |
https://doi.org/10.1055/S-2006-959548 https://doi.org/10.1080/10412905.1995.9698530 |
Camphor
|
2537 |
Click to see
CC1(C2CCC1(C(=O)C2)C)C
|
152.23 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
CID 44630107
|
44630107 |
Click to see
CC1(C2CCC1(C(C2)O)C)C
|
154.25 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
Sabinen
|
18818 |
Click to see
CC(C)C12CCC(=C)C1C2
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1055/S-2006-959548 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
|
4-Terpineol, (+/-)-
|
11230 |
Click to see
CC1=CCC(CC1)(C(C)C)O
|
154.25 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
alpha-PHELLANDRENE
|
7460 |
Click to see
CC1=CCC(C=C1)C(C)C
|
136.23 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
Alpha-Terpineol
|
17100 |
Click to see
CC1=CCC(CC1)C(C)(C)O
|
154.25 |
unknown |
https://doi.org/10.1055/S-2006-959548 https://doi.org/10.1080/10412905.1995.9698530 |
Limonene, (+/-)-
|
22311 |
Click to see
CC1=CCC(CC1)C(=C)C
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1055/S-2006-959548 |
p-Menth-3-en-1-ol
|
11468 |
Click to see
CC(C)C1=CCC(CC1)(C)O
|
154.25 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
Terpinolene
|
11463 |
Click to see
CC1=CCC(=C(C)C)CC1
|
136.23 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1055/S-2006-959548 |
> 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/10.1080/10412905.1995.9698530 |
(R)-beta-bisabolene
|
68128 |
Click to see
CC1=CCC(CC1)C(=C)CCC=C(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
1-Ethenyl-1,2-dimethyl-4-propan-2-ylidene-2-prop-1-en-2-ylcyclohexane
|
5317024 |
Click to see
CC(=C1CCC(C(C1)(C)C(=C)C)(C)C=C)C
|
218.38 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
2-Isopropenyl-1-methyl-4-(1-methylethylidene)-1-vinylcyclohexane
|
6432312 |
Click to see
CC(=C1CCC(C(C1)C(=C)C)(C)C=C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
Beta-Bisabolene
|
10104370 |
Click to see
CC1=CCC(CC1)C(=C)CCC=C(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
beta-CARYOPHYLLENE OXIDE
|
1742210 |
Click to see
CC1(CC2C1CCC3(C(O3)CCC2=C)C)C
|
220.35 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
Cadina-1(10),4-diene
|
10223 |
Click to see
CC1=CC2C(CCC(=C2CC1)C)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
Carotol
|
442347 |
Click to see
CC1=CCC2(CCC(C2(CC1)O)C(C)C)C
|
222.37 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
Caryophyllene
|
5281515 |
Click to see
CC1=CCCC(=C)C2CC(C2CC1)(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-959548 https://doi.org/10.1080/10412905.1995.9698530 |
Caryophyllene epoxide
|
14350 |
Click to see
CC1(CC2C1CCC3(C(O3)CCC2=C)C)C
|
220.35 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
gamma-Muurolene
|
12313020 |
Click to see
CC1=CC2C(CC1)C(=C)CCC2C(C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1055/S-2006-959548 |
Humulene
|
5281520 |
Click to see
CC1=CCC(C=CCC(=CCC1)C)(C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids
|
(1aS,4aS,7aS,7bR)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene
|
91746456 |
Click to see
CC1CCC2C1C3C(C3(C)C)CCC2=C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
(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/10.1080/10412905.1995.9698530 |
(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/10.1080/10412905.1995.9698530 |
Aromadendrene
|
91354 |
Click to see
CC1CCC2C1C3C(C3(C)C)CCC2=C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
Viridiflorene
|
10910653 |
Click to see
CC1CCC2=C(CCC3C(C12)C3(C)C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Bicyclogermacrane and isolepidozane sesquiterpenoids
|
(1S,2E,10R)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene
|
44583886 |
Click to see
CC1=CCCC(=CC2C(C2(C)C)CC1)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
Bicyclogermacrene
|
5315347 |
Click to see
CC1=CCCC(=CC2C(C2(C)C)CC1)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
|
4a,5-Dimethyl-3-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene
|
288227 |
Click to see
CC1CCC=C2C1(CC(CC2)C(=C)C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
Valencene
|
9855795 |
Click to see
CC1CCC=C2C1(CC(CC2)C(=C)C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-959548 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
|
7-epi-alpha-Selinene
|
10123 |
Click to see
CC1=CCCC2(C1CC(CC2)C(=C)C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
alpha-Selinene
|
10856614 |
Click to see
CC1=CCCC2(C1CC(CC2)C(=C)C)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 |
beta-Selinene
|
442393 |
Click to see
CC(=C)C1CCC2(CCCC(=C)C2C1)C
|
204.35 |
unknown |
https://doi.org/10.1080/10412905.1995.9698530 https://doi.org/10.1055/S-2006-959548 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
86821 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00158-2 |
24-Ethylcholest-5-en-3beta-ol
|
22012 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00158-2 |
> Organoheterocyclic compounds / Benzodioxoles
|
Safrole
|
5144 |
Click to see
C=CCC1=CC2=C(C=C1)OCO2
|
162.18 |
unknown |
https://doi.org/10.1055/S-2006-959548 https://doi.org/10.1080/10412905.1995.9698530 |
> Phenylpropanoids and polyketides / Cinnamyl alcohols
|
CID 95641
|
95641 |
Click to see
COC1=CC=C(C=C1)C=CCO
|
164.20 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00158-2 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
|
Kaempferol 3-sophoroside-7-rhamnoside
|
102004842 |
Click to see
CC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)C6=CC=C(C=C6)O)O)O)O)O
|
756.70 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00377-5 |