> 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/10.1016/0378-8741(89)90113-X https://doi.org/10.1021/NP50047A042 |
> Benzenoids / Phenol ethers / Anisoles
|
Elemicin
|
10248 |
Click to see
COC1=CC(=CC(=C1OC)OC)CC=C
|
208.25 |
unknown |
https://doi.org/10.1021/NP50047A042 |
> Benzenoids / Phenols / Methoxyphenols
|
Eugenol
|
3314 |
Click to see
COC1=C(C=CC(=C1)CC=C)O
|
164.20 |
unknown |
https://doi.org/10.1021/NP50047A042 https://doi.org/10.1021/NP50015A012 |
o-Methoxy-o-methyl-p-allylphenol
|
45266909 |
Click to see
CC1=CC(=CC(=C1O)OC)CC=C
|
178.23 |
unknown |
https://doi.org/10.1021/NP50015A012 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
|
1-Octanol
|
957 |
Click to see
CCCCCCCCO
|
130.23 |
unknown |
https://doi.org/10.1021/NP50047A042 |
1-Octen-3-Ol
|
18827 |
Click to see
CCCCCC(C=C)O
|
128.21 |
unknown |
https://doi.org/10.1021/NP50047A042 |
3-Octanol
|
11527 |
Click to see
CCCCCC(CC)O
|
130.23 |
unknown |
https://doi.org/10.1021/NP50047A042 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids
|
Phytol
|
5280435 |
Click to see
CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C
|
296.50 |
unknown |
https://doi.org/10.1021/NP50015A012 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
|
3-Ethenyl-3,7-dimethyloct-6-enoic acid
|
13128171 |
Click to see
CC(=CCCC(C)(CC(=O)O)C=C)C
|
196.29 |
unknown |
https://doi.org/10.1021/NP50015A012 |
beta-OCIMENE, (3E)-
|
5281553 |
Click to see
CC(=CCC=C(C)C=C)C
|
136.23 |
unknown |
https://doi.org/10.1016/0378-8741(89)90113-X https://doi.org/10.1021/NP50047A042 |
beta-Ocimene, (3Z)-
|
5320250 |
Click to see
CC(=CCC=C(C)C=C)C
|
136.23 |
unknown |
https://doi.org/10.1016/0378-8741(89)90113-X https://doi.org/10.1021/NP50047A042 https://doi.org/10.1021/NP50015A012 |
Linalool, (+/-)-
|
6549 |
Click to see
CC(=CCCC(C)(C=C)O)C
|
154.25 |
unknown |
https://doi.org/10.1021/NP50015A012 https://doi.org/10.1021/NP50047A042 https://doi.org/10.1055/S-2007-969121 |
Myrcene
|
31253 |
Click to see
CC(=CCCC(=C)C=C)C
|
136.23 |
unknown |
https://doi.org/10.1055/S-2007-969121 https://doi.org/10.1021/NP50047A042 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
|
2-Isopropyl-5-methylanisole
|
14104 |
Click to see
CC1=CC(=C(C=C1)C(C)C)OC
|
164.24 |
unknown |
https://doi.org/10.1055/S-2007-969121 |
p-CYMENE
|
7463 |
Click to see
CC1=CC=C(C=C1)C(C)C
|
134.22 |
unknown |
https://doi.org/10.1055/S-2007-969121 https://doi.org/10.1021/NP50047A042 |
Thymol
|
6989 |
Click to see
CC1=CC(=C(C=C1)C(C)C)O
|
150.22 |
unknown |
https://doi.org/10.1021/NP50047A042 https://doi.org/10.1055/S-2007-969121 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
|
(1R)-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene
|
6451618 |
Click to see
CC1=CCC2(C1C2)C(C)C
|
136.23 |
unknown |
https://doi.org/10.1021/NP50047A042 |
3-Carene
|
26049 |
Click to see
CC1=CCC2C(C1)C2(C)C
|
136.23 |
unknown |
https://doi.org/10.1055/S-2007-969121 |
alpha-PINENE
|
6654 |
Click to see
CC1=CCC2CC1C2(C)C
|
136.23 |
unknown |
https://doi.org/10.1021/NP50015A012 https://doi.org/10.1021/NP50047A042 https://doi.org/10.1055/S-2007-969121 |
beta-Pinene
|
14896 |
Click to see
CC1(C2CCC(=C)C1C2)C
|
136.23 |
unknown |
https://doi.org/10.1021/NP50015A012 https://doi.org/10.1021/NP50047A042 |
Bicyclo[3.1.0]hex-2-ene, 2-methyl-5-(1-methylethyl)-
|
17868 |
Click to see
CC1=CCC2(C1C2)C(C)C
|
136.23 |
unknown |
https://doi.org/10.1021/NP50047A042 |
Camphene
|
6616 |
Click to see
CC1(C2CCC(C2)C1=C)C
|
136.23 |
unknown |
https://doi.org/10.1055/S-2007-969121 https://doi.org/10.1021/NP50047A042 |
Sabinen
|
18818 |
Click to see
CC(C)C12CCC(=C)C1C2
|
136.23 |
unknown |
https://doi.org/10.1021/NP50047A042 https://doi.org/10.1055/S-2007-969121 |
Umbellulone
|
91195 |
Click to see
CC1=CC(=O)C2(C1C2)C(C)C
|
150.22 |
unknown |
https://doi.org/10.1055/S-2007-969121 |
Umbellulone
|
442504 |
Click to see
CC1=CC(=O)C2(C1C2)C(C)C
|
150.22 |
unknown |
https://doi.org/10.1055/S-2007-969121 |
> 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/10.1055/S-2007-969121 |
Alpha-Terpineol
|
17100 |
Click to see
CC1=CCC(CC1)C(C)(C)O
|
154.25 |
unknown |
https://doi.org/10.1021/NP50047A042 |
Limonene, (+/-)-
|
22311 |
Click to see
CC1=CCC(CC1)C(=C)C
|
136.23 |
unknown |
https://doi.org/10.1021/NP50047A042 https://doi.org/10.1055/S-2007-969121 |
Menthol
|
1254 |
Click to see
CC1CCC(C(C1)O)C(C)C
|
156.26 |
unknown |
https://doi.org/10.1055/S-2007-969121 |
> 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/10.1021/NP50047A042 |
(1R,2S,7S,8S)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene
|
92042749 |
Click to see
CC1=CCC2C3C1C2(CCC3C(C)C)C
|
204.35 |
unknown |
https://doi.org/10.1021/NP50047A042 |
(1R,4S,4aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
|
5315592 |
Click to see
CC1=CC2C(CCC(C2CC1)(C)O)C(C)C
|
222.37 |
unknown |
https://doi.org/10.1055/S-2007-969121 |
(R)-beta-bisabolene
|
68128 |
Click to see
CC1=CCC(CC1)C(=C)CCC=C(C)C
|
204.35 |
unknown |
https://doi.org/10.1021/NP50015A012 |
alpha-Cadinol
|
10398656 |
Click to see
CC1=CC2C(CCC(C2CC1)(C)O)C(C)C
|
222.37 |
unknown |
https://doi.org/10.1055/S-2007-969121 |
Alpha-Farnesene
|
5281516 |
Click to see
CC(=CCCC(=CCC=C(C)C=C)C)C
|
204.35 |
unknown |
https://doi.org/10.1021/NP50047A042 |
Beta-Bisabolene
|
10104370 |
Click to see
CC1=CCC(CC1)C(=C)CCC=C(C)C
|
204.35 |
unknown |
https://doi.org/10.1021/NP50015A012 |
beta-Cubebene
|
93081 |
Click to see
CC1CCC(C2C13C2C(=C)CC3)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1021/NP50015A012 |
Caryophyllene
|
5281515 |
Click to see
CC1=CCCC(=C)C2CC(C2CC1)(C)C
|
204.35 |
unknown |
https://doi.org/10.1021/NP50047A042 https://doi.org/10.1055/S-2007-969121 https://doi.org/10.1021/NP50015A012 |
CID 16396350
|
16396350 |
Click to see
CC1(CCCC2(C3C1C(C2=C)CC3)C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2007-969121 |
Copaene
|
19725 |
Click to see
CC1=CCC2C3C1C2(CCC3C(C)C)C
|
204.35 |
unknown |
https://doi.org/10.1021/NP50047A042 |
gamma-Cadinene
|
15094 |
Click to see
CC1=CC2C(CC1)C(=C)CCC2C(C)C
|
204.35 |
unknown |
https://doi.org/10.1021/NP50047A042 |
Humulene
|
5281520 |
Click to see
CC1=CCC(C=CCC(=CCC1)C)(C)C
|
204.35 |
unknown |
https://doi.org/10.1021/NP50047A042 |
Longifolene
|
289151 |
Click to see
CC1(CCCC2(C3C1C(C2=C)CC3)C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2007-969121 |
> 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/10.1021/NP50047A042 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
|
beta-Selinene
|
442393 |
Click to see
CC(=C)C1CCC2(CCCC(=C)C2C1)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2007-969121 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Germacrane sesquiterpenoids
|
(S,1Z,6Z)-8-Isopropyl-1-methyl-5-methylenecyclodeca-1,6-diene
|
91723653 |
Click to see
CC1=CCCC(=C)C=CC(CC1)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1021/NP50047A042 |
Germacrene D
|
5317570 |
Click to see
CC1=CCCC(=C)C=CC(CC1)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1021/NP50047A042 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Estrane steroids / Estrogens and derivatives
|
Ethinyl Estradiol
|
5991 |
Click to see
CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)O
|
296.40 |
unknown |
https://doi.org/10.1021/NP50015A012 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
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/10.1021/NP50015A012 |
Stigmasterol
|
5280794 |
Click to see
CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1021/NP50015A012 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
|
3-Octanone
|
246728 |
Click to see
CCCCCC(=O)CC
|
128.21 |
unknown |
https://doi.org/10.1021/NP50047A042 |
> Organoheterocyclic compounds / Benzodioxoles
|
Apiole
|
10659 |
Click to see
COC1=C2C(=C(C(=C1)CC=C)OC)OCO2
|
222.24 |
unknown |
https://doi.org/10.1021/NP50047A042 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Cinnamic acid esters
|
3-Phenyl-2-propenoic acid methyl ester
|
7644 |
Click to see
COC(=O)C=CC1=CC=CC=C1
|
162.18 |
unknown |
https://doi.org/10.1021/NP50047A042 |
Methyl cinnamate
|
637520 |
Click to see
COC(=O)C=CC1=CC=CC=C1
|
162.18 |
unknown |
https://doi.org/10.1021/NP50047A042 |