BETA-GUAIENE

Structure

2D structure of BETA-GUAIENE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 15560252

Names and identifiers

Name

BETA-GUAIENE

IUPAC name

(1S,4S)-1,4-dimethyl-7-(propan-2-ylidene)-1,2,3,4,5,6,7,8-octahydroazulene

SMILES

C[C@H]1CCC(=C(C)C)CC2=C1CC[C@@H]2C

General information

Molecular formula

C15H24

Molecular weight

204.36 g/mol

Monoisotopic mass

204.1878 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Erigeron annuus (L.) Desf. flower, essential oil -
Miyazawa, M., Kameoka, H. (1979). The constituents of the essential oil from Erigeron annuus. Agr Biol Chem, 43, 2199-2201 doi:10.1271/bbb1961.43.2199
Erigeron annuus (L.) Desf. leaf, essential oil -
Miyazawa, M., Kameoka, H. (1979). The constituents of the essential oil from Erigeron annuus. Agr Biol Chem, 43, 2199-2201 doi:10.1271/bbb1961.43.2199
Erigeron annuus (L.) Desf. stem, essential oil -
Miyazawa, M., Kameoka, H. (1979). The constituents of the essential oil from Erigeron annuus. Agr Biol Chem, 43, 2199-2201 doi:10.1271/bbb1961.43.2199