ALPHA-BISABOLANE

Structure

2D structure of ALPHA-BISABOLANE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 520453

Names and identifiers

Name

ALPHA-BISABOLANE

IUPAC name

1-methyl-4-(6-methylheptan-2-yl)cyclohexane

SMILES

CC1CCC(CC1)C(C)CCCC(C)C

General information

Molecular formula

C15H30

Molecular weight

210.41 g/mol

Monoisotopic mass

210.2348 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Calendula arvensis (Vaill.) L. aerial parts -
Ahmed, A.A., Jakupovic, J., Mabry, T.J. (1993). Sesquiterpene glycosides from Calendula arvensis. J Nat Prod, 56(10), 1821-1824 doi:10.1021/np50100a025