NEROL ISO-VALERATE

Structure

2D structure of NEROL ISO-VALERATE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 6429039

Names and identifiers

Name

NEROL ISO-VALERATE

IUPAC name

(Z)-3,7-dimethylocta-2,6-dien-1-yl 3-methylbutanoate

SMILES

CC(C)CC(=O)OC/C=C(/C)\CCC=C(C)C

General information

Molecular formula

C15H26O2

Molecular weight

238.37 g/mol

Monoisotopic mass

238.1933 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Eupatorium cannabinum L. subsp. cannabinum aerial parts -
Zdero, C., Bohlmann, F. (1987). Eupatoriopicrin 19-o-linolenoate and other constituents from Eupatorium cannabium. Planta Med, 53(2), 169-172 doi:10.1055/s-2006-962665