Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCC(O)\C=C\C(=O)CCC1=CC(OC)=C(O)C=C1

InChIKey

InChIKey=XSLAWFMJLBIOGI-BUHFOSPRSA-N

Formula

C21H32O4

Mass

348.483

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenols

Subclass

Methoxyphenols

Intermediate Tree Nodes

Not available

Direct Parent

Shogaols

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Shogaol - Fatty alcohol - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Monocyclic benzene moiety - Fatty acyl - Enone - Acryloyl-group - Alpha,beta-unsaturated ketone - Ketone - Secondary alcohol - Ether - Alcohol - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as shogaols. These are ginger derivatives containing a shogaol moiety, which consists of a benzene ring bearing a dec-4-en-3-one moiety, a methoxyphenyl group, a hydroxyl group and at positions 1, 3, and 4, respectively.

External Descriptors

Not available

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