Structure Information
Structure

Compound Identification

SMILES

COC1=C(O)C=CC(CCC(=O)\C=C\CCCCCCCO)=C1

InChIKey

InChIKey=QXSULCQXDCGMJE-VQHVLOKHSA-N

Formula

C19H28O4

Mass

320.429

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