Structure Information
Structure

Compound Identification

SMILES

COC1=C(O)C(C(=O)\C=C\C=C\C=C/C(O)=O)=C(O)C(CCCCCC(O)=O)=C1O

InChIKey

InChIKey=CBVZKEVESCFLRS-UPLAUGARSA-N

Formula

C21H24O9

Mass

420.414

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenols

Subclass

Benzenetriols and derivatives

Intermediate Tree Nodes

Phloroglucinols and derivatives

Direct Parent

Acylphloroglucinols and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Acylphloroglucinol derivative - Methoxyphenol - 4-alkoxyphenol - Medium-chain keto acid - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Aryl ketone - Phenol ether - Alkyl aryl ether - Hydroxy fatty acid - Fatty acyl - Monocyclic benzene moiety - Unsaturated fatty acid - Dicarboxylic acid or derivatives - Acryloyl-group - Vinylogous acid - Alpha,beta-unsaturated ketone - Enone - Ketone - Polyol - Carboxylic acid - Carboxylic acid derivative - Ether - Carbonyl group - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as acylphloroglucinols and derivatives. These are phloroglucinol derivatives characterized by the presence of a COR group.

External Descriptors

Not available

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