Structure Information
Structure

Compound Identification

SMILES

CC(=O)C[C@]12OC[C@H](COC(=O)C3=CC=CC=C3)[C@H]1CC(=O)O2

InChIKey

InChIKey=KPLJENFVVZWBMN-JJRVBVJISA-N

Formula

C17H18O6

Mass

318.325

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoate ester - Benzoyl - Furofuran - Ketal - Dicarboxylic acid or derivatives - Gamma butyrolactone - Tetrahydrofuran - Carboxylic acid ester - Lactone - Ketone - Acetal - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

CHEBI:66718 : benzoate ester

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