Structure Information
Structure

Compound Identification

SMILES

C[C@]12CC(=O)O[C@@H](C[C@H]1OC(=O)C1=CC=CC=C1)[C@@]21CO1

InChIKey

InChIKey=IASBPBCPSLLTEF-KNPMLCFXSA-N

Formula

C16H16O5

Mass

288.299

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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 - Caprolactone - Delta valerolactone - Delta_valerolactone - Oxepane - Oxane - Lactone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Ether - Oxirane - Dialkyl ether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - 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

Not available

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