Structure Information
Structure

Compound Identification

SMILES

OC1C(O)C(COC(=O)C2=CC(O)=C(O)C=C2)OC(OC(=O)C2=CC(O)=C(O)C=C2)C1O

InChIKey

InChIKey=VNQNUULCMPXFER-UHFFFAOYSA-N

Formula

C20H20O12

Mass

452.368

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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

Benzoic acid esters - p-Hydroxybenzoic acid esters

Direct Parent

p-Hydroxybenzoic acid alkyl esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

P-hydroxybenzoic acid alkyl ester - M-hydroxybenzoic acid ester - Dihydroxybenzoic acid - Benzoyl - Catechol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Oxane - Monosaccharide - Dicarboxylic acid or derivatives - Secondary alcohol - Carboxylic acid ester - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Acetal - Oxacycle - Organooxygen compound - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as p-hydroxybenzoic acid alkyl esters. These are aromatic compounds containing a benzoic acid, which is esterified with an alkyl group and para-substituted with a hydroxyl group.

External Descriptors

Not available

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