Structure Information
Structure

Compound Identification

SMILES

CC(=O)OC\C=C\C1CC2=CC(=O)[C@](C)(OC(=O)c3c(C)cc(O)cc3O)C(=O)C2=CO1

InChIKey

InChIKey=TYURHYMMTQGDOP-LLSAIIIMSA-N

Formula

C23H22O9

Mass

442.42

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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 heteropolycyclic compounds

Substituents

P-hydroxybenzoic acid alkyl ester - O-hydroxybenzoic acid ester - Dihydroxybenzoic acid - Benzopyran - Salicylic acid or derivatives - Benzoyl - M-cresol - Resorcinol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Cyclohexenone - Toluene - Dicarboxylic acid or derivatives - Vinylogous acid - Vinylogous ester - Ketone - Carboxylic acid ester - Cyclic ketone - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic 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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