Structure Information
Structure

Compound Identification

SMILES

CC(O)C(C)(O)C(=O)OCC1CCN2CCC(OC(=O)c3ccccc3O)C12

InChIKey

InChIKey=HQNBAGWQDKKAMY-UHFFFAOYSA-N

Formula

C20H27NO7

Mass

393.436

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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

Direct Parent

o-Hydroxybenzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

O-hydroxybenzoic acid ester - Salicylic acid or derivatives - Benzoyl - Pyrrolizidine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Beta-hydroxy acid - Fatty acid ester - Phenol - Dicarboxylic acid or derivatives - Hydroxy acid - Fatty acyl - N-alkylpyrrolidine - Pyrrolidine - Vinylogous acid - Tertiary alcohol - 1,2-diol - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Carbonyl group - Organic oxygen compound - Organooxygen compound - Alcohol - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as o-hydroxybenzoic acid esters. These are benzoic acid esters where the benzene ring is ortho-substituted with a hydroxy group.

External Descriptors

Not available

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