Structure Information
Structure

Compound Identification

SMILES

O[C@H]1CO[C@@]2(O)[C@@H]1OC(=O)[C@]2(O)[C@H](CC(O)=O)C1=CC=C(O)C=C1

InChIKey

InChIKey=MQVWOYQLIZIHNH-CFEZUGBKSA-N

Formula

C15H16O9

Mass

340.284

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Phenylpropanoic acids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpropanoic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-phenylpropanoic-acid - Isosorbide - Furofuran - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Gamma butyrolactone - Monosaccharide - Benzenoid - Oxolane - Tertiary alcohol - Lactone - Secondary alcohol - Hemiacetal - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Polyol - Carboxylic acid - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Organic oxide - Carbonyl group - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.

External Descriptors

Not available

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