Structure Information
Structure

Compound Identification

SMILES

NC(CC(C(C(O)=O)C(=O)CCC(O)=O)C1=CC=CC=C1)C(O)=O

InChIKey

InChIKey=OHNYZVPEQBLONT-UHFFFAOYSA-N

Formula

C16H19NO7

Mass

337.328

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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 homomonocyclic compounds

Substituents

3-phenylpropanoic-acid - Alpha-amino acid - Alpha-amino acid or derivatives - Tricarboxylic acid or derivatives - Gamma-keto acid - Amino fatty acid - Beta-keto acid - Aralkylamine - Monocyclic benzene moiety - Beta-hydroxy ketone - Keto acid - Fatty acyl - Benzenoid - 1,3-dicarbonyl compound - Ketone - Amino acid - Amino acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Primary aliphatic amine - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Organic oxide - Aromatic homomonocyclic 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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