Structure Information
Structure

Compound Identification

SMILES

OC(=O)CNC(=O)C1=CC=C(CNC(=O)C2=CC(=NC=N2)C(=O)NCC2=CC3=C(OCC3)C=C2)C=C1

InChIKey

InChIKey=WWTGSDVPGHMSES-UHFFFAOYSA-N

Formula

C25H23N5O6

Mass

489.488

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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

Benzamides - Hippuric acids and derivatives

Direct Parent

Hippuric acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Hippuric acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Coumaran - Pyrimidine-6-carboxylic acid or derivatives - 2-heteroaryl carboxamide - Benzoyl - Alkyl aryl ether - Pyrimidine - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Ether - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hippuric acids. These are compounds containing hippuric acid, which consists of a of a benzoyl group linked to the N-terminal of a glycine.

External Descriptors

Not available

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