Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@@H](NC(=O)C1=CC=C(C=C1)N(CC#C)CC1=CC2=C(NC(C)=NC2=O)C=C1)C(O)=O

InChIKey

InChIKey=AXUMAJPONGIXCH-JOCHJYFZSA-N

Formula

C25H26N4O4

Mass

446.507

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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

N-acyl-alpha amino acid or derivatives - Valine or derivatives - N-acyl-alpha-amino acid - Hippuric acid - Diazanaphthalene - Alpha-amino acid or derivatives - Aminobenzamide - Aminobenzoic acid or derivatives - Quinazoline - Benzoyl - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aralkylamine - Pyrimidone - Pyrimidine - Vinylogous amide - Heteroaromatic compound - Amino acid - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Acetylide - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organopnictogen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen 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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