Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(CCP(=O)(OCC)OCC)NC(=O)C1=CC=C(C=C1)N(C)CC1=CN=C2N=C(N)N=C(N)C2=N1

InChIKey

InChIKey=KBLMREUHQIPPKS-UHFFFAOYSA-N

Formula

C25H35N8O6P

Mass

574.579

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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

Direct Parent

Hippuric acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid or derivatives - Aminobenzamide - Aminobenzoic acid or derivatives - Pteridine - Aniline or substituted anilines - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Benzoyl - Dialkyl alkylphosphonate - Aminopyrimidine - Fatty acid ester - Phosphonic acid diester - Aralkylamine - Phosphonic acid ester - Pyrimidine - Fatty acyl - Imidolactam - Pyrazine - Organophosphonic acid derivative - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Tertiary amine - Secondary carboxylic acid amide - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organic oxide - Organic nitrogen compound - Amine - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Primary amine - Organophosphorus compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.

External Descriptors

Not available

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