Structure Information
Structure

Compound Identification

SMILES

CN1C(CNC2=CC=C(C=C2)C(=O)NC(CCC(O)=N)C(O)=O)CN=C2NC(N)N=C(O)C12

InChIKey

InChIKey=LDOWWMMYXFEPRG-UHFFFAOYSA-N

Formula

C20H28N8O5

Mass

460.495

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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 - N-acyl-alpha-amino acid - Hippuric acid - Pterin - Alpha-amino acid or derivatives - Aminobenzamide - Aminobenzoic acid or derivatives - Pteridine - Phenylalkylamine - Aniline or substituted anilines - Benzoyl - Secondary aliphatic/aromatic amine - Aminopyrimidine - Hydropyrimidine - 1,2,5,6-tetrahydropyrimidine - Imidolactam - Cyclic carboximidic acid - Carboxamide group - Amino acid - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Orthocarboxylic acid derivative - Ortho amide - Amidine - Azacycle - Organoheterocyclic compound - Carboxylic acid amidine - Carboximidic acid - Carboximidic acid derivative - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Secondary amine - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Amine - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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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