Structure Information
Structure

Compound Identification

SMILES

CCN1C2=NC=C(CCOC3=C(C)C=C(C=C3)C(=O)NC(C)(C)C(O)=O)C=C2C(=O)N(C)C2=C1N=CC=C2

InChIKey

InChIKey=ZNCLUSNKLXGPPC-UHFFFAOYSA-N

Formula

C28H31N5O5

Mass

517.586

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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 - Alkyldiarylamine - Pyrido-para-diazepine - Alpha-amino acid or derivatives - M-toluamide - Toluamide - Benzoyl - Phenoxy compound - Phenol ether - Toluene - Para-diazepine - Alkyl aryl ether - Imidolactam - Pyridine - Vinylogous amide - Tertiary carboxylic acid amide - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Amine - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen 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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