Structure Information
Structure

Compound Identification

SMILES

CC(C)CC(NC(=O)[C@H](CNC(=O)C1=CC=CC=C1[N+]([O-])=O)NC(=O)C1=CC=CC(=C1)C1=CC=CC=C1)C(=O)C1(CO)CO1

InChIKey

InChIKey=FGNLLQNYHKGSBA-GLSDHEMCSA-N

Formula

C32H34N4O8

Mass

602.644

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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 heteromonocyclic compounds

Substituents

Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Biphenyl - Beta amino acid or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - Beta-hydroxy ketone - Organic nitro compound - Carboxamide group - Ketone - Secondary carboxylic acid amide - C-nitro compound - Oxacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Organic salt - Organic zwitterion - Primary alcohol - Organooxygen compound - Carbonyl group - Organonitrogen compound - Aromatic heteromonocyclic 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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