Structure Information
Structure

Compound Identification

SMILES

NC(=O)C(CC(O)=O)N1C(C2=CC=CC=C2C1=O)[N+]([O-])=O

InChIKey

InChIKey=KAVNWXNGATWEDC-UHFFFAOYSA-N

Formula

C12H11N3O6

Mass

293.235

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Aspartic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aspartic acid or derivatives - Indolyl carboxylic acid derivative - Isoindolone - Indole - Isoindoline - Isoindole - Isoindole or derivatives - Fatty amide - Fatty acyl - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Organic nitro compound - Lactam - C-nitro compound - Primary carboxylic acid amide - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic salt - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aspartic acid and derivatives. These are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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