Structure Information
Structure

Compound Identification

SMILES

NC1=NC(NCCC(O)=O)=NC(N\N=C\C2=CC=C(O2)[N+]([O-])=O)=N1

InChIKey

InChIKey=WQVOIDNJZCYHFY-LHHJGKSTSA-N

Formula

C11H12N8O5

Mass

336.268

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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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Beta amino acid or derivatives - 2,4-diamine-s-triazine - Nitroaromatic compound - 2-nitrofuran - Amino-1,3,5-triazine - Aminotriazine - N-aliphatic s-triazine - 1,3,5-triazine - Triazine - Furan - Heteroaromatic compound - Amino acid - C-nitro compound - Organic nitro compound - Carboxylic acid - Hydrazone - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary amine - Amine - Organic salt - Organic zwitterion - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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