Structure Information
Structure

Compound Identification

SMILES

[Na+].[Na+].[Na+].COC1=NC(Cl)=NC(NC2=C(C=C(N=NC3C(C)=NN(C3=O)C3=CC=C(C=C3)S([O-])(=O)=O)C(=C2)S([O-])(=O)=O)S([O-])(=O)=O)=N1

InChIKey

InChIKey=AGFKGCBQQDZVOK-UHFFFAOYSA-K

Formula

C20H14ClN8Na3O11S3

Mass

742.98

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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

Alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid or derivatives - Benzenesulfonate - Benzenesulfonyl group - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - 2-methoxy-1,3,5-triazine - Alkoxy-s-triazine - Aniline or substituted anilines - Alkyl aryl ether - Chloro-s-triazine - Halo-s-triazine - Amino-1,3,5-triazine - Aminotriazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrazolinone - Triazine - Benzenoid - 1,3,5-triazine - Heteroaromatic compound - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrazoline - Azo compound - Organic alkali metal salt - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Secondary amine - Organic metal halide - Propargyl-type 1,3-dipolar organic compound - Ether - Organic sodium salt - Organic nitrogen compound - Organochloride - Organohalogen compound - Organonitrogen compound - Carbonyl group - Amine - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organosulfur compound - Organic oxide - Organic salt - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.

External Descriptors

Not available

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