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Structure Information
Structure

Compound Identification

SMILES

[Na+].[Na+].[Na+].[Na+].CC1=C(Cl)C(NC2=CC(N=NC3C(=O)N(N=C3C([O-])=O)C3=C(C=CC(=C3)S([O-])(=O)=O)S([O-])(=O)=O)=C(C=C2)S([O-])(=O)=O)=NC(F)=N1

InChIKey

InChIKey=KIIXPAIWMJQRPR-UHFFFAOYSA-J

Formula

C21H11ClFN7Na4O12S3

Mass

795.94

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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 - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Aniline or substituted anilines - Aminopyrimidine - 2-halopyrimidine - Halopyrimidine - Aryl chloride - Aryl fluoride - Pyrimidine - Benzenoid - Pyrazolinone - Imidolactam - Aryl halide - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Pyrazoline - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Heteroaromatic compound - Amino acid - Carboxylic acid salt - Azo compound - Organic metal halide - Azacycle - Organic alkali metal salt - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Organohalogen compound - Organic oxide - Organic salt - Organic nitrogen compound - Carbonyl group - Organic sodium salt - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Amine - Organic oxygen compound - 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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