Structure Information
Structure

Compound Identification

SMILES

[Na+].[H]C(N)(CSCC([O-])=N[C@]1(OC)C(=O)N2C(C(O)=O)=C(CSC3=NN=NN3C)CS[C@]12[H])C(O)=O

InChIKey

InChIKey=SBIDXLKJYJVQOE-ZMUPEPPLSA-M

Formula

C16H20N7NaO7S3

Mass

541.55

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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

N-acyl-alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Cysteine or derivatives - Alpha-amino acid - Cephem - Aryl thioether - Alkylarylthioether - Meta-thiazine - Dicarboxylic acid or derivatives - Tetrazole - Tertiary carboxylic acid amide - Azole - Heteroaromatic compound - Beta-lactam - Azetidine - Amino acid - Carboxamide group - Lactam - Azacycle - Carboximidic acid - Carboximidic acid derivative - Organic alkali metal salt - Carboxylic acid - Organoheterocyclic compound - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Hemithioaminal - Sulfenyl compound - Organic salt - Hydrocarbon derivative - Organic sodium salt - Primary aliphatic amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Carbonyl group - Organic oxygen compound - Amine - Organic oxide - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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