Structure Information
Structure

Compound Identification

SMILES

[Na+].CO[C@]1(NC(=O)CC2=CC=C(O)C=C2)C2OCC(CSC3=NN=NN3C)=C(N2C1=O)C([O-])=O

InChIKey

InChIKey=QOGAZMZQIIYESJ-YHBSKVLESA-M

Formula

C19H19N6NaO7S

Mass

498.45

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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 - Phenylacetamide - Oxacephem - Aryl thioether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Azole - Beta-lactam - Heteroaromatic compound - Tertiary carboxylic acid amide - Tetrazole - Azetidine - Carboxamide group - Carboxylic acid salt - Lactam - Amino acid - Secondary carboxylic acid amide - Tertiary amine - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Oxacycle - Thioether - Organic alkali metal salt - Carboxylic acid - Monocarboxylic acid or derivatives - Organic salt - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Amine - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic sodium salt - Organic zwitterion - Carbonyl group - 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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