Structure Information
Structure

Compound Identification

SMILES

CN1N=NN=C1SCC1=C(N2C(OC1)[C@H](NC(=O)C(C(O)=O)C1=CC=C(O)C=C1)C2=O)C(O)=O

InChIKey

InChIKey=OEUQQPZNNLKCNZ-BWBHSNQOSA-N

Formula

C19H18N6O8S

Mass

490.45

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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 - Dicarboxylic acid or derivatives - 1,3-dicarbonyl compound - Benzenoid - Azole - Beta-lactam - Tertiary carboxylic acid amide - Tetrazole - Heteroaromatic compound - Azetidine - Tertiary amine - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Lactam - Thioether - Organoheterocyclic compound - Azacycle - Oxacycle - Sulfenyl compound - Carboxylic acid - Amine - Organic oxygen compound - Organic oxide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Organosulfur compound - Hydrocarbon derivative - 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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