Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=CS1)C(=N\OCC1=CC=CC=C1)\C(=O)NC1C2COC(CSC3=NN=CS3)=C(N2C1=O)C(O)=O

InChIKey

InChIKey=VVRKMFXXKLWQJY-MBTHVWNTSA-N

Formula

C22H19N7O6S3

Mass

573.62

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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 - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - 1,3-thiazol-2-amine - Azole - Beta-lactam - Tertiary carboxylic acid amide - Thiadiazole - Thiazole - Vinylogous ester - Heteroaromatic compound - Azetidine - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Lactam - Sulfenyl compound - Thioether - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Primary amine - Amine - 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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