Structure Information
Structure

Compound Identification

SMILES

OC(C(=O)NC1[C@H]2SCC(CSC3=NN=C(CS(O)(=O)=O)O3)(CN2C1=O)C(O)=O)C1=CC=CC=C1

InChIKey

InChIKey=XRWWEHXIGDUISW-VAWZVNNESA-N

Formula

C19H20N4O9S3

Mass

544.57

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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 - Cepham - Aryl thioether - Alkylarylthioether - 1,3-thiazinane - Monocyclic benzene moiety - Benzenoid - Oxadiazole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Beta-lactam - Alkanesulfonic acid - Azole - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Tertiary carboxylic acid amide - 1,3,4-oxadiazole - Azetidine - Carboxamide group - Lactam - Secondary alcohol - Secondary carboxylic acid amide - Thioether - Hemithioaminal - Organoheterocyclic compound - Sulfenyl compound - Dialkylthioether - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Oxacycle - Organic oxygen compound - Organonitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Aromatic alcohol - Organic nitrogen compound - 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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