Structure Information
Structure

Compound Identification

SMILES

CON=C(C(O)=NC1C2SCC(C[NH+]3CC=C(C=C3)C3=CN=CO3)=C(N2C1=O)C(O)=O)C1=CSC(=N)N1

InChIKey

InChIKey=ADGUEUOHDHTQEF-UHFFFAOYSA-O

Formula

C22H22N7O6S2

Mass

544.58

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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 - N-acyl-alpha amino acids and derivatives

Direct Parent

N-acyl-alpha amino acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-acyl-alpha-amino acid - Alpha-amino acid amide - Cephem - Thia fatty acid - Dihydropyridine - Fatty acyl - Hydropyridine - Meta-thiazine - Heteroaromatic compound - N,s-acetal - Meta-thiazoline - Thiazole - Tertiary carboxylic acid amide - Oxazole - Beta-lactam - Azole - Lactam - Carboxamide group - Azetidine - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Carboximidamide - Hemithioaminal - Thioether - Monocarboxylic acid or derivatives - Carboxylic acid - Carboximidic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Imine - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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