Structure Information
Structure

Compound Identification

SMILES

NC1=NC2=NC=C(CN3CCSC4=C3C=CC(=C4)C(=O)N[C@H](CCCC(O)=O)C(O)=O)N=C2C(N)=N1

InChIKey

InChIKey=WEEYASWRWODDTJ-CYBMUJFWSA-N

Formula

C22H24N8O5S

Mass

512.55

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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 - Benzothiazine - Pteridine - Aryl thioether - Tertiary aliphatic/aromatic amine - Medium-chain fatty acid - Dialkylarylamine - Aminopyrimidine - Heterocyclic fatty acid - Alkylarylthioether - Aralkylamine - Para-thiazine - Dicarboxylic acid or derivatives - Pyrazine - Pyrimidine - Benzenoid - Fatty acyl - Imidolactam - Fatty acid - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Tertiary amine - Amino acid - Carboxylic acid - Organoheterocyclic compound - Azacycle - Thioether - Organic nitrogen compound - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Primary amine - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - 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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