Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@H](N)C(=O)NC1=C(SC=C1)C1=NC(=O)C(O)=C(N1)C(O)=O

InChIKey

InChIKey=QUONQSAAIJTJBF-ZETCQYMHSA-N

Formula

C14H16N4O5S

Mass

352.37

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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

Valine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Valine or derivatives - Alpha-amino acid amide - Hydropyrimidine carboxylic acid derivative - Pyrimidine-6-carboxylic acid - Pyrimidine-6-carboxylic acid or derivatives - N-arylamide - Hydroxypyrimidine - Pyrimidone - Fatty amide - Hydropyrimidine - Pyrimidine - Fatty acyl - Vinylogous acid - Heteroaromatic compound - Thiophene - Vinylogous amide - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid - Hydrocarbon derivative - Organonitrogen compound - Primary aliphatic amine - Amine - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Primary amine - Organic oxide - Carbonyl group - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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