Structure Information
Structure

Compound Identification

SMILES

CC(C)(S)[C@@H](N)C(O)=O.OC(=O)C1=CC(C=CC1=O)=NNC1=CC=C(C=C1)S(=O)(=O)NC1=CC=CC=N1

InChIKey

InChIKey=FHXPGIRHGIUADY-HVDRVSQOSA-N

Formula

C23H25N5O7S2

Mass

547.6

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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

Not available

Substituents

Valine or derivatives - Alpha-amino acid - Benzenesulfonamide - D-alpha-amino acid - Benzenesulfonyl group - Phenylhydrazine - Branched fatty acid - Thia fatty acid - Methyl-branched fatty acid - Monocyclic benzene moiety - Pyridine - Organosulfonic acid amide - Benzenoid - Imidolactam - Fatty acid - Fatty acyl - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Cyclic ketone - Amino acid - Ketone - Alkylthiol - Organoheterocyclic compound - Azacycle - Carboxylic acid - Hydrazone - Monocarboxylic acid or derivatives - Organic oxygen compound - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Primary amine - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - 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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