Structure Information
Structure

Compound Identification

SMILES

COc1ccc(CS(=O)(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N2CCC[C@H]2C#N)cc1

InChIKey

InChIKey=GCXSCVHFOOOAMN-PKOBYXMFSA-N

Formula

C23H33N3O6S

Mass

479.59

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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 - Phenoxy compound - Anisole - N-acylpyrrolidine - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Pyrrolidine - Sulfone - Sulfonyl - Tertiary carboxylic acid amide - Carbamic acid ester - Carboxamide group - Azacycle - Nitrile - Carbonitrile - Ether - Organoheterocyclic compound - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Cyanide - 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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