Structure Information
Structure

Compound Identification

SMILES

CCC(C)[C@H](NC[C@@H](N)CS)C(=O)N[C@H](CN[C@@H](CCSC)C(O)=O)CC1=CC=CC=C1

InChIKey

InChIKey=XEDXTEZWILWFIY-UQRQBEMFSA-N

Formula

C23H40N4O3S2

Mass

484.72

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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

Isoleucine and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Isoleucine or derivatives - Methionine or derivatives - Alpha-amino acid amide - Alpha-amino acid - Amphetamine or derivatives - L-alpha-amino acid - Aralkylamine - Thia fatty acid - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Fatty amide - N-acyl-amine - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Alkylthiol - Dialkylthioether - Carboxylic acid - Secondary aliphatic amine - Sulfenyl compound - Monocarboxylic acid or derivatives - Thioether - Secondary amine - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Carbonyl group - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as isoleucine and derivatives. These are compounds containing isoleucine or a derivative thereof resulting from reaction of isoleucine 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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