Structure Information
Structure

Compound Identification

SMILES

CCC(C)C(NC(=O)C1CCCCC1)C(=O)N1CCN(CC1)C(=O)NC1=CC=CC(=C1)C(F)(F)F

InChIKey

InChIKey=ROEQOIXIPDXLBM-UHFFFAOYSA-N

Formula

C25H35F3N4O3

Mass

496.575

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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 heteromonocyclic compounds

Substituents

Isoleucine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Trifluoromethylbenzene - N-phenylurea - Piperazine-1-carboxamide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Urea - Carboxamide group - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organic oxygen compound - Alkyl halide - Organonitrogen compound - Carbonyl group - Alkyl fluoride - Organooxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic 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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