Structure Information
Structure

Compound Identification

SMILES

CC[C@H](C)[C@H](NC(=O)CN1CCN(CC1)C1=CC=CC(C)=C1C)C(=O)OC

InChIKey

InChIKey=BTFKAYOMPNMTTI-YWZLYKJASA-N

Formula

C21H33N3O3

Mass

375.513

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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 - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenylpiperazine - N-arylpiperazine - N-piperazineacetamide - O-xylene - Xylene - Aniline or substituted anilines - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Fatty acid ester - N-alkylpiperazine - Benzenoid - Fatty acyl - Piperazine - Monocyclic benzene moiety - 1,4-diazinane - Methyl ester - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Amine - Organooxygen compound - 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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