Structure Information
Structure

Compound Identification

SMILES

CC(C)CC(NC(=O)C1CCC(C)CC1)C(=O)OCC(=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=APRVYNXXRHPGLX-UHFFFAOYSA-N

Formula

C22H30BrNO4

Mass

452.389

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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

Leucine and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Leucine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alkyl-phenylketone - Phenylketone - Benzoyl - Aryl ketone - Aryl alkyl ketone - Alpha-acyloxy ketone - Fatty acid ester - Halobenzene - Bromobenzene - Benzenoid - Aryl bromide - Fatty acyl - Monocyclic benzene moiety - Aryl halide - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Ketone - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organobromide - Organic oxide - Organohalogen compound - Aromatic homomonocyclic compound

Description

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