Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(N)CC1=C(Br)C(Br)=C(C(=O)C2=CC=CC=C2)C(Br)=C1Br

InChIKey

InChIKey=WCTHHTAPPPZOML-UHFFFAOYSA-N

Formula

C17H13Br4NO3

Mass

598.911

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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

Phenylalanine and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Phenylalanine or derivatives - Benzophenone - Alpha-amino acid ester - Aryl-phenylketone - Diphenylmethane - Amphetamine or derivatives - Benzoyl - Aryl ketone - Aralkylamine - Bromobenzene - Fatty acid ester - Halobenzene - Fatty acyl - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Methyl ester - Vinylogous halide - Carboxylic acid ester - Ketone - Monocarboxylic acid or derivatives - Primary amine - Hydrocarbon derivative - Primary aliphatic amine - Carbonyl group - Amine - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound

Description

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