Structure Information
Structure

Compound Identification

SMILES

[Cl-].CCCCCCCCNC(=O)[C@H](CC1=CC=C(OC(=O)OCC2=CC=CC=C2Br)C=C1)NC(=O)C1CCC(C[NH3+])CC1

InChIKey

InChIKey=PJPBAJQATFXTDU-UMNWNVFJSA-N

Formula

C33H47BrClN3O5

Mass

681.11

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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 - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Amphetamine or derivatives - Benzyloxycarbonyl - Phenoxy compound - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Carbonic acid diester - Fatty amide - Fatty acyl - Benzenoid - Quaternary ammonium salt - Secondary carboxylic acid amide - Carboxamide group - Carbonic acid derivative - Organic salt - Amine - Primary aliphatic amine - Organic chloride salt - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Primary amine - Organobromide - Organonitrogen compound - Organic zwitterion - Organic oxygen 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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