Structure Information
Structure

Compound Identification

SMILES

OC(=O)\C=C/C(O)=O.CNCC1=CC2=C(C=C1)N(C)C(=O)N(C2=O)C1=CC=C(C[C@H](NC(=O)C2=C(Cl)C=CC=C2Cl)C(=O)OC(C)C)C=C1

InChIKey

InChIKey=WLKJPELNJHVEGQ-GCCVQAHUSA-N

Formula

C34H34Cl2N4O9

Mass

713.57

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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

Not available

Substituents

Phenylalanine or derivatives - Alpha-amino acid ester - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Amphetamine or derivatives - Quinazoline - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - 1,3-dichlorobenzene - Benzoyl - Halobenzene - Fatty acid ester - Pyrimidone - Chlorobenzene - Aralkylamine - Unsaturated fatty acid - Fatty acid - Aryl halide - Fatty acyl - Aryl chloride - Pyrimidine - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous amide - Vinylogous halide - Urea - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Secondary aliphatic amine - Secondary amine - Carboxylic acid - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Carbonyl group - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Aromatic heteropolycyclic 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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