Structure Information
Structure

Compound Identification

SMILES

CN([C@H](CCN)C(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CC1=CC=C(Cl)C=C1)C(=O)N1CCN(CC1)C1=CC=C(C=C1)[N+]([O-])=O)C(=O)OCC1=CC=CC=C1

InChIKey

InChIKey=LIZQOPCFVMLFJD-UJTUJTOWSA-N

Formula

C42H48ClN7O7

Mass

798.34

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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 heteromonocyclic compounds

Substituents

Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenylpiperazine - N-arylpiperazine - Amphetamine or derivatives - Benzyloxycarbonyl - Nitrobenzene - Nitroaromatic compound - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Fatty amide - N-acyl-amine - Fatty acyl - Piperazine - Benzenoid - Carbamic acid ester - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Tertiary amine - Carboxamide group - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Azacycle - Primary amine - Primary aliphatic amine - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic salt - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Carbonyl group - Organic oxide - Aromatic heteromonocyclic 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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