Structure Information
Structure

Compound Identification

SMILES

CC(C)(C(O)=O)C1=CC(NC(=O)[C@@H](CC2=CC=CC=C2)NCC2=CSC=N2)=CC(=C1)C1=CC=NC=C1

InChIKey

InChIKey=BGZGDSKLOGUSNM-RUZDIDTESA-N

Formula

C28H28N4O3S

Mass

500.62

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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 - Alpha-amino acid amide - 4-phenylpyridine - Amphetamine or derivatives - Phenylpropane - Anilide - N-arylamide - Aralkylamine - Pyridine - Monocyclic benzene moiety - Benzenoid - Fatty amide - Fatty acyl - Azole - Heteroaromatic compound - Thiazole - Amino acid - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid - Secondary aliphatic amine - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Secondary amine - Amine - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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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