Structure Information
Structure

Compound Identification

SMILES

CCC1=C(C(=O)NC(CC2=CC=C(C=C2)C2=CC=C(CNC3=NC=CN3)N2)C(O)=O)C(C)=CC(F)=C1

InChIKey

InChIKey=URAIJVMITBBRHV-UHFFFAOYSA-N

Formula

C27H28FN5O3

Mass

489.551

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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 - Hippuric acid or derivatives - Hippuric acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - 3-phenylpropanoic-acid - 2-phenylpyrrole - Amphetamine or derivatives - Halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - O-toluamide - Toluamide - Benzoic acid or derivatives - Benzamide - Benzoyl - Imidazolyl carboxylic acid derivative - Fluorobenzene - Toluene - Halobenzene - Substituted pyrrole - Benzenoid - Aminoimidazole - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Imidazole - Pyrrole - Heteroaromatic compound - Azole - Carboxamide group - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid - Organoheterocyclic compound - Amine - Carbonyl group - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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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