Structure Information
Structure

Compound Identification

SMILES

CC(OC1=CC=C(CC(NC2=CC=CC=C2C(=O)C2=CC=CC=C2)C(O)=O)C=C1)C1=NC2=C(N1)C=C(OC1=CC(C)=C(NC(=O)NC3=CC=C(C=C3)C(F)(F)F)C(C)=C1)C=C2

InChIKey

InChIKey=VTEOPOLFBORXNQ-UHFFFAOYSA-N

Formula

C47H40F3N5O6

Mass

827.861

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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 heteropolycyclic compounds

Substituents

Phenylalanine or derivatives - Benzophenone - Diphenylmethane - Aryl-phenylketone - Diaryl ether - 3-phenylpropanoic-acid - N-phenylurea - Alpha-amino acid - Amphetamine or derivatives - Trifluoromethylbenzene - Benzimidazole - Phenoxy compound - Phenol ether - M-xylene - Benzoyl - Aryl ketone - Xylene - Aniline or substituted anilines - Phenylalkylamine - Alkyl aryl ether - Aralkylamine - Secondary aliphatic/aromatic amine - Benzenoid - Monocyclic benzene moiety - Azole - Vinylogous amide - Imidazole - Heteroaromatic compound - Urea - Ketone - Amino acid - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Amine - Organofluoride - Organohalogen compound - Organopnictogen compound - 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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