Structure Information
Structure

Compound Identification

SMILES

C[C@H]1CC[C@@H](N1C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(N)=O)NC(=O)C1=NC2=CC=CC=C2C=C1)C(F)(F)F

InChIKey

InChIKey=GTHFBJCQIIGZMN-RXZDJQSYSA-N

Formula

C30H34F3N5O4

Mass

585.628

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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

Asparagine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Asparagine or derivatives - Quinoline-2-carboxamide - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenylbutylamine - Quinoline - Amphetamine or derivatives - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Aralkylamine - N-acyl-amine - Fatty acyl - Fatty amide - Benzenoid - N-alkylpyrrolidine - Pyridine - Monocyclic benzene moiety - Pyrrolidine - Heteroaromatic compound - 1,2-aminoalcohol - Carboxamide group - Primary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Organohalogen compound - Organofluoride - Hydrocarbon derivative - Organic oxide - Alcohol - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Alkyl fluoride - Alkyl halide - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as asparagine and derivatives. These are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine 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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