Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@H](NC(=O)C1=CC=NN2C(=NN=C12)C1=CC=C(NC(=O)NC2=CC=CC=C2C(F)(F)F)C=C1)C(O)=O

InChIKey

InChIKey=HCQURUWHBZJGSG-IBGZPJMESA-N

Formula

C25H22F3N7O4

Mass

541.491

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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 - N-acyl-alpha amino acids and derivatives

Direct Parent

N-acyl-alpha amino acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Valine or derivatives - N-acyl-alpha-amino acid - Phenyltriazole - Phenyl-1,2,4-triazole - Trifluoromethylbenzene - N-phenylurea - Triazolopyridazine - Monocyclic benzene moiety - Benzenoid - Pyridazine - Triazole - Azole - Vinylogous amide - 1,2,4-triazole - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Urea - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organohalogen compound - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Organic oxide - Carbonyl group - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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