Structure Information
Structure

Compound Identification

SMILES

N[C@@H](CC(=O)N1CCN2N=C(N=C2C1)C1CC1)CC1=CC(F)=C(F)C=C1F

InChIKey

InChIKey=LAJLTISZRIAEIN-GFCCVEGCSA-N

Formula

C18H20F3N5O

Mass

379.387

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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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Beta amino acid or derivatives - Amphetamine or derivatives - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - 1,2,4-triazole - Carboxamide group - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organohalogen compound - Primary aliphatic amine - Organic nitrogen compound - Amine - Organofluoride - Carbonyl group - Organic oxygen compound - Organic oxide - Organonitrogen compound - Primary amine - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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