Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1CCN(CC1)C(=O)CC(NC(=O)C(F)(F)F)C1=CC=CS1

InChIKey

InChIKey=GKPPUXKFKLATRX-UHFFFAOYSA-N

Formula

C16H19F3N2O4S

Mass

392.39

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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 heteromonocyclic compounds

Substituents

Beta amino acid or derivatives - N-acyl-piperidine - Piperidinecarboxylic acid - Piperidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiophene - Methyl ester - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic nitrogen compound - Aromatic heteromonocyclic 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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