Structure Information
Structure

Compound Identification

SMILES

N[C@@H](CC(=O)N1CC2=CC=CC=C2C[C@H]1CNS(=O)(=O)C1CC1)CC1=CC=CC=C1F

InChIKey

InChIKey=ZNTOIAJPUWOMAA-UXHICEINSA-N

Formula

C23H28FN3O3S

Mass

445.55

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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 - Tetrahydroisoquinoline - Halobenzene - Fluorobenzene - Aralkylamine - Aryl fluoride - Organic sulfonic acid amide - Organosulfonic acid amide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Organosulfonic acid or derivatives - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Sulfonyl - Carboxamide group - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Primary aliphatic amine - Primary amine - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organosulfur 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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