Structure Information
Structure

Compound Identification

SMILES

O[C@H](CNC(=O)C1=CC=C(CN(C(=O)NC2=CC3=C(OC(F)(F)OC3(F)F)C=C2)C2=CC=C(C=C2)C2=CCCCC2)C=C1)C(O)=O

InChIKey

InChIKey=SPYNVKYBDKGKEH-AREMUKBSSA-N

Formula

C32H29F4N3O7

Mass

643.592

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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 - Benzo-1,3-dioxane - Benzodioxane - N-phenylurea - Benzamide - Benzoic acid or derivatives - Benzoyl - Alpha-hydroxy acid - Monocyclic benzene moiety - Benzenoid - Hydroxy acid - Monosaccharide - Urea - Secondary carboxylic acid amide - Carboxamide group - Secondary alcohol - Monocarboxylic acid or derivatives - Oxacycle - Carboxylic acid - Organoheterocyclic compound - Organofluoride - Carbonyl group - Alkyl fluoride - Alcohol - Alkyl halide - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organohalogen 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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