Structure Information
Structure

Compound Identification

SMILES

[O-]C(=O)C(F)(F)F.COC(=O)[C@H](CC1=CC=CC(=C1)C([NH3+])=N)[C@H](NC(=O)C1=CC(C)=CC=C1)\C=C\C1=CC=CC=C1

InChIKey

InChIKey=KFXLJKDXRASFMA-NNHHTGDISA-N

Formula

C30H30F3N3O5

Mass

569.581

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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

Not available

Substituents

Beta amino acid or derivatives - Benzamide - Benzoic acid or derivatives - M-toluamide - Toluamide - Benzoyl - Styrene - Fatty acid ester - Toluene - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Methyl ester - Quaternary ammonium salt - Secondary carboxylic acid amide - Carboxylic acid salt - Carboxylic acid ester - Carboxamide group - Carboximidamide - Amidine - Monocarboxylic acid or derivatives - Carboxylic acid amidine - Carboxylic acid - Organonitrogen compound - Alkyl fluoride - Carbonyl group - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organooxygen compound - Alkyl halide - Organofluoride - Aromatic homomonocyclic 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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