Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)N(C(CC(=O)NCC1=CC(OC(F)(F)F)=CC=C1)C1CCN(CC1)C1=NC=CC(\C=C2\SC(=O)NC2=O)=N1)C(O)=O

InChIKey

InChIKey=WVIBYIDDVKOPCV-HYARGMPZSA-N

Formula

C29H33F3N6O6S

Mass

650.67

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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 - Phenoxy compound - Phenol ether - Dialkylarylamine - Aminopyrimidine - Thiazolidinedione - Monocyclic benzene moiety - Fatty amide - Piperidine - Pyrimidine - Benzenoid - Fatty acyl - Heteroaromatic compound - Thiazolidine - Dicarboximide - Thiocarbamic acid derivative - Trihalomethane - Secondary carboxylic acid amide - Carbamic acid - Carbamic acid derivative - Carboxamide group - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organohalogen compound - Alkyl halide - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxide - Organic oxygen compound - Amine - Halomethane - Alkyl fluoride - 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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