Structure Information
Structure

Compound Identification

SMILES

CC1=NC(Cl)=C(C=C1)C1(NC2=CC=CC=C2N1)[C@H](C1CCCCC1)C(=O)NC1CCCCC1

InChIKey

InChIKey=LTXPIGIBNKEFFE-XMMPIXPASA-N

Formula

C27H35ClN4O

Mass

467.05

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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 - Benzimidazole - 2-halopyridine - Methylpyridine - Aryl chloride - Aryl halide - Fatty amide - Pyridine - Fatty acyl - Benzenoid - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen 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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