Structure Information
Structure

Compound Identification

SMILES

CCCCC(CN[C@@H](CC(O)=O)C1=CC2=C(OCO2)C=C1)N1C=C(C)C=C(CC2=CC=C(Cl)C=C2)C1=O

InChIKey

InChIKey=IJKZVBOGWFPKSL-BBMPLOMVSA-N

Formula

C29H33ClN2O5

Mass

525.04

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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 - Benzodioxole - Pyridinone - Halobenzene - Aralkylamine - Dihydropyridine - Methylpyridine - Chlorobenzene - Pyridine - Aryl chloride - Hydropyridine - Monocyclic benzene moiety - Aryl halide - Benzenoid - Heteroaromatic compound - Lactam - Amino acid - Acetal - Carboxylic acid - Oxacycle - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Organic nitrogen compound - Amine - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen 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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