Structure Information
Structure

Compound Identification

SMILES

[Cl-].[K+].OC(=O)CCNC(=O)C(CC1=CC=CC=C1)CP(O)(=O)OCCC1=CC=CC=C1

InChIKey

InChIKey=MYNJKHDWLQGTQW-UHFFFAOYSA-M

Formula

C21H26ClKNO6P

Mass

493.96

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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 homomonocyclic compounds

Substituents

Beta amino acid or derivatives - Monocyclic benzene moiety - Fatty amide - Phosphonic acid ester - Benzenoid - Fatty acyl - Organophosphonic acid - Organophosphonic acid derivative - Carboxamide group - Secondary carboxylic acid amide - Organic metal halide - Organic alkali metal salt - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic zwitterion - Carbonyl group - Organic salt - Organic potassium salt - Hydrocarbon derivative - Organic oxide - Organic chloride salt - 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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