Structure Information
Structure

Compound Identification

SMILES

CC(=C)C(=O)OCC[N+](C)(C)C.CC(C)(CS([O-])(=O)=O)NC(=O)C=C

InChIKey

InChIKey=UGYWEAYDPJVTCV-UHFFFAOYSA-M

Formula

C16H30N2O6S

Mass

378.48

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic nitrogen compounds

Class

Organonitrogen compounds

Subclass

Quaternary ammonium salts

Intermediate Tree Nodes

Cholines

Direct Parent

Acyl cholines

Alternative Parents

Molecular Framework

Not available

Substituents

Acyl choline - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Tetraalkylammonium salt - Acrylic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Amine - Organic oxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic cation - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as acyl cholines. These are acylated derivatives of choline. Choline or 2-Hydroxy-N,N,N-trimethylethanaminium is a quaternary ammonium salt with the chemical formula (CH3)3N+(CH2)2OH.

External Descriptors

Not available

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