Structure Information
Structure

Compound Identification

SMILES

COS([O-])(=O)=O.CCCCCCCC\C=C\CCCCCCCC(=O)NCC[N+](C)(CCO)CCNC(=O)CCCCCCC\C=C\CCCCCCCC

InChIKey

InChIKey=CRNOHKQARKZYBD-RRCQUFFISA-N

Formula

C44H87N3O7S

Mass

802.25

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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

Not available

Direct Parent

Cholines

Alternative Parents

Molecular Framework

Not available

Substituents

Choline - Fatty amide - N-acyl-amine - Fatty acyl - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Tetraalkylammonium salt - Organic sulfuric acid or derivatives - 1,2-aminoalcohol - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Alkanolamine - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Carbonyl group - Amine - Organooxygen compound - Primary alcohol - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as cholines. These are organic compounds containing a N,N,N-trimethylethanolammonium cation.

External Descriptors

Not available

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