Structure Information
Structure

Compound Identification

SMILES

[H]C(O)(CCCCCCCCCCC(C)C)C([H])(O)C([H])(COP([O-])(=O)OCC[N+](C)(C)C)N=C(O)CCCCCCCCCCCCCCCCCCCC

InChIKey

InChIKey=ILXLWZXMPXDRTR-UHFFFAOYSA-N

Formula

C43H89N2O7P

Mass

777.166

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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

Phosphocholines

Alternative Parents

Molecular Framework

Aliphatic acyclic compounds

Substituents

Phosphocholine - Dialkyl phosphate - Organic phosphoric acid derivative - Phosphoric acid ester - Alkyl phosphate - Tetraalkylammonium salt - 1,2-diol - Secondary alcohol - Carboximidic acid - Carboximidic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Alcohol - Organic oxygen compound - Organic salt - Amine - Organic zwitterion - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as phosphocholines. These are compounds containing a [2-(trimethylazaniumyl)ethoxy]phosphonic acid or derivative.

External Descriptors

Not available

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