Compound Identification
SMILES
[Cl-].[Ca++].[2H]C([2H])([2H])[N+](CCOP([O-])([O-])=O)(C([2H])([2H])[2H])C([2H])([2H])[2H]
InChIKey
InChIKey=ICVPTJCCKTXCDT-VIVYLVLJSA-L
Formula
C5H13CaClNO4P
Mass
266.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
-
Subclass
Quaternary ammonium salts
-
Level 5
Cholines
- Level 6 Phosphocholines
-
Level 5
Cholines
-
Subclass
Quaternary ammonium salts
-
Class
Organonitrogen compounds
-
Superclass
Organic nitrogen compounds
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Quaternary ammonium salts
Intermediate Tree Nodes
Cholines
Direct Parent
Phosphocholines
Alternative Parents
Alkyl phosphates Tetraalkylammonium salts Organic metal halides Organic calcium salts Organooxygen compounds Organic oxides Organic chloride salts Hydrocarbon derivatives Amines Organic cations
Molecular Framework
Aliphatic acyclic compounds
Substituents
Phosphocholine - Organic phosphoric acid derivative - Phosphoric acid ester - Alkyl phosphate - Tetraalkylammonium salt - Organic calcium salt - Organic metal halide - Amine - Organic oxygen compound - Organic salt - Organic chloride salt - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic cation - 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