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CHEBI:61040 - phosphorylcholine chloride

ChEBI IDCHEBI:61040
ChEBI Namephosphorylcholine chloride
Stars
DefinitionAn organic chloride salt comprising a choline phosphate cation and chloride anion.
Last Modified17 February 2011
Submitterzjosephs
DownloadsMolfile
FormulaC5H15NO4P.Cl
Net Charge0
Average Mass219.605
Monoisotopic Mass219.04272
SMILESC[N+](C)(C)CCOP(=O)(O)O.[Cl-]
InChIInChI=1S/C5H14NO4P.ClH/c1-6(2,3)4-5-10-11(7,8)9;/h4-5H2,1-3H3,(H-,7,8,9);1H
InChIKeyPYJNAPOPMIJKJZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
phosphorylcholine chloride (CHEBI:61040) has part chloride (CHEBI:17996)
phosphorylcholine chloride (CHEBI:61040) has part phosphocholine (CHEBI:18132)
phosphorylcholine chloride (CHEBI:61040) is a organic chloride salt (CHEBI:36094)
IUPAC Name 
N,N,N-trimethyl-2-(phosphonooxy)ethanaminium chloride
Synonyms  Source
trimethyl(2-(phosphonooxy)ethyl)ammonium chlorideChemIDplus
choline phosphate chlorideChemIDplus
[2-(phosphonooxy)ethyl]trimethylammonium chlorideChEBI
PC-ClChEBI
phosphocholine chlorideChEBI
Registry NumbersSources
Reaxys:3743805Reaxys
CAS:107-73-3ChemIDplus
Citations