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CHEBI:61040 - phosphorylcholine chloride
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ChEBI Ontology
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ChEBI Name
phosphorylcholine chloride
ChEBI ID
CHEBI:61040
Definition
An organic chloride salt comprising a choline phosphate cation and chloride anion.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C5H15ClNO4P
Net Charge
0
Average Mass
219.60400
Monoisotopic Mass
219.04272
InChI
InChI=1S/C5H14NO4P.ClH/c1-6(2,3)4-5-10-11(7,8)9;/h4-5H2,1-3H3,(H-,7,8,9);1H
InChIKey
PYJNAPOPMIJKJZ-UHFFFAOYSA-N
SMILES
[Cl-].C[N+](C)(C)CCOP(O)(O)=O
ChEBI Ontology
Outgoing
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
Sources
[2-(phosphonooxy)ethyl]trimethylammonium chloride
ChEBI
choline phosphate chloride
ChemIDplus
PC-Cl
ChEBI
phosphocholine chloride
ChEBI
trimethyl(2-(phosphonooxy)ethyl)ammonium chloride
ChemIDplus
Registry Numbers
Types
Sources
107-73-3
CAS Registry Number
ChemIDplus
3743805
Reaxys Registry Number
Reaxys
Citations
Types
Sources
10862788
PubMed citation
Europe PMC
846320
PubMed citation
Europe PMC
Last Modified
17 February 2011
General Comment
2011-01-18
Its calcium and magnesium salts are used therapeutically in hepatobiliary dysfunction.