453-16-7 Purity
95%+
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Specification
The molecular formula is C5H13CaClNO4P.
Some synonyms include CALCIUM PHOSPHORYLCHOLINE CHLORIDE, Trans-colin, and Phosphocholine Chloride Calcium Salt.
The CAS number is 4826-71-5.
The IUPAC name is calcium;2-(trimethylazaniumyl)ethyl phosphate;chloride.
The InChI key is ICVPTJCCKTXCDT-UHFFFAOYSA-L.
The canonical SMILES is C[N+](C)(C)CCOP(=O)([O-])[O-].[Cl-].[Ca+2].
The EC number is 225-403-0.
The DSSTox Substance ID is DTXSID601335812.
The Wikidata ID is Q27286216.
The computed date is 2005-08-08.