Calcium phosphorylcholine-d9 chloride

For research use only. Not for therapeutic Use.

  • CAT Number: R056872
  • CAS Number: 344299-43-0
  • Molecular Formula: C5H4D9CaClNO4P
  • Molecular Weight: 266.72
  • Purity: ≥95%
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Calcium phosphorylcholine-d9 (chloride) is the deuterium labeled Calcium phosphorylcholine chloride[1].
Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].


Catalog Number R056872
CAS Number 344299-43-0
Synonyms

calcium;2-[tris(trideuteriomethyl)azaniumyl]ethyl phosphate;chloride

Molecular Formula C5H4D9CaClNO4P
Purity ≥95%
InChI InChI=1S/C5H14NO4P.Ca.ClH/c1-6(2,3)4-5-10-11(7,8)9;;/h4-5H2,1-3H3,(H-,7,8,9);;1H/q;+2;/p-2/i1D3,2D3,3D3;;
InChIKey ICVPTJCCKTXCDT-VIVYLVLJSA-L
SMILES C[N+](C)(C)CCOP(=O)([O-])[O-].[Cl-].[Ca+2]
Reference

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-216.
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