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Substance Name: Phosphorylcholine calcium chloride
RN: 15557-11-6
InChIKey: ICVPTJCCKTXCDT-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formulas

  • C5-H15-N-O4-P.x-Ca.Cl
  • C5-H15-N-O4-P.x-Ca.Cl.4H2-O

Molecular Weight

  • 257.666
 
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Names and Synonyms

Results Name

  • Phosphorylcholine calcium chloride

Synonyms

  • Calcium phosphocholine chloride
  • Calcium phosphocholine tetrahydrate
  • EINECS 239-610-9
  • Ethanaminium, N,N,N-trimethyl-2-(phosphonooxy)-, chloride calcium salt, tetrahydrate
  • Phosphorylcholine calcium chloride
  • Trans-colin

Systematic Names

  • Choline chloride O-(calcium phosphate)
  • Choline, chloride, dihydrogen phosphate calcium (8CI)
  • Choline, chloride, dihydrogen phosphate calcium, tetrahydrate
  • Ethanaminium, N,N,N-trimethyl-2-(phosphonooxy)-, chloride calcium (9CI)

Registry Numbers

CAS Registry Number

  • 15557-11-6

System Generated Number

  • 0015557116

Molecular Formulas

Molecular Formulas

  • C5-H15-N-O4-P.x-Ca.Cl
  • C5-H15-N-O4-P.x-Ca.Cl.4H2-O

Molecular Formula Fragments

  • C5-H15-N-O4-P
  • Ca
  • Cl
  • COMPONENT
  • H2-O

Structure Descriptors

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

InChIKey

ICVPTJCCKTXCDT-UHFFFAOYSA-L

Smiles

P(=O)(OCC[N+](C)(C)C)([O-])[O-].[ClH-].[Ca+2]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 1600mg/kg (1600mg/kg)   Zhongguo Yaoxue Zazhi. Chinese Pharmacuetical Journal. Vol. 27, Pg. 692, 1992.
mouse LD50 oral 12900mg/kg (12900mg/kg)   Zhongguo Yaoxue Zazhi. Chinese Pharmacuetical Journal. Vol. 27, Pg. 692, 1992.