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Substance Name: Choline, iodide, nicotinate, N-oxide
RN: 51505-44-3
InChIKey: KLHXJLFXBCHSRE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H17-N2-O3.I

Molecular Weight

  • 352.1663
 
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Names and Synonyms

  • Choline, iodide, nicotinate, N-oxide
  • Ethanaminium, 2-((3-pyridinylcarbonyl)oxy)-N,N,N-trimethyl-, iodide, N-oxide (9CI)

Registry Numbers

CAS Registry Number

  • 51505-44-3

System Generated Number

  • 0051505443

Molecular Formulas

Molecular Formula

  • C11-H17-N2-O3.I

Molecular Formula Fragments

  • C11-H17-N2-O3
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C11H17IN2O3/c1-14(2,3)10(12)8-17-11(15)9-5-4-6-13(16)7-9/h4-5,7,10H,6,8H2,1-3H3

InChIKey

KLHXJLFXBCHSRE-UHFFFAOYSA-N

Smiles

C[N+](C)(C)C(COC(=O)C1=CN(CC=C1)[O-])I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 380mg/kg (380mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 25, Pg. 447, 1973.