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Substance Name: Choline, iodide, 10,11-dihydro-5-hydroxy-5H-benzo(4,5)cyclohepta(1,2-b)pyridine-5-carboxylate
RN: 34222-76-9
InChIKey: PDOGINLRZBKKSN-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-N2-O3.I

Molecular Weight

  • 468.328
 
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Names and Synonyms

  • Choline, iodide, 10,11-dihydro-5-hydroxy-5H-benzo(4,5)cyclohepta(1,2-b)pyridine-5-carboxylate

Registry Numbers

CAS Registry Number

  • 34222-76-9

System Generated Number

  • 0034222769

Molecular Formulas

Molecular Formula

  • C20-H25-N2-O3.I

Molecular Formula Fragments

  • C20-H25-N2-O3
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C20H25N2O3.HI/c1-22(2,3)13-14-25-19(23)20(24)16-8-5-4-7-15(16)10-11-18-17(20)9-6-12-21-18;/h4-9,12,24H,10-11,13-14H2,1-3H3;1H/q+1;/p-1

InChIKey

PDOGINLRZBKKSN-UHFFFAOYSA-M

Smiles

C(OCC[N+](C)(C)C)(=O)[C@@]1(c2c(CCc3c1cccn3)cccc2)O.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2800mg/kg (2800mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 1415, 1971.