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Substance Name: 9H-Pyrido(3,4-b)indolium, 2-(3-(trimethylammonio)propyl)-, dibromide
RN: 63731-88-4
InChIKey: YXWKGHSFQVHHSO-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H21-N3.2Br

Molecular Weight

  • 429.198
 
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Names and Synonyms

Synonyms

  • Ammonium, (3-(pyrido(3,4-b)indolinio)propyl)trimethyl-, dibromide
  • IN 226

Systematic Name

  • 9H-Pyrido(3,4-b)indolium, 2-(3-(trimethylammonio)propyl)-, dibromide

Registry Numbers

CAS Registry Number

  • 63731-88-4

System Generated Number

  • 0063731884

Molecular Formulas

Molecular Formula

  • C17-H21-N3.2Br

Molecular Formula Fragments

  • Br
  • C17-H21-N3
  • COMPONENT

Structure Descriptors

InChI

1S/C17H22N3.2BrH/c1-20(2,3)12-6-10-19-11-9-17-15(13-19)14-7-4-5-8-16(14)18-17;;/h4-5,7-9,11,13H,6,10,12H2,1-3H3;2*1H/q+1;;/p-1

InChIKey

YXWKGHSFQVHHSO-UHFFFAOYSA-M

Smiles

c12c([nH]c3c1cccc3)cc[n+](c2)CCC[N+](C)(C)C.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 26mg/kg (26mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES Journal of Pharmacology and Experimental Therapeutics. Vol. 114, Pg. 306, 1955.