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Substance Name: Pyridinium, 4-(2-indol-3-ylethyl)-1-(3-(trimethylammonio)propyl)-, dibromide
RN: 21199-25-7
InChIKey: MWLHSMMCWPOORG-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H29-N3.2Br

Molecular Weight

  • 483.289
 
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Names and Synonyms

Synonym

  • 4-(2-Indol-3-ylethyl)-1-(3-(trimethylammonio)propyl)pyridinium dibromide

Systematic Name

  • Pyridinium, 4-(2-indol-3-ylethyl)-1-(3-(trimethylammonio)propyl)-, dibromide

Registry Numbers

CAS Registry Number

  • 21199-25-7

System Generated Number

  • 0021199257

Molecular Formulas

Molecular Formula

  • C21-H29-N3.2Br

Molecular Formula Fragments

  • Br
  • C21-H29-N3
  • COMPONENT

Structure Descriptors

InChI

1S/C21H29N3.2BrH/c1-24(2,3)16-6-13-23-14-11-18(12-15-23)9-10-19-17-22-21-8-5-4-7-20(19)21;;/h4-5,7-8,11-12,14-15,17,22H,6,9-10,13,16H2,1-3H3;2*1H/q+2;;/p-2

InChIKey

MWLHSMMCWPOORG-UHFFFAOYSA-L

Smiles

c1cc(cc[n+]1CCC[N+](C)(C)C)CCc1c[nH]c2ccccc12.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 9mg/kg (9mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 120, Pg. 438, 1957.