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Substance Name: Murexine chloride hydrochloride
RN: 6032-82-2
UNII: 19X3NAW2Z4
InChIKey: VQMMZOYNQZNRJF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H18-N3-O2.Cl-H.Cl

Molecular Weight

  • 296.196
 
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Names and Synonyms

Results Name

  • Murexine chloride hydrochloride

Name of Substance

  • Murexine chloride hydrochloride

Synonyms

  • 2-beta-Imidazol-4'(5')-ylacryloyloxyethyltrimethylammonium chloride hydrochloride
  • beta-(4-Imidazolyl)acrylcholine chloride hydrochloride
  • Choline, chloride urocanate, hydrochloride (6CI)
  • Ethanaminium, 2-((3-(1H-imidazol-4-yl)-1-oxo-2-propenyl)oxy)-N,N,N-trimethyl-, chloride, HCl
  • Murexine chloride hydrochloride
  • NSC 172794
  • UNII-19X3NAW2Z4
  • Urocanylcholine chloride hydrochloride

Systematic Names

  • Choline, chloride, imidazole-4-acrylate, monohydrochloride
  • Ethanaminium, 2-((3-(1H-imidazol-4-yl)-1-oxo-2-propenyl)oxy)-N,N,N-trimethyl-, chloride, monohydrochloride (9CI)

Registry Numbers

CAS Registry Number

  • 6032-82-2

FDA UNII

  • 19X3NAW2Z4

System Generated Number

  • 0006032822

Molecular Formulas

Molecular Formula

  • C11-H18-N3-O2.Cl-H.Cl

Molecular Formula Fragments

  • C11-H18-N3-O2
  • Cl
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C11H17N3O2.2ClH/c1-14(2,3)6-7-16-11(15)5-4-10-8-12-9-13-10;;/h4-5,8-9H,6-7H2,1-3H3;2*1H

InChIKey

VQMMZOYNQZNRJF-UHFFFAOYSA-N

Smiles

[N+](CCOC(\C=C\c1nc[nH]c1)=O)(C)(C)C.[ClH-].Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 8520ug/kg (8.52mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 13, Pg. 378, 1958.