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Substance Name: Acetoxy-methyl acetylcholine chloride
RN: 38939-85-4
InChIKey: QENRWINHIGJULD-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H20-N-O4.Cl

Molecular Weight

  • 253.724
 
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Names and Synonyms

Results Name

  • Acetoxy-methyl acetylcholine chloride

Synonym

  • Acetoxy-methyl acetylcholine chloride

Systematic Name

  • Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, chloride

Registry Numbers

CAS Registry Number

  • 38939-85-4

System Generated Number

  • 0038939854

Molecular Formulas

Molecular Formula

  • C10-H20-N-O4.Cl

Molecular Formula Fragments

  • C10-H20-N-O4
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C10H20NO4.ClH/c1-8(15-9(2)12)10(13)14-7-6-11(3,4)5;/h8H,6-7H2,1-5H3;1H/q+1;/p-1

InChIKey

QENRWINHIGJULD-UHFFFAOYSA-M

Smiles

[N+](CCOC([C@@H](OC(C)=O)C)=O)(C)(C)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 400mg/kg (400mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 99, Pg. 1245, 1979.
mouse LD50 oral 6800mg/kg (6800mg/kg)   United States Patent Document. Vol. #3903137,
mouse LD50 subcutaneous 576mg/kg (576mg/kg)   United States Patent Document. Vol. #3903137,