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Substance Name: Ambutonium
RN: 14007-49-9
UNII: 4O677EQ77U
InChIKey: KFZMXOLSYABOSE-UHFFFAOYSA-O

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-N2-O

Molecular Weight

  • 311.4463
 
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Names and Synonyms

Name of Substance

  • Ambutonium

Synonyms

  • (3-Carbamoyl-3,3-diphenylpropyl)ethyldimethylammonium
  • Ambutonium
  • UNII-4O677EQ77U

Systematic Names

  • Ammonium, (3-carbamoyl-3,3-diphenylpropyl)ethyldimethyl-
  • Benzenepropanaminium, gamma-(aminocarbonyl)-N-ethyl-N,N-dimethyl-gamma-phenyl- (9CI)

Registry Numbers

CAS Registry Number

  • 14007-49-9

FDA UNII

  • 4O677EQ77U

System Generated Number

  • 0014007499

Structure Descriptors

InChI

1S/C20H26N2O/c1-4-22(2,3)16-15-20(19(21)23,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,4,15-16H2,1-3H3,(H-,21,23)/p+1

InChIKey

KFZMXOLSYABOSE-UHFFFAOYSA-O

Smiles

CC[N+](C)(C)CCC(c1ccccc1)(c2ccccc2)C(=O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3060mg/kg (3060mg/kg)   Toxicology and Applied Pharmacology. Vol. 18, Pg. 185, 1971.
rat LD50 oral 1350mg/kg (1350mg/kg)   Toxicology and Applied Pharmacology. Vol. 18, Pg. 185, 1971.