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Substance Name: Alcuronium chloride [USAN:INN:BAN:JAN]
RN: 15180-03-7
UNII: 490DW6501Y
InChIKey: CPYGBGOXCJJJGC-GKLGUMFISA-L

Classification Code

  • Relaxant (Skeletal Muscle)

Molecular Formulas

  • C44-H50-Cl2-N4-O2
  • C44-H50-N4-O2.2Cl

Molecular Weight

  • 737.811
 
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Names and Synonyms

Name of Substance

  • Alcuronium chloride [USAN:INN:BAN:JAN]

Synonyms

  • 4,4'-Didemethyl-4,4'-di-2-propenyltoxiferine I dichloride
  • Alcuronii chloridum
  • Alcuronii chloridum [INN-Latin]
  • Alcuronium chloride
  • Alcuronium dichloride
  • Alloferin
  • Allyl-toxiferin
  • Allyl-toxiferin [German]
  • Chlorure d'alcuronium
  • Chlorure d'alcuronium [INN-French]
  • Cloruro de alcuronic
  • Cloruro de alcuronic [INN-Spanish]
  • Dialferin
  • Diallylnortoxiferine dichloride
  • EINECS 239-229-8
  • N,N'-Diallylnortoxiferinium dichloride
  • Ro 4-3816
  • Toxiferine I, 4,4'-didemethyl-4,4'-di-2-propenyl-, dichloride
  • UNII-490DW6501Y

Systematic Names

  • 10H,21H-1,21:10,12-Diethano-19aH,20bH-dipyrrolo(1,2f:3',2'-f')(1,5)diazocino(3,2,1-jk:7,6,5-j'k')dicarbazolium, 2,3,11,11a,13,14,22,22a-octahydro-23,26-bis(2-hydroxyethylidene)-1,12-di-2-propenyl)-, dichloride, (1R,3aS,10S,11aS,12R,14aS,19aS,20bS,21S,22aS,23E,26E)-
  • Alcuronium chloride
  • Nortoxiferinium, N,N'-diallyl-, dichloride
  • Toxiferine I, 4,4'-didemethyl-4,4'-di-2-propenyl-, dichloride

Registry Numbers

CAS Registry Number

  • 15180-03-7

FDA UNII

  • 490DW6501Y

Related Registry Number

  • 23214-96-2 (Parent)

System Generated Number

  • 0015180037

Molecular Formulas

Molecular Formulas

  • C44-H50-Cl2-N4-O2
  • C44-H50-N4-O2.2Cl

Molecular Formula Fragments

  • C44-H50-N4-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C44H50N4O2.2ClH/c1-3-17-47-19-15-43-35-9-5-7-11-37(35)45-26-34-32-24-40-44(16-20-48(40,18-4-2)28-30(32)14-22-50)36-10-6-8-12-38(36)46(42(34)44)25-33(41(43)45)31(23-39(43)47)29(27-47)13-21-49;;/h3-14,25-26,31-32,39-42,49-50H,1-2,15-24,27-28H2;2*1H/q+2;;/p-2/b29-13-,30-14-,33-25-,34-26-;;/t31-,32-,39-,40-,41-,42-,43+,44+,47-,48-;;/m0../s1

InChIKey

CPYGBGOXCJJJGC-GKLGUMFISA-L

Smiles

[Cl-].[Cl-].OC\C=C/1\C[N@+]2(CC=C)CC[C@@]34[C@@H]2C[C@@H]1\C\5=C\N6[C@H]7\C(=C/N([C@H]35)c8ccccc48)\[C@H]9C[C@H]%10[C@@]7(CC[N@@+]%10(CC=C)C/C/9=C/CO)c%11ccccc6%11

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 610ug/kg (0.61mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 3, Pg. 390, 1969.
mouse LD50 intravenous 240ug/kg (0.24mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 3, Pg. 390, 1969.
mouse LD50 oral 38500ug/kg (38.5mg/kg)   Gendai no Rinsho. Vol. 1, Pg. 349, 1967.
mouse LD50 subcutaneous 610ug/kg (0.61mg/kg)   Gendai no Rinsho. Vol. 1, Pg. 349, 1967.
rat LD50 intraperitoneal 270ug/kg (0.27mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Gendai no Rinsho. Vol. 1, Pg. 349, 1967.
rat LD50 oral 27600ug/kg (27.6mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 3, Pg. 390, 1969.
rat LD50 subcutaneous 280ug/kg (0.28mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 3, Pg. 390, 1969.