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Substance Name: (Dideacetoxy)vecuronium
RN: 115952-48-2
InChIKey: AQMVPBLWUQDAHJ-LPSBBQSESA-M

Molecular Formula

  • C30-H53-N2.Br

Molecular Weight

  • 521.667
 
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Names and Synonyms

Name of Substance

  • (Dideacetoxy)vecuronium

Synonyms

  • (Dideacetoxy)vecuronium
  • (Didesacetoxy)vecuronium
  • Bis(desacetoxy)vecuronium
  • Org-8764

Systematic Name

  • Piperidinium, 1-methyl-1-((2beta,5alpha,16beta)-2-(1-piperidinyl)androstan-16-yl)-, bromide

Registry Numbers

CAS Registry Number

  • 115952-48-2

System Generated Number

  • 0115952482

Molecular Formulas

Molecular Formula

  • C30-H53-N2.Br

Molecular Formula Fragments

  • Br
  • C30-H53-N2
  • COMPONENT

Structure Descriptors

InChI

1S/C30H53N2.BrH/c1-29-15-14-27-26(28(29)20-25(22-29)32(3)18-8-5-9-19-32)13-11-23-10-12-24(21-30(23,27)2)31-16-6-4-7-17-31;/h23-28H,4-22H2,1-3H3;1H/q+1;/p-1/t23-,24-,25+,26-,27+,28+,29-,30+;/m1./s1

InChIKey

AQMVPBLWUQDAHJ-LPSBBQSESA-M

Smiles

[N+]1(CCCCC1)(C)[C@@H]1C[C@@]2([C@@H]([C@H]3[C@H](CC2)[C@@]2([C@H](CC[C@H](C2)N2CCCCC2)CC3)C)C1)C.[BrH-]