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Substance Name: Dipyrandium
RN: 33235-64-2
InChIKey: BHYLKXZGVYDNJN-UADHMQRGSA-L

Molecular Formula

  • C29-H52-N2.2I

Molecular Weight

  • 684.56
 
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Names and Synonyms

Name of Substance

  • Dipyrandium

Synonym

  • 3beta,17beta-Di-(1-pyrrolidinyl)-5alpha-androstane

Systematic Name

  • 1,1'-Androstan-3beta,17beta-diylbis(1-methylpyrrolidinium)

Registry Numbers

CAS Registry Number

  • 33235-64-2

System Generated Number

  • 0033235642

Molecular Formulas

Molecular Formula

  • C29-H52-N2.2I

Molecular Formula Fragments

  • C29-H52-N2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C29H52N2.2HI/c1-28-15-13-23(30(3)17-5-6-18-30)21-22(28)9-10-24-25-11-12-27(31(4)19-7-8-20-31)29(25,2)16-14-26(24)28;;/h22-27H,5-21H2,1-4H3;2*1H/p-2/t22-,23-,24-,25-,26-,27-,28-,29-;;/m0../s1

InChIKey

BHYLKXZGVYDNJN-UADHMQRGSA-L

Smiles

C1CCC[N]1([C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H]([N]5(CCCC5)C)CC[C@@]4(C)[C@H]3CC[C@@]12C)C.[IH-].[IH-]