Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Pyrrolidinium, 1,1'-(3-alpha,17-beta-dihydroxy-5-alpha-androstan-2-beta,16-beta-ylene)bis(1-methyl-, dibromide
RN: 50588-04-0
InChIKey: FHZMVSFWULGVAR-MKCUDKBESA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H52-N2-O2.2Br

Molecular Weight

  • 620.5498
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • Pyrrolidinium, 1,1'-(3-alpha,17-beta-dihydroxy-5-alpha-androstan-2-beta,16-beta-ylene)bis(1-methyl-, dibromide

Registry Numbers

CAS Registry Number

  • 50588-04-0

System Generated Number

  • 0050588040

Molecular Formulas

Molecular Formula

  • C29-H52-N2-O2.2Br

Molecular Formula Fragments

  • Br
  • C29-H52-N2-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C29H52N2O2.2BrH/c1-28-12-11-22-21(23(28)18-24(27(28)33)30(3)13-5-6-14-30)10-9-20-17-26(32)25(19-29(20,22)2)31(4)15-7-8-16-31;;/h20-27,32-33H,5-19H2,1-4H3;2*1H/q+2;;/p-2/t20-,21+,22-,23-,24?,25?,26-,27-,28-,29-;;/m0../s1

InChIKey

FHZMVSFWULGVAR-MKCUDKBESA-L

Smiles

C[C@]12CC[C@H]3[C@H]([C@@H]1CC([C@@H]2O)[N+]4(CCCC4)C)CC[C@@H]5[C@@]3(CC([C@H](C5)O)[N+]6(CCCC6)C)C.[Br-].[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 1mg/kg (1mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 1116, 1973.