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Substance Name: Pyrrolidinium, 1-(3-alpha-hydroxy-17-oxo-5-alpha-androstan-2-beta-yl)-1-methyl-, bromide, acetate
RN: 14668-12-3
InChIKey: GLTPBELQCPHQJV-UBUJPKMXSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H42-N-O3.Br

Molecular Weight

  • 496.526
 
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Names and Synonyms

Synonym

  • 3-alpha-Acetoxy-2-beta-pyrrolidin-1'-yl-5-alpha-androstan-17-one methobromide

Systematic Name

  • Pyrrolidinium, 1-(3-alpha-hydroxy-17-oxo-5-alpha-androstan-2-beta-yl)-1-methyl-, bromide, acetate

Registry Numbers

CAS Registry Number

  • 14668-12-3

System Generated Number

  • 0014668123

Molecular Formulas

Molecular Formula

  • C26-H42-N-O3.Br

Molecular Formula Fragments

  • Br
  • C26-H42-N-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C26H42NO3.BrH/c1-17(28)30-23-15-18-7-8-19-20-9-10-24(29)25(20,2)12-11-21(19)26(18,3)16-22(23)27(4)13-5-6-14-27;/h18-23H,5-16H2,1-4H3;1H/q+1;/p-1/t18-,19?,20?,21?,22-,23-,25-,26-;/m0./s1

InChIKey

GLTPBELQCPHQJV-UBUJPKMXSA-M

Smiles

[N+]1(CCCC1)(C)[C@@H]1[C@H](C[C@@H]2CC[C@@H]3[C@@H]4CCC([C@@]4(C)CC[C@@H]3[C@@]2(C1)C)=O)OC(=O)C.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 72mg/kg (72mg/kg)   Journal of Pharmacy and Pharmacology. Vol. 19, Pg. 502, 1967.