1,1'-[(2b,5a,16b)-Androstane-2,16-diyl]bis[1-methyl-Piperidinium dibromide
[CAS# 53357-37-2]

Identification

• Name: 1,1'-[(2b,5a,16b)-Androstane-2,16-diyl]bis[1-methyl-Piperidinium dibromide
• Synonyms: 1-[(2R,5S,8S,9S,10S,13R,14S,16S)-10,13-Dimethyl-2-(1-Methylpiperidin-1-Ium-1-Yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-16-Yl]-1-Methyl-Piperidin-1-Ium Dibromide; 1-[(2R,5S,8S,9S,10S,13R,14S,16S)-10,13-Dimethyl-2-(1-Methyl-1-Piperidin-1-Iumyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-16-Yl]-1-Methylpiperidin-1-Ium Dibromide; (Dideacetoxy)Pancuronium
• Molecular Formula: C₃₁H₅₆Br₂N₂
• Molecular Weight: 616.60
• CAS Registry Number: 53357-37-2
• SMILES: [C@@H]12[C@@]6([C@@H](CC[C@H]1[C@H]4[C@](CC2)(C[C@@H]([N+]3(CCCCC3)C)C4)C)CC[C@@H]([N+]5(CCCCC5)C)C6)C.[Br-].[Br-]
• InChI: 1S/C31H56N2.2BrH/c1-30-16-15-28-27(29(30)21-26(22-30)33(4)19-9-6-10-20-33)14-12-24-11-13-25(23-31(24,28)2)32(3)17-7-5-8-18-32;;/h24-29H,5-23H2,1-4H3;2*1H/q+2;;/p-2/t24-,25-,26+,27-,28+,29+,30-,31+;;/m1../s1
• InChIKey: WMKSDOJENIGUCY-CHEMMBICSA-L