Pancuronium bromide CRS

Analyte Name

Pancuronium Bromide

CAS Number

15500-66-0

Molecular Formula

C35 H60 N2 O4 . 2 Br

Molecular Weight

732.67

Accurate Mass

730.292

Flash Point

5.0

SMILES

[Br-].[Br-].CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@H](CC[C@@]4(C)[C@H]3C[C@@H]([C@@H]4OC(=O)C)[N+]5(C)CCCCC5)[C@@]2(C)C[C@@H]1[N+]6(C)CCCCC6

InChI

, /m0../s1, InChI=1S/C35H60N2O4.2BrH/c1-24(38)40-32-21-26-13-14-27-28(35(26,4)23-31(32)37(6)19-11-8-12-20-37)15-16-34(3)29(27)22-30(33(34)41-25(2)39)36(5)17-9-7-10-18-36, , , 2*1H/q+2, /h26-33H,7-23H2,1-6H3, /p-2/t26-,27+,28-,29-,30-,31-,32-,33-,34-,35-

IUPAC

[(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetyloxy-10,13-dimethyl-2,16-bis(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-3-yl] acetate;dibromide

Storage Temperature

2-8C Fridge/Coldroom

Shipping Temperature

Room Temperature

Country of Origin

FRANCE

Tariff Code

29333999

Product Type

API

Product Format

Neat

API Family

Pancuronium Bromide