Nombre del analito

17-Desacetyl Rocuronium Bromide

Número CAS

119302-86-2

Fórmula molecular

C30 H51 N2 O3 . Br

Peso molecular

567.64

Masa exacta

566.3083

SMILES

[Br-].C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)[C@H](C[C@]34C)N5CCOCC5)[C@@H]1C[C@@H]([C@@H]2O)[N+]6(CC=C)CCCC6

InChI

InChI=1S/C30H51N2O3.BrH/c1-4-13-32(14-5-6-15-32)26-19-24-22-8-7-21-18-27(33)25(31-11-16-35-17-12-31)20-30(21,3)23(22)9-10-29(24,2)28(26)34;/h4,21-28,33-34H,1,5-20H2,2-3H3;1H/q+1;/p-1/t21-,22+,23-,24-,25-,26-,27-,28-,29-,30-;/m0./s1

IUPAC

(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-10,13-dimethyl-2-morpholin-4-yl-16-(1-prop-2-enylpyrrolidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol;bromide

Temperatura de almacenamiento

-20°C

Temperatura de envío

Room Temperature

País de origen

CANADA

Tipo de producto

Metabolite; Impurity

Formato del producto

Neat

Familia API

Rocuronium Bromide

Purity

>95% (HPLC)