17-Desacetyl Rocuronium Bromide
Product Code
TRC-D288705
CAS Number
Product Format
Neat
Molecular Formula
C30 H51 N2 O3 . Br
Molecular Weight
567.64
API Family
RocuroniumProduct Categories
TRC, Steroids and derivatives, Impurity Reference Materials , Hormones, Hormones, Hormones, Steroids and derivatives
Purity
>95% (HPLC)
Drug Type
Steroids / Hormones
Documentation
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Product Information
Chemical Data
Analyte Name
17-Desacetyl Rocuronium Bromide
CAS Number
119302-86-2
Molecular Formula
C30 H51 N2 O3 . Br
Molecular Weight
567.64
Accurate Mass
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
1H/q+1, 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, /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
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Metabolite; Impurity
Product Format
Neat
API Family
Purity
>95% (HPLC)