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Product Overview

Product Code

TRC-P769550

Product Format

Neat

Molecular Formula

C35 H57 N2 O4 . Br

Molecular Weight

649.74

API Family

Rocuronium Bromide

Product Categories

Hormones, Hormones, Impurity Reference Materials , Steroids and derivatives, TRC, Hormones, Steroids and derivatives, Additional Neuro Products

Product Type

Impurity

Drug Type

Steroids / Hormones

Documentation

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Product Information

Chemical Data

Analyte Name

3-O-Allyl Rocuronium Bromide

Molecular Formula

C35 H57 N2 O4 . Br

Molecular Weight

649.74

Accurate Mass

648.3502

SMILES

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

InChI

InChI=1S/C35H57N2O4.BrH/c1-6-16-37(17-8-9-18-37)31-23-29-27-11-10-26-22-32(40-19-7-2)30(36-14-20-39-21-15-36)24-35(26,5)28(27)12-13-34(29,4)33(31)41-25(3)38;/h6-7,26-33H,1-2,8-24H2,3-5H3;1H/q+1;/p-1/t26-,27+,28-,29-,30-,31-,32-,33-,34-,35-;/m0./s1

IUPAC

[(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-3-allyloxy-16-(1-allylpyrrolidin-1-ium-1-yl)-10,13-dimethyl-2-morpholino-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate;bromide

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Rocuronium Bromide

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Chemical Data

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3-O-Allyl Rocuronium Bromide (>90%)

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