VECURONIUM BROMIDE

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

CAS: 50700-72-6

Molecular Formula	`C34H57BrN2O4`
Molecular Weight	637.7 g/mol
Topological Polar Surface Area	55.8 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	636.35016
Heavy Atoms	41
Complexity	958.0

Chemical Identifiers

CAS Number	50700-72-6
SMILES	`CC(=O)OC1CC2CCC3C(C2(CC1N4CCCCC4)C)CCC5(C3CC(C5OC(=O)C)[N+]6(CCCCC6)C)C.[Br-]`
InChIKey	`VEPSYABRBFXYIB-PWXDFCLTSA-M`

📖 Product Overview

VECURONIUM BROMIDE (CAS: 50700-72-6) is a chemical compound with molecular formula C34H57BrN2O4 and molecular weight 637.7 g/mol. Its IUPAC systematic name is [(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetyloxy-10,13-dimethyl-16-(1-methylpiperidin-1-ium-1-yl)-2-piperidin-1-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate bromide. Topological Polar Surface Area 55.8 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 6 Exact Mass 636.35016 Heavy Atoms 41 Complexity 958.0 InChI Key: VEPSYABRBFXYIB-PWXDFCLTSA-M. SMILES: CC(=O)OC1CC2CCC3C(C2(CC1N4CCCCC4)C)CCC5(C3CC(C5OC(=O)C)[N+]6(CCCCC6)C)C.[Br-].

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