2-Pyrrolidinyl Desmorpholinylrocuronium Bromide

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For Research Use Only | Not For Clinical Use
CATAPS1190105657
CAS1190105-65-7
Structure
SynonymsPyrrolidinium, 1-[(2β,3α,5α,16β,17β)-17-(acetyloxy)-3-hydroxy-2-(1-pyrrolidinyl)androstan-16-yl]-1-(2-propen-1-yl)-, bromide (1:1), 1-[17β-Acetoxy-3α-hydroxy-2β-(pyrrolidin-1-yl)-5α-androstan-16β-yl]-1-(prop-2-enyl)pyrrolidinium Bromide
IUPAC Name[(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-3-hydroxy-10,13-dimethyl-16-(1-prop-2-enylpyrrolidin-1-ium-1-yl)-2-pyrrolidin-1-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate;bromide
Molecular Weight593.68
Molecular FormulaC32H53N2O3.Br
Canonical SMILES[Br-].CC(=O)O[C@H]1[C@H](C[C@H]2[C@@H]3CC[C@H]4C[C@H](O)[C@H](C[C@]4(C)[C@H]3CC[C@]12C)N5CCCC5)[N+]6(CC=C)CCCC6
InChIInChI=1S/C32H53N2O3.BrH/c1-5-16-34(17-8-9-18-34)28-20-26-24-11-10-23-19-29(36)27(33-14-6-7-15-33)21-32(23,4)25(24)12-13-31(26,3)30(28)37-22(2)35;/h5,23-30,36H,1,6-21H2,2-4H3;1H/q+1;/p-1/t23-,24-,25-,26-,27+,28+,29+,30+,31+,32+;/m1./s1
Accurate Mass592.324
FormatNeat
Product TypeImpurity
SubcategoryImpurity standards
  • Verification code
CATSizeShippingStorage Conditions
APS1190105657-10MG 10MG Room Temperature -20°C Freezer Inquiry
APS1190105657-1MG 1MG Room Temperature -20°C Freezer Inquiry
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