Desallyl 2-Pyrrolidinyl Desmorpholinylrocuronium Acetate

Analyte Name

Desallyl 2-Pyrrolidinyl Desmorpholinylrocuronium Acetate

Molecular Formula

C30 H49 N O3

Molecular Weight

471.715

Accurate Mass

471.371

SMILES

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)C6CCCC6

InChI

InChI=1S/C30H49NO3/c1-19(32)34-28-23(20-8-4-5-9-20)17-25-22-11-10-21-16-27(33)26(31-14-6-7-15-31)18-30(21,3)24(22)12-13-29(25,28)2/h20-28,33H,4-18H2,1-3H3/t21-,22+,23+,24-,25-,26-,27-,28-,29-,30-/m0/s1

IUPAC

[(2S,3S,5S,8R,9S,10S,13S,14S,16R,17S)-16-cyclopentyl-3-hydroxy-10,13-dimethyl-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

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat