(2β,3α,5α,16β,17β)-17-Acetoxy-3-hydroxy-2-(4-morpholinyl)-16-(1-pyrrolidinyl)andros

CAS: 119302-24-8

Ref. TR-A165650

Product Information

• Name: (2β,3α,5α,16β,17β)-17-Acetoxy-3-hydroxy-2-(4-morpholinyl)-16-(1-pyrrolidinyl)andros
• Synonyms: (2β,3α,5α,16β,17β)-2-(4-Morpholinyl)-16-(1-pyrrolidinyl)-androstane-3,17-diol 17-acetate, (2β,3α,5α,16β,17β)-17-Acetoxy-3-hydroxy-2-(4-morpholinyl)-16-(1-pyrrolidinyl)androstane, (2β,3α,5α,16β,17β)-2-(4-Morpholinyl)-16-(pyrrolidin-1-yl)androstane-3,17-diol 17-acetate, 2β-(4-Morpholinyl)-16β-(1-pyrrolidinyl)-5α-androstane-3α,17β-diol 17-acetate, Org 20860, 3α-Hydroxy-2β-(morpholin-4-yl)-16β-(pyrrolidin-1-yl)-5α-androstan-17β-yl Acetate, Rocuronium Bromide Imp. A (EP)
• Brand: TRC
• Description: Impurity Rocuronium EP Impurity AApplications (2β,3α,5α,16β,17β)-17-Acetoxy-3-hydroxy-2-(4-morpholinyl)-16-(1-pyrrolidinyl)androstane (Rocuronium EP Impurity A) is a compound is used in the synthesis of the neuromuscular blocking agent rocuronium bromide.References Srinivasan, N. et al.: Orient. J. Chem., 24, 989 (2008)

Chemical properties

• Molecular weight: 488.70
• Formula: C₂₉H₄₈N₂O₄
• Color/Form: White To Light Brown
• InChI: InChI=1S/C29H48N2O4/c1-19(32)35-27-24(30-10-4-5-11-30)17-23-21-7-6-20-16-26(33)25(31-12-14-34-15-13-31)18-29(20,3)22(21)8-9-28(23,27)2/h20-27,33H,4-18H2,1-3H3/t20-,21+,22-,23-,24-,25-,26-,27-,28-,29-/m0/s1
• InChI key: InChIKey=YBZSVMDKHBRYNB-RIQJFVKASA-N
• SMILES: CC(=O)O[C@H]1[C@@H](N2CCCC2)C[C@H]2[C@@H]3CC[C@H]4C[C@H](O)[C@@H](N5CCOCC5)C[C@]4(C)[C@H]3CC[C@@]21C