[(2S,3S,5S,10S,13S,16S,17R)-3-Hydroxy-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-17-Yl] Acetate
[CAS# 74041-85-3]

Identification

• Name: [(2S,3S,5S,10S,13S,16S,17R)-3-Hydroxy-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-17-Yl] Acetate
• Synonyms: [(2S,3S,5S,10S,13S,16S,17R)-3-Hydroxy-10,13-Dimethyl-16-(1-Methylpiperidin-1-Ium-1-Yl)-2-(1-Piperidyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Acetate; Acetic Acid [(2S,3S,5S,10S,13S,16S,17R)-3-Hydroxy-10,13-Dimethyl-16-(1-Methyl-1-Piperidin-1-Iumyl)-2-(1-Piperidyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Ester; Acetic Acid [(2S,3S,5S,10S,13S,16S,17R)-3-Hydroxy-10,13-Dimethyl-16-(1-Methylpiperidin-1-Ium-1-Yl)-2-Piperidino-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Ester
• Molecular Formula: C₃₂H₅₅N₂O₃
• Molecular Weight: 515.80
• CAS Registry Number: 74041-85-3
• SMILES: [C@]46(C(C1C([C@@]3([C@@H](CC1)C[C@H](O)[C@@H](N2CCCCC2)C3)C)CC4)C[C@H]([N+]5(CCCCC5)C)[C@@H]6OC(=O)C)C
• InChI: 1S/C32H55N2O3/c1-22(35)37-30-28(34(4)17-9-6-10-18-34)20-26-24-12-11-23-19-29(36)27(33-15-7-5-8-16-33)21-32(23,3)25(24)13-14-31(26,30)2/h23-30,36H,5-21H2,1-4H3/q+1/t23-,24?,25?,26?,27-,28-,29-,30-,31-,32-/m0/s1
• InChIKey: KHTHYBVBGJQSIO-FUYRPLHRSA-N