[3-Hydroxy-10,13-Dimethyl-17-[1-(5-Methylpiperidin-2-Yl)Ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-16-Yl] Acetate
[CAS# 36069-45-1]

Identification

• Name: [3-Hydroxy-10,13-Dimethyl-17-[1-(5-Methylpiperidin-2-Yl)Ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-16-Yl] Acetate
• Synonyms: [3-Hydroxy-10,13-Dimethyl-17-[1-(5-Methyl-2-Piperidyl)Ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-16-Yl] Acetate; Acetic Acid [3-Hydroxy-10,13-Dimethyl-17-[1-(5-Methyl-2-Piperidinyl)Ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-16-Yl] Ester; Acetic Acid [3-Hydroxy-10,13-Dimethyl-17-[1-(5-Methyl-2-Piperidyl)Ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-16-Yl] Ester
• Molecular Formula: C₂₉H₄₇NO₃
• Molecular Weight: 457.70
• CAS Registry Number: 36069-45-1
• SMILES: CC35C(=CCC4C1C(C(C(OC(=O)C)C1)C(C2NCC(CC2)C)C)(CCC34)C)CC(CC5)O
• InChI: 1S/C29H47NO3/c1-17-6-9-25(30-16-17)18(2)27-26(33-19(3)31)15-24-22-8-7-20-14-21(32)10-12-28(20,4)23(22)11-13-29(24,27)5/h7,17-18,21-27,30,32H,6,8-16H2,1-5H3
• InChIKey: ZVYUDNWAHWVPPN-UHFFFAOYSA-N

Properties

• Density: 1.099g/cm³ (Cal.)
• Boiling point: 553.843°C at 760 mmHg (Cal.)
• Flash point: 288.754°C (Cal.)