[(16S,17S)-16-Ethyl-13-Methyl-3-Oxo-2,6,7,8,9,10,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-17-Yl] Acetate
[CAS# 33765-80-9]

Identification

• Name: [(16S,17S)-16-Ethyl-13-Methyl-3-Oxo-2,6,7,8,9,10,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-17-Yl] Acetate
• Synonyms: Acetic Acid [(16S,17S)-16-Ethyl-13-Methyl-3-Oxo-2,6,7,8,9,10,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Ester; Acetic Acid [(16S,17S)-16-Ethyl-3-Keto-13-Methyl-2,6,7,8,9,10,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Ester; [(16S,17S)-16-Ethyl-13-Methyl-3-Oxo-2,6,7,8,9,10,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Ethanoate
• Molecular Formula: C₂₂H₃₂O₃
• Molecular Weight: 344.49
• CAS Registry Number: 33765-80-9
• SMILES: [C@@H]4(OC(=O)C)C3(C(C2C(C1C(=CC(=O)CC1)CC2)CC3)C[C@@H]4CC)C
• InChI: 1S/C22H32O3/c1-4-14-12-20-19-7-5-15-11-16(24)6-8-17(15)18(19)9-10-22(20,3)21(14)25-13(2)23/h11,14,17-21H,4-10,12H2,1-3H3/t14-,17?,18?,19?,20?,21-,22?/m0/s1
• InChIKey: CFEWNKYXYQEFOP-HXYGNHFVSA-N

Properties

• Density: 1.104g/cm³ (Cal.)
• Boiling point: 460.34°C at 760 mmHg (Cal.)
• Flash point: 199.017°C (Cal.)