[2-[(8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-3,11-Dioxo-2,6,7,8,9,12,14,15,16,17-Decahydro-1H-Cyclopenta[a]Phenanthren-17-Yl]-2-Oxoethyl] Acetate
[CAS# 1173-27-9]

Identification

• Name: [2-[(8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-3,11-Dioxo-2,6,7,8,9,12,14,15,16,17-Decahydro-1H-Cyclopenta[a]Phenanthren-17-Yl]-2-Oxoethyl] Acetate
• Synonyms: [2-[(8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-3,11-Dioxo-2,6,7,8,9,12,14,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Acetate; Acetic Acid [2-[(8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-3,11-Dioxo-2,6,7,8,9,12,14,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; Acetic Acid [2-[(8S,9S,10R,13S,14S,17S)-3,11-Diketo-10,13-Dimethyl-2,6,7,8,9,12,14,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Ester
• Molecular Formula: C₂₃H₃₀O₅
• Molecular Weight: 386.49
• CAS Registry Number: 1173-27-9
• SMILES: [C@H]23[C@@H]([C@@]1(C(=CC(=O)CC1)CC2)C)C(=O)C[C@]4([C@H]3CC[C@@H]4C(=O)COC(=O)C)C
• InChI: 1S/C23H30O5/c1-13(24)28-12-20(27)18-7-6-17-16-5-4-14-10-15(25)8-9-22(14,2)21(16)19(26)11-23(17,18)3/h10,16-18,21H,4-9,11-12H2,1-3H3/t16-,17-,18+,21+,22-,23-/m0/s1
• InChIKey: DOETVHHSMBAUKN-GHBJZYDUSA-N

Properties

• Density: 1.204g/cm³ (Cal.)
• Boiling point: 542.427°C at 760 mmHg (Cal.)
• Flash point: 235.232°C (Cal.)