[2-[(8S,10S,11S,13S,14S,16R,17S)-9-Fluoro-11,16,17-Trihydroxy-10,13-Dimethyl-3-Oxo-1,2,6,7,8,11,12,14,15,16-Decahydrocyclopenta[a]Phenanthren-17-Yl]-2-Oxoethyl] Propanoate
[CAS# 3797-62-4]

Identification

• Name: [2-[(8S,10S,11S,13S,14S,16R,17S)-9-Fluoro-11,16,17-Trihydroxy-10,13-Dimethyl-3-Oxo-1,2,6,7,8,11,12,14,15,16-Decahydrocyclopenta[a]Phenanthren-17-Yl]-2-Oxoethyl] Propanoate
• Synonyms: [2-[(8S,10S,11S,13S,14S,16R,17S)-9-Fluoro-11,16,17-Trihydroxy-10,13-Dimethyl-3-Oxo-1,2,6,7,8,11,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Propanoate; Propanoic Acid [2-[(8S,10S,11S,13S,14S,16R,17S)-9-Fluoro-11,16,17-Trihydroxy-10,13-Dimethyl-3-Oxo-1,2,6,7,8,11,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; Propionic Acid [2-[(8S,10S,11S,13S,14S,16R,17S)-9-Fluoro-11,16,17-Trihydroxy-3-Keto-10,13-Dimethyl-1,2,6,7,8,11,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Ester
• Molecular Formula: C₂₄H₃₃FO₇
• Molecular Weight: 452.52
• CAS Registry Number: 3797-62-4
• SMILES: [C@H]34[C@H]2C(F)([C@@]1(C(=CC(=O)CC1)CC2)C)[C@@H](O)C[C@@]3([C@](O)([C@H](O)C4)C(=O)COC(=O)CC)C
• InChI: 1S/C24H33FO7/c1-4-20(30)32-12-19(29)24(31)17(27)10-16-15-6-5-13-9-14(26)7-8-21(13,2)23(15,25)18(28)11-22(16,24)3/h9,15-18,27-28,31H,4-8,10-12H2,1-3H3/t15-,16-,17+,18-,21-,22-,23?,24-/m0/s1
• InChIKey: UKUCKBKKOVCOJJ-KFDFKENLSA-N

Properties

• Density: 1.339g/cm³ (Cal.)
• Boiling point: 603.111°C at 760 mmHg (Cal.)
• Flash point: 318.55°C (Cal.)