(11beta,16alpha)-9-Fluoro-11-Hydroxy-16,17-[(1-Methylethylidene)Bis(Oxy)]-21-(Phosphonooxy)-Pregna-1,4-Diene-3,20-Dione Disodium Salt
[CAS# 1997-15-5]

Identification

• Name: (11beta,16alpha)-9-Fluoro-11-Hydroxy-16,17-[(1-Methylethylidene)Bis(Oxy)]-21-(Phosphonooxy)-Pregna-1,4-Diene-3,20-Dione Disodium Salt
• Synonyms: Cl 106359; Cl 61965
• Molecular Formula: C₂₄H₃₀FNa₂O₉P
• Molecular Weight: 558.45
• CAS Registry Number: 1997-15-5
• EINECS: 217-878-8
• SMILES: [C@H]23[C@@]([C@@]1(OC(O[C@@H]1C2)(C)C)C(=O)CO[P]([O-])([O-])=O)(C[C@H](O)[C@@]4(F)[C@H]3CCC5=CC(=O)C=C[C@]45C)C.[Na+].[Na+]
• InChI: 1S/C24H32FO9P.2Na/c1-20(2)33-19-10-16-15-6-5-13-9-14(26)7-8-21(13,3)23(15,25)17(27)11-22(16,4)24(19,34-20)18(28)12-32-35(29,30)31;;/h7-9,15-17,19,27H,5-6,10-12H2,1-4H3,(H2,29,30,31);;/q;2*+1/p-2/t15-,16-,17-,19+,21-,22-,23-,24+;;/m0../s1
• InChIKey: XCMJCLDAGKYHPP-AREPQIRLSA-L

Properties

• Boiling point: 674.4°C at 760 mmHg (Cal.)
• Flash point: 361.6°C (Cal.)