(6alpha,11beta)-11,17-Dihydroxy-6-Methyl-21-(Phosphonooxy)-Pregna-1,4-Diene-3,20-Dione Disodium Salt
[CAS# 5015-36-1]

Identification

• Name: (6alpha,11beta)-11,17-Dihydroxy-6-Methyl-21-(Phosphonooxy)-Pregna-1,4-Diene-3,20-Dione Disodium Salt
• Synonyms: Disodium [2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-6,10,13-Trimethyl-3-Oxo-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Phosphate; Disodium [2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-3-Keto-6,10,13-Trimethyl-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Phosphate; Methylprednisolone Sodium Phosphate [Usan]
• Molecular Formula: C₂₂H₂₉Na₂O₈P
• Molecular Weight: 498.42
• CAS Registry Number: 5015-36-1
• EINECS: 225-694-4
• SMILES: [C@H]24[C@H]1[C@@]([C@](O)(CC1)C(=O)CO[P]([O-])([O-])=O)(C[C@H](O)[C@@H]2[C@@]3(C(=CC(=O)C=C3)[C@H](C4)C)C)C.[Na+].[Na+]
• InChI: 1S/C22H31O8P.2Na/c1-12-8-14-15-5-7-22(26,18(25)11-30-31(27,28)29)21(15,3)10-17(24)19(14)20(2)6-4-13(23)9-16(12)20;;/h4,6,9,12,14-15,17,19,24,26H,5,7-8,10-11H2,1-3H3,(H2,27,28,29);;/q;2*+1/p-2/t12-,14-,15-,17-,19+,20-,21-,22-;;/m0../s1
• InChIKey: FVKLXKOXTMCACB-VJWYNRERSA-L

Properties

• Boiling point: 673.5°C at 760 mmHg (Cal.)
• Flash point: 361.1°C (Cal.)