CAS 1869-92-7

Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-(phosphonooxy)-, sodium salt (1:1), (11β,16α)-

Description:

Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-(phosphonooxy)-, sodium salt (1:1), commonly known as a synthetic corticosteroid, is characterized by its complex steroid structure, which includes a fluorine atom and a phosphonooxy group. This compound exhibits anti-inflammatory and immunosuppressive properties, making it useful in various therapeutic applications, particularly in treating conditions like asthma and autoimmune disorders. The presence of hydroxyl groups contributes to its biological activity, enhancing its interaction with corticosteroid receptors. As a sodium salt, it is more soluble in water, facilitating its administration in clinical settings. The specific stereochemistry indicated by the (11β,16α) configuration is crucial for its pharmacological efficacy, influencing how the molecule interacts with biological systems. Overall, this compound exemplifies the structural diversity and functional significance of synthetic steroids in medicine.

Formula: C₂₂H₃₀FO₈P·Na

InChI: InChI=1S/C22H30FO8P.Na/c1-12-8-16-15-5-4-13-9-14(24)6-7-19(13,2)21(15,23)17(25)10-20(16,3)22(12,27)18(26)11-31-32(28,29)30;/h6-7,9,12,15-17,25,27H,4-5,8,10-11H2,1-3H3,(H2,28,29,30);/t12-,15+,16+,17+,19+,20+,21+,22+;/m1./s1

InChI key: InChIKey=VIKBYTWZYXGHAT-WKSAPEMMSA-N

SMILES: C[C@@]12[C@]([C@]3([C@@](F)([C@]4(C)C(CC3)=CC(=O)C=C4)[C@@H](O)C1)[H])(C[C@@H](C)[C@@]2(C(COP(=O)(O)O)=O)O)[H].[Na]

Synonyms:

• Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-(phosphonooxy)-, monosodium salt, (11β,16α)-
• Pregna-1,4-diene-3,20-dione, 9-fluoro-11β,17,21-trihydroxy-16α-methyl-, 21-(dihydrogen phosphate), monosodium salt
• Pregna-1,4-diene-3,20-dione, 9-fluoro-11β,17,21-trihydroxy-16α-methyl-, 21-phosphate, monosodium salt
• Sodium (11Beta,16Alpha)-9-Fluoro-11,17-Dihydroxy-16-Methyl-3,20-Dioxopregna-1,4-Dien-21-Yl Hydrogen Phosphate
• Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-(phosphonooxy)-, sodium salt (1:1), (11β,16α)-
• Dexamethasone 21-(sodium hydrogen phosphate)

Dexamethasone 21-Phosphate Dimer Sodium Salt

Controlled Product

CAS: 1869-92-7, 312-93-6

Stability Hygroscopic
Applications Dexamethasone 21-Phosphate Dimer is a derivative of Dexamethasone (D298800), a glucocorticoid used as an anti-inflammatory agent. Dexamethasone regulates T cell survival, growth, and differentiation. Dexamethasone inhibits the induction of nitric oxide synthase.
References Wershil, B.K., et al.: Int. Arch. Allergy Immunol., 107, 323 (1995), Riccardi, C., et al.: Cell Death Diff., 6, 1182 (1999), Llanos, S.L. and Roldan, A.: Bio Cell, 23, 29 (1999)

Formula: C₄₄H₅₆F₂NaO₁₂P

Color and Shape: White Solid

Molecular weight: 868.87

Ref: TR-D298840

(11b,​16a)​-9-​Fluoro-​11,​17-​dihydroxy-​16-​methyl-​21-​(phosphonooxy)​-​pregna-​1,​4-​diene-​3,​20-​dione Monosodium Salt

Controlled Product

CAS: 1869-92-7

Applications (11β,​16α)​-9-​Fluoro-​11,​17-​dihydroxy-​16-​methyl-​21-​(phosphonooxy)​-​pregna-​1,​4-​diene-​3,​20-​dione Monosodium Salt is a by-product during the synthesis of Dexamethasone Phosphate (D298835).
References Kodelja, V., et al.: J. Immunol., 160, 1411 (1998); Metselaar, J., et al.: Arthritis Rheum., 48, 2059 (2003); Buttgereit, F., et al.: Arthritis Rheum., 50, 3408 (2004); Martinez, F., et al.: Front Biosci., 13, 453 (2008)

Formula: C₂₂H₂₉FO₈P·Na

Color and Shape: Neat

Molecular weight: 494.42

Ref: TR-F599725