(11beta,16alpha)-9-Fluoro-11,17-dihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-21-yl D-glucopyranoside
[CAS# 88158-43-4]

Identification

• Name: (11beta,16alpha)-9-Fluoro-11,17-dihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-21-yl D-glucopyranoside
• Synonyms: Dexamethasone 21-glucoside; Dexamethasone 21β-D-glucoside
• Molecular Formula: C₂₈H₃₉FO₁₀
• Molecular Weight: 554.60
• CAS Registry Number: 88158-43-4
• SMILES: O=C\1\C=C4/[C@@](/C=C/1)(C)[C@@]5(F)[C@@H](O)C[C@@]3(C)[C@@H](C[C@@H](C)[C@]3(O)C(=O)COC2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO)[C@@H]5CC4
• InChI: 1S/C28H39FO10/c1-13-8-17-16-5-4-14-9-15(31)6-7-25(14,2)27(16,29)19(32)10-26(17,3)28(13,37)20(33)12-38-24-23(36)22(35)21(34)18(11-30)39-24/h6-7,9,13,16-19,21-24,30,32,34-37H,4-5,8,10-12H2,1-3H3/t13-,16+,17+,18-,19+,21-,22+,23-,24?,25+,26+,27+,28+/m1/s1
• InChIKey: CBHWNVHRXOVHJV-INDGYWFMSA-N

Properties

• Density: 1.456g/cm³ (Cal.)
• Boiling point: 778.85°C at 760 mmHg (Cal.)
• Flash point: 424.833°C (Cal.)