(6a,11b,16a,17a)-6,9-Difluoro-17-[(2-furanylcarbonyl)oxy]-11-hydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carboxylic Acid

CAS: 397864-63-0

Ref. TR-D450254

Product Information

• Name: (6a,11b,16a,17a)-6,9-Difluoro-17-[(2-furanylcarbonyl)oxy]-11-hydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carboxylic Acid
• Synonyms: GW 694301X, (6S,8S,9R,10S,11S,13S,14S,16R,17R)-6,9-Difluoro-17-((furan-2-carbonyl)oxy)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene-17-carboxylic Acid

Description

Applications (6α,11β,16α,17α)-6,9-Difluoro-17-[(2-furanylcarbonyl)oxy]-11-hydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carboxylic Acid is an impurity compound of fluticasone furoate (F599510). A steroid used in the studies on the primary metabolic pathway of fluticasone furoate in animals hepatocyte and in humans.
References Lulla, M., et al.: Handbook of Metabolic Pathways of Xenobiotics, 4, 1475 (2014), Hughes, S. C., et al.: Drug Metab. Dispos., 36, 2337 (2008)

• Brand: TRC

Chemical properties

• Molecular weight: 490.49
• Formula: C₂₆H₂₈F₂O₇
• Color/Form: Neat
• InChI: InChI=1S/C26H28F2O7/c1-13-9-15-16-11-18(27)17-10-14(29)6-7-23(17,2)25(16,28)20(30)12-24(15,3)26(13,22(32)33)35-21(31)19-5-4-8-34-19/h4-8,10,13,15-16,18,20,30H,9,11-12H2,1-3H3,(H,32,33)/t13-,15+,16+,18+,20+,23+,24+,25+,26+/m1/s1
• InChI key: InChIKey=QOANMINPJDURAZ-VEGHOPOESA-N
• SMILES: C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(OC(=O)c1ccco1)C(=O)O