Analyte Name

6alpha,9-Difluoro-11beta-hydroxy-16alpha-methyl-17-((methylsulfanyl)carbonyl)-3-oxo-androsta-1,4-diene-17alphalpha-yl Furoate

Molecular Formula

C27 H30 F2 O6 S

Molecular Weight

520.585

Accurate Mass

520.173

SMILES

CSC(=O)[C@@]1(OC(=O)c2occc2)[C@H](C)C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]13C

InChI

InChI=1S/C27H30F2O6S/c1-14-10-16-17-12-19(28)18-11-15(30)7-8-24(18,2)26(17,29)21(31)13-25(16,3)27(14,23(33)36-4)35-22(32)20-6-5-9-34-20/h5-9,11,14,16-17,19,21,31H,10,12-13H2,1-4H3/t14-,16+,17+,19+,21+,24+,25+,26+,27+/m1/s1

IUPAC

[(6S,8S,9R,10S,11S,13S,14S,16R,17R)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-17-methylsulfanylcarbonyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] furan-2-carboxylate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat