IUPAC Name :(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
InChI :InChI=1/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15-,16-,17-,19-,20-,21-,22-/m0/s1
Std.InChI: InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15-,16-,17-,19-,20-,21-,22-/m0/s1
InChIKey :UREBDLICKHMUKA-DVTGEIKXBT
Std.InChIKey: UREBDLICKHMUKA-DVTGEIKXSA-N
SMILES :O=C(CO)[C@]3(O)[C@]2(C[C@H](O)[C@]4(F)[C@@]/1(\C(=C/C(=O)\C=C\1)CC[C@H]4[C@@H]2C[C@@H]3C)C)C
MDL: MFCD00062969
Molar Refractivity :100.23 ± 0.4 cm3 (est)
Parachor :812.3 ± 6.0 cm3 (est)
Index of Refraction :1.591 ± 0.03
(est)
Surface Tension :56.5 ± 5.0 dyne/cm (est)
Density :1.32 ± 0.1 g/cm3 (est)
Polarizability :39.73 ± 0.5 10-24cm3 (est)