IUPAC Name :(3S,5R,6S,8R,9R,10R,12R,13R,14S,17S)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,6,12-triol
InChI :InChI=1/C30H52O4/c1-18(2)10-9-13-30(8,34)19-11-15-28(6)24(19)20(31)16-22-27(5)14-12-23(33)26(3,4)25(27)21(32)17-29(22,28)7/h10,19-25,31-34H,9,11-17H2,1-8H3/t19-,20+,21-,22+,23-,24-,25-,27+,28-,29+,30-/m0/s1
Std.InChI: InChI=1S/C30H52O4/c1-18(2)10-9-13-30(8,34)19-11-15-28(6)24(19)20(31)16-22-27(5)14-12-23(33)26(3,4)25(27)21(32)17-29(22,28)7/h10,19-25,31-34H,9,11-17H2,1-8H3/t19-,20+,21-,22+,23-,24-,25-,27+,28-,29+,30-/m0/s1
InChIKey :SHCBCKBYTHZQGZ-PHFGEWBZBO
Std.InChIKey: SHCBCKBYTHZQGZ-PHFGEWBZSA-N
SMILES :CC(=CCC[C@@](C)([C@H]1CC[C@]2([C@@H]1[C@@H](C[C@H]3[C@]2(C[C@@H]([C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)O)C)O)C)O)C
MDL: MFCD01861517
Molar Refractivity :138.63 ± 0.3 cm3 (est)
Parachor :1133.0 ± 6.0 cm3 (est)
Index of Refraction :1.540 ± 0.02
(est)
Surface Tension :43.3 ± 3.0 dyne/cm (est)
Density :1.079 ± 0.06 g/cm3 (est)
Polarizability :54.96 ± 0.5 10-24cm3 (est)