IUPAC Name :(3S,4aR,6aR,6aR,6bR,8S,8aS,12S,12aR,14aR,14bR)-11-(hydroxymethyl)-4,4,6a,6b,8a,12,14b-heptamethyl-2,3,4a,5,6,6a,7,8,9,12,12a,13,14,14a-tetradecahydro-1H-picene-3,8-diol
InChI :InChI=1/C30H50O3/c1-18-19(17-31)10-13-28(5)24(33)16-30(7)20(25(18)28)8-9-22-27(4)14-12-23(32)26(2,3)21(27)11-15-29(22,30)6/h10,18,20-25,31-33H,8-9,11-17H2,1-7H3/t18-,20-,21+,22-,23+,24+,25-,27+,28-,29-,30-/m1/s1
Std.InChI: InChI=1S/C30H50O3/c1-18-19(17-31)10-13-28(5)24(33)16-30(7)20(25(18)28)8-9-22-27(4)14-12-23(32)26(2,3)21(27)11-15-29(22,30)6/h10,18,20-25,31-33H,8-9,11-17H2,1-7H3/t18-,20-,21+,22-,23+,24+,25-,27+,28-,29-,30-/m1/s1
InChIKey :IWSSUQMYGYYLOJ-LKFLZPLEBS
Std.InChIKey: IWSSUQMYGYYLOJ-LKFLZPLESA-N
SMILES :C[C@H]1[C@@H]2[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(C[C@@H]([C@]2(CC=C1CO)C)O)C)C)(C)C)O)C
Molar Refractivity :135.14 ± 0.3 cm3 (est)
Parachor :1086.5 ± 6.0 cm3 (est)
Index of Refraction :1.532 ± 0.02
(est)
Surface Tension :38.7 ± 3.0 dyne/cm (est)
Density :1.053 ± 0.06 g/cm3 (est)
Polarizability :53.57 ± 0.5 10-24cm3 (est)