IUPAC Name :methyl (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
InChI :InChI=1/C31H50O3/c1-26(2)15-17-31(25(33)34-8)18-16-29(6)20(21(31)19-26)9-10-23-28(5)13-12-24(32)27(3,4)22(28)11-14-30(23,29)7/h9,21-24,32H,10-19H2,1-8H3/t21-,22-,23+,24-,28-,29+,30+,31-/m0/s1
Std.InChI: InChI=1S/C31H50O3/c1-26(2)15-17-31(25(33)34-8)18-16-29(6)20(21(31)19-26)9-10-23-28(5)13-12-24(32)27(3,4)22(28)11-14-30(23,29)7/h9,21-24,32H,10-19H2,1-8H3/t21-,22-,23+,24-,28-,29+,30+,31-/m0/s1
InChIKey :BTXWOKJOAGWCSN-JBYJGCOVBX
Std.InChIKey: BTXWOKJOAGWCSN-JBYJGCOVSA-N
SMILES :C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)OC)C)C)(C)C)O
Molar Refractivity :138.41 ± 0.4 cm3 (est)
Parachor :1120.4 ± 6.0 cm3 (est)
Index of Refraction :1.542 ± 0.03
(est)
Surface Tension :42.1 ± 5.0 dyne/cm (est)
Density :1.07 ± 0.1 g/cm3 (est)
Polarizability :54.87 ± 0.5 10-24cm3 (est)