IUPAC Name :[(1S,4S,5aS,5bR,7aS,11aS,11bR,13R,13aR)-1-acetyloxy-13-hydroxy-5a,5b,8,8,11a,13a-hexamethyl-4,5,6,7,7a,9,10,11,11b,12,13,13b-dodecahydro-1H-phenanthro[2,1-e][2]benzofuran-4-yl] acetate
InChI :InChI=1/C30H46O6/c1-17(31)35-20-15-29(7)28(6)13-10-21-26(3,4)11-9-12-27(21,5)22(28)14-23(33)30(29,8)24-19(20)16-34-25(24)36-18(2)32/h16,20-25,33H,9-15H2,1-8H3/t20-,21-,22+,23+,24?,25-,27-,28+,29-,30+/m0/s1
Std.InChI: InChI=1S/C30H46O6/c1-17(31)35-20-15-29(7)28(6)13-10-21-26(3,4)11-9-12-27(21,5)22(28)14-23(33)30(29,8)24-19(20)16-34-25(24)36-18(2)32/h16,20-25,33H,9-15H2,1-8H3/t20-,21-,22+,23+,24?,25-,27-,28+,29-,30+/m0/s1
InChIKey :GCGWIVLWDZJIGO-CFGFJSJZBW
Std.InChIKey: GCGWIVLWDZJIGO-CFGFJSJZSA-N
SMILES :O=C(O[C@@H]5C\1=C\O[C@@H](OC(=O)C)C/1[C@@]4([C@@]([C@]2([C@@H]([C@@]3([C@@H](CC2)C(C)(C)CCC3)C)C[C@H]4O)C)(C)C5)C)C
Molar Refractivity :137.32 ± 0.4 cm3 (est)
Parachor :1125.8 ± 6.0 cm3 (est)
Index of Refraction :1.546 ± 0.03
(est)
Surface Tension :45.6 ± 5.0 dyne/cm (est)
Density :1.16 ± 0.1 g/cm3 (est)
Polarizability :54.44 ± 0.5 10-24cm3 (est)