IUPAC Name :(2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bR)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
InChI :InChI=1/C30H48O3/c1-25(2)21-10-13-30(7)22(28(21,5)12-11-23(25)31)9-8-19-20-18-27(4,24(32)33)15-14-26(20,3)16-17-29(19,30)6/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23-,26+,27+,28-,29+,30+/m0/s1
Std.InChI: InChI=1S/C30H48O3/c1-25(2)21-10-13-30(7)22(28(21,5)12-11-23(25)31)9-8-19-20-18-27(4,24(32)33)15-14-26(20,3)16-17-29(19,30)6/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23-,26+,27+,28-,29+,30+/m0/s1
InChIKey :JZFSMVXQUWRSIW-FWXFQHTDBW
Std.InChIKey: JZFSMVXQUWRSIW-FWXFQHTDSA-N
SMILES :C[C@]12CC[C@@](C[C@H]1C3=CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)(C)C(=O)O
MDL: MFCD20274874
Molar Refractivity :133.57 ± 0.4 cm3 (est)
Parachor :1077.0 ± 6.0 cm3 (est)
Index of Refraction :1.557 ± 0.03
(est)
Surface Tension :45.4 ± 5.0 dyne/cm (est)
Density :1.10 ± 0.1 g/cm3 (est)
Polarizability :52.95 ± 0.5 10-24cm3 (est)