IUPAC Name :methyl (2S,4aS,6aR,6aS,6bR,8aR,10S,12aS,14bR)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylat
InChI :InChI=1/C31H48O4/c1-26(2)22-9-12-31(7)24(29(22,5)11-10-23(26)33)21(32)17-19-20-18-28(4,25(34)35-8)14-13-27(20,3)15-16-30(19,31)6/h17,20,22-24,33H,9-16,18H2,1-8H3/t20-,22-,23-,24+,27+,28-,29-,30+,31+/m0/s1
Std.InChI: InChI=1S/C31H48O4/c1-26(2)22-9-12-31(7)24(29(22,5)11-10-23(26)33)21(32)17-19-20-18-28(4,25(34)35-8)14-13-27(20,3)15-16-30(19,31)6/h17,20,22-24,33H,9-16,18H2,1-8H3/t20-,22-,23-,24+,27+,28-,29-,30+,31+/m0/s1
InChIKey :RMIVRCBSQPCSCQ-BDANYOJNBC
Std.InChIKey: RMIVRCBSQPCSCQ-BDANYOJNSA-N
SMILES :C[C@]12CC[C@](C[C@H]1C3=CC(=O)[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)OC
Molar Refractivity :138.52 ± 0.4 cm3 (est)
Parachor :1125.6 ± 6.0 cm3 (est)
Index of Refraction :1.547 ± 0.03
(est)
Surface Tension :44.2 ± 5.0 dyne/cm (est)
Density :1.11 ± 0.1 g/cm3 (est)
Polarizability :54.91 ± 0.5 10-24cm3 (est)