IUPAC Name :(1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
InChI :InChI=1/C32H50O4/c1-19-11-16-32(27(34)35)18-17-30(7)22(26(32)20(19)2)9-10-24-29(6)14-13-25(36-21(3)33)28(4,5)23(29)12-15-31(24,30)8/h9,19-20,23-26H,10-18H2,1-8H3,(H,34,35)/t19-,20+,23+,24-,25+,26+,29+,30-,31-,32+/m1/s1
Std.InChI: InChI=1S/C32H50O4/c1-19-11-16-32(27(34)35)18-17-30(7)22(26(32)20(19)2)9-10-24-29(6)14-13-25(36-21(3)33)28(4,5)23(29)12-15-31(24,30)8/h9,19-20,23-26H,10-18H2,1-8H3,(H,34,35)/t19-,20+,23+,24-,25+,26+,29+,30-,31-,32+/m1/s1
InChIKey :PHFUCJXOLZAQNH-OTMOLZNZBG
Std.InChIKey: PHFUCJXOLZAQNH-OTMOLZNZSA-N
SMILES :C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)OC(=O)C)C)C)[C@@H]2[C@H]1C)C)C(=O)O
Molar Refractivity :143.10 ± 0.4 cm3 (est)
Parachor :1165.3 ± 6.0 cm3 (est)
Index of Refraction :1.543 ± 0.03
(est)
Surface Tension :43.6 ± 5.0 dyne/cm (est)
Density :1.09 ± 0.1 g/cm3 (est)
Polarizability :56.73 ± 0.5 10-24cm3 (est)