IUPAC Name :(2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid
InChI :InChI=1/C29H38O4/c1-17-18-7-8-21-27(4,19(18)15-20(30)23(17)31)12-14-29(6)22-16-26(3,24(32)33)10-9-25(22,2)11-13-28(21,29)5/h7-8,15,22,31H,9-14,16H2,1-6H3,(H,32,33)/t22-,25-,26-,27+,28-,29+/m1/s1
Std.InChI: InChI=1S/C29H38O4/c1-17-18-7-8-21-27(4,19(18)15-20(30)23(17)31)12-14-29(6)22-16-26(3,24(32)33)10-9-25(22,2)11-13-28(21,29)5/h7-8,15,22,31H,9-14,16H2,1-6H3,(H,32,33)/t22-,25-,26-,27+,28-,29+/m1/s1
InChIKey :KQJSQWZMSAGSHN-JJWQIEBTBS
Std.InChIKey: KQJSQWZMSAGSHN-JJWQIEBTSA-N
SMILES :CC1=C(C(=O)C=C2C1=CC=C3[C@]2(CC[C@@]4([C@@]3(CC[C@@]5([C@H]4C[C@](CC5)(C)C(=O)O)C)C)C)C)O
MDL: MFCD03424073
Molar Refractivity :127.93 ± 0.4 cm3 (est)
Parachor :999.8 ± 6.0 cm3 (est)
Index of Refraction :1.602 ± 0.03
(est)
Surface Tension :51.7 ± 5.0 dyne/cm (est)
Density :1.20 ± 0.1 g/cm3 (est)
Polarizability :50.71 ± 0.5 10-24cm3 (est)