InChI :InChI=1/C49H76O3/c1-34(2)19-14-20-35(3)21-15-22-36(4)25-17-31-49(13)32-29-43-42(10)46(40(8)41(9)47(43)52-49)51-45(50)33-38(6)24-16-23-37(5)27-28-44-39(7)26-18-30-48(44,11)12/h16,23-24,27-28,33-36H,14-15,17-22,25-26,29-32H2,1-13H3/b24-16+,28-27+,37-23-,38-33-/t35-,36-,49-/m1/s1
Std.InChI: InChI=1S/C49H76O3/c1-34(2)19-14-20-35(3)21-15-22-36(4)25-17-31-49(13)32-29-43-42(10)46(40(8)41(9)47(43)52-49)51-45(50)33-38(6)24-16-23-37(5)27-28-44-39(7)26-18-30-48(44,11)12/h16,23-24,27-28,33-36H,14-15,17-22,25-26,29-32H2,1-13H3/b24-16+,28-27+,37-23-,38-33-/t35-,36-,49-/m1/s1
InChIKey :RIQIJXOWVAHQES-OWUNKUSIBE
Std.InChIKey: RIQIJXOWVAHQES-OWUNKUSISA-N
SMILES :O=C(Oc2c(c(c1O[C@](CCc1c2C)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C)C)/C=C(\C=C\C=C(/C=C/C3=C(\C)CCCC3(C)C)C)C
Molar Refractivity :227.17 ± 0.3 cm3 (est)
Parachor :1814.1 ± 6.0 cm3 (est)
Index of Refraction :1.523 ± 0.02 (est)
Surface Tension :35.5 ± 3.0 dyne/cm (est)
Density :0.959 ± 0.06 g/cm3 (est)
Polarizability :90.05 ± 0.5 10-24cm3 (est)