IUPAC Name :[(3S,4R,5R)-5-[(1R)-2-hydroxy-1-(16-methylheptadecanoyloxy)ethyl]-4-(16-methylheptadecanoyloxy)oxolan-3-yl] 16-methylheptadecanoate
InChI :InChI=1/C60H114O8/c1-51(2)43-37-31-25-19-13-7-10-16-22-28-34-40-46-56(62)66-54(49-61)59-60(68-58(64)48-42-36-30-24-18-12-9-15-21-27-33-39-45-53(5)6)55(50-65-59)67-57(63)47-41-35-29-23-17-11-8-14-20-26-32-38-44-52(3)4/h51-55,59-61H,7-50H2,1-6H3/t54-,55+,59-,60-/m1/s1
Std.InChI: InChI=1S/C60H114O8/c1-51(2)43-37-31-25-19-13-7-10-16-22-28-34-40-46-56(62)66-54(49-61)59-60(68-58(64)48-42-36-30-24-18-12-9-15-21-27-33-39-45-53(5)6)55(50-65-59)67-57(63)47-41-35-29-23-17-11-8-14-20-26-32-38-44-52(3)4/h51-55,59-61H,7-50H2,1-6H3/t54-,55+,59-,60-/m1/s1
InChIKey :QWSHIYVIOOXKLL-LLPUSWRMBZ
Std.InChIKey: QWSHIYVIOOXKLL-LLPUSWRMSA-N
SMILES :O=C(O[C@@H]1[C@@H](OC(=O)CCCCCCCCCCCCCCC(C)C)[C@H](OC1)[C@H](OC(=O)CCCCCCCCCCCCCCC(C)C)CO)CCCCCCCCCCCCCCC(C)C
Molar Refractivity :286.54 ± 0.4 cm3 (est)
Parachor :2504.2 ± 6.0 cm3 (est)
Index of Refraction :1.487 ± 0.03
(est)
Surface Tension :39.9 ± 5.0 dyne/cm (est)
Density :0.96 ± 0.1 g/cm3 (est)
Polarizability :113.59 ± 0.5 10-24cm3 (est)