IUPAC Name :[(1S,4aR,6R,7R,7aR)-6-hydroxy-4,7-bis(hydroxymethyl)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl] 3-methylbutanoate
InChI :InChI=1/C15H24O6/c1-8(2)3-13(19)21-15-14-10(9(5-16)7-20-15)4-12(18)11(14)6-17/h7-8,10-12,14-18H,3-6H2,1-2H3/t10-,11+,12+,14+,15-/m0/s1
Std.InChI: InChI=1S/C15H24O6/c1-8(2)3-13(19)21-15-14-10(9(5-16)7-20-15)4-12(18)11(14)6-17/h7-8,10-12,14-18H,3-6H2,1-2H3/t10-,11+,12+,14+,15-/m0/s1
InChIKey :PWJFLTCGPYRIGH-PRSHDEELBL
Std.InChIKey: PWJFLTCGPYRIGH-PRSHDEELSA-N
SMILES :O=C(O[C@@H]2O\C=C(/[C@@H]1C[C@@H](O)[C@H]([C@@H]12)CO)CO)CC(C)C
Molar Refractivity :75.16 ± 0.4 cm3 (est)
Parachor :640.3 ± 6.0 cm3 (est)
Index of Refraction :1.547 ± 0.03
(est)
Surface Tension :53.3 ± 5.0 dyne/cm (est)
Density :1.26 ± 0.1 g/cm3 (est)
Polarizability :29.79 ± 0.5 10-24cm3 (est)