IUPAC Name :(3S,5S)-1-(4-hydroxy-3,5-dimethoxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)heptane-3,5-diol
InChI :InChI=1/C22H30O7/c1-27-19-10-14(6-9-18(19)25)4-7-16(23)13-17(24)8-5-15-11-20(28-2)22(26)21(12-15)29-3/h6,9-12,16-17,23-26H,4-5,7-8,13H2,1-3H3/t16-,17-/m0/s1
Std.InChI: InChI=1S/C22H30O7/c1-27-19-10-14(6-9-18(19)25)4-7-16(23)13-17(24)8-5-15-11-20(28-2)22(26)21(12-15)29-3/h6,9-12,16-17,23-26H,4-5,7-8,13H2,1-3H3/t16-,17-/m0/s1
InChIKey :UEKHBUNMFZUBFK-IRXDYDNUBG
Std.InChIKey: UEKHBUNMFZUBFK-IRXDYDNUSA-N
SMILES :COC1=CC(=CC(=C1O)OC)CC[C@@H](C[C@H](CCC2=CC(=C(C=C2)O)OC)O)O
Molar Refractivity :110.23 ± 0.3 cm3 (est)
Parachor :883.1 ± 4.0 cm3 (est)
Index of Refraction :1.582 ± 0.02
(est)
Surface Tension :51.2 ± 3.0 dyne/cm (est)
Density :1.231 ± 0.06 g/cm3 (est)
Polarizability :43.70 ± 0.5 10-24cm3 (est)