IUPAC Name :[(1S,2R,6R)-2-[2,6-dihydroxy-4-(6-hydroxy-1-benzofuran-2-yl)phenyl]-6-(4-hydroxyphenyl)-4-methylcyclohex-3-en-1-yl]-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]methanone
InChI :InChI=1/C39H36O8/c1-20(2)4-11-27-31(42)13-12-28(38(27)45)39(46)36-29(22-5-8-25(40)9-6-22)14-21(3)15-30(36)37-32(43)16-24(17-33(37)44)34-18-23-7-10-26(41)19-35(23)47-34/h4-10,12-13,15-19,29-30,36,40-45H,11,14H2,1-3H3/t29-,30+,36-/m0/s1
Std.InChI: InChI=1S/C39H36O8/c1-20(2)4-11-27-31(42)13-12-28(38(27)45)39(46)36-29(22-5-8-25(40)9-6-22)14-21(3)15-30(36)37-32(43)16-24(17-33(37)44)34-18-23-7-10-26(41)19-35(23)47-34/h4-10,12-13,15-19,29-30,36,40-45H,11,14H2,1-3H3/t29-,30+,36-/m0/s1
InChIKey :RQIKMRKKKIMUNB-BLBFUMABBV
Std.InChIKey: RQIKMRKKKIMUNB-BLBFUMABSA-N
SMILES :CC1=C[C@H]([C@H]([C@@H](C1)C2=CC=C(C=C2)O)C(=O)C3=C(C(=C(C=C3)O)CC=C(C)C)O)C4=C(C=C(C=C4O)C5=CC6=C(O5)C=C(C=C6)O)O
Molar Refractivity :179.88 ± 0.3 cm3 (est)
Parachor :1331.2 ± 6.0 cm3 (est)
Index of Refraction :1.688 ± 0.02
(est)
Surface Tension :63.4 ± 3.0 dyne/cm (est)
Density :1.341 ± 0.06 g/cm3 (est)
Polarizability :71.31 ± 0.5 10-24cm3 (est)