IUPAC Name :5-[(2S,3S)-4-[(2R,3R)-5-[(E)-2-[3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-1-benzofuran-4-yl]ethenyl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol
InChI :InChI=1/C56H40O12/c57-35-10-4-29(5-11-35)54-50(33-19-38(60)23-39(61)20-33)49-32(18-42(64)26-47(49)67-54)3-1-28-2-16-46-44(17-28)52(56(66-46)31-8-14-37(59)15-9-31)45-25-43(65)27-48-53(45)51(34-21-40(62)24-41(63)22-34)55(68-48)30-6-12-36(58)13-7-30/h1-27,51-52,55-65H/b3-1+/t51-,52-,55+,56-/m0/s1
Std.InChI: InChI=1S/C56H40O12/c57-35-10-4-29(5-11-35)54-50(33-19-38(60)23-39(61)20-33)49-32(18-42(64)26-47(49)67-54)3-1-28-2-16-46-44(17-28)52(56(66-46)31-8-14-37(59)15-9-31)45-25-43(65)27-48-53(45)51(34-21-40(62)24-41(63)22-34)55(68-48)30-6-12-36(58)13-7-30/h1-27,51-52,55-65H/b3-1+/t51-,52-,55+,56-/m0/s1
InChIKey :RBEDFIPDONMHBV-VUIIBDILBW
Std.InChIKey: RBEDFIPDONMHBV-VUIIBDILSA-N
SMILES :C1=CC(=CC=C1[C@@H]2[C@H](C3=C(O2)C=C(C=C3[C@H]4[C@@H](OC5=C4C=C(C=C5)/C=C/C6=CC(=CC7=C6C(=C(O7)C8=CC=C(C=C8)O)C9=CC(=CC(=C9)O)O)O)C1=CC=C(C=C1)O)O)C1=CC(=CC(=C1)O)O)O
Molar Refractivity :256.01 ± 0.3 cm3 (est)
Parachor :1816.6 ± 4.0 cm3 (est)
Index of Refraction :1.792 ± 0.02
(est)
Surface Tension :82.3 ± 3.0 dyne/cm (est)
Density :1.500 ± 0.06 g/cm3 (est)
Polarizability :101.49 ± 0.5 10-24cm3 (est)