IUPAC Name :(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(2R,3R)-6-hydroxy-4-[(2S,3S)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
InChI :InChI=1/C48H42O14/c49-22-38-43(56)44(57)45(58)48(62-38)59-34-17-27(16-31(53)18-34)40-41-35(19-33(55)21-37(41)61-46(40)24-5-11-29(51)12-6-24)42-39-26(4-1-23-2-9-28(50)10-3-23)15-32(54)20-36(39)60-47(42)25-7-13-30(52)14-8-25/h1-21,38,40,42-58H,22H2/b4-1+/t38-,40-,42+,43-,44+,45-,46+,47-,48-/m1/s1
Std.InChI: InChI=1S/C48H42O14/c49-22-38-43(56)44(57)45(58)48(62-38)59-34-17-27(16-31(53)18-34)40-41-35(19-33(55)21-37(41)61-46(40)24-5-11-29(51)12-6-24)42-39-26(4-1-23-2-9-28(50)10-3-23)15-32(54)20-36(39)60-47(42)25-7-13-30(52)14-8-25/h1-21,38,40,42-58H,22H2/b4-1+/t38-,40-,42+,43-,44+,45-,46+,47-,48-/m1/s1
InChIKey :SZKVNSODIJRAET-AKFYMKAIBS
Std.InChIKey: SZKVNSODIJRAET-AKFYMKAISA-N
SMILES :C1=CC(=CC=C1/C=C/C2=CC(=CC3=C2[C@@H]([C@H](O3)C4=CC=C(C=C4)O)C5=CC(=CC6=C5[C@H]([C@@H](O6)C7=CC=C(C=C7)O)C8=CC(=CC(=C8)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)O)O)O)O
Molar Refractivity :226.75 ± 0.3 cm3 (est)
Parachor :1657.0 ± 4.0 cm3 (est)
Index of Refraction :1.766 ± 0.02
(est)
Surface Tension :84.0 ± 3.0 dyne/cm (est)
Density :1.539 ± 0.06 g/cm3 (est)
Polarizability :89.89 ± 0.5 10-24cm3 (est)