IUPAC Name :5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[1-(4-hydroxyphenyl)ethyl]-8-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
InChI :InChI=1/C29H28O11/c1-12(13-2-6-15(31)7-3-13)20-24(35)21-17(33)10-18(14-4-8-16(32)9-5-14)39-28(21)22(25(20)36)29-27(38)26(37)23(34)19(11-30)40-29/h2-10,12,19,23,26-27,29-32,34-38H,11H2,1H3/t12?,19-,23-,26+,27-,29-/m1/s1
Std.InChI: InChI=1S/C29H28O11/c1-12(13-2-6-15(31)7-3-13)20-24(35)21-17(33)10-18(14-4-8-16(32)9-5-14)39-28(21)22(25(20)36)29-27(38)26(37)23(34)19(11-30)40-29/h2-10,12,19,23,26-27,29-32,34-38H,11H2,1H3/t12?,19-,23-,26+,27-,29-/m1/s1
InChIKey :VAVVYQGVFZBLHB-OAKRFNPRBH
Std.InChIKey: VAVVYQGVFZBLHB-OAKRFNPRSA-N
SMILES :CC(C1=CC=C(C=C1)O)C2=C(C3=C(C(=C2O)[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC(=CC3=O)C5=CC=C(C=C5)O)O
Molar Refractivity :139.53 ± 0.3 cm3 (est)
Parachor :1074.1 ± 6.0 cm3 (est)
Index of Refraction :1.725 ± 0.02
(est)
Surface Tension :87.2 ± 3.0 dyne/cm (est)
Density :1.572 ± 0.06 g/cm3 (est)
Polarizability :55.31 ± 0.5 10-24cm3 (est)