IUPAC Name :3,5,7-trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]chromen-4-one
InChI :InChI=1/C25H20O10/c1-32-17-6-11(2-4-14(17)28)24-20(10-26)33-16-5-3-12(7-18(16)34-24)25-23(31)22(30)21-15(29)8-13(27)9-19(21)35-25/h2-9,20,24,26-29,31H,10H2,1H3/t20-,24-/m1/s1
Std.InChI: InChI=1S/C25H20O10/c1-32-17-6-11(2-4-14(17)28)24-20(10-26)33-16-5-3-12(7-18(16)34-24)25-23(31)22(30)21-15(29)8-13(27)9-19(21)35-25/h2-9,20,24,26-29,31H,10H2,1H3/t20-,24-/m1/s1
InChIKey :BVKQRAYKLBRNIK-HYBUGGRVBP
Std.InChIKey: BVKQRAYKLBRNIK-HYBUGGRVSA-N
SMILES :COC1=C(C=CC(=C1)[C@@H]2[C@H](OC3=C(O2)C=C(C=C3)C4=C(C(=O)C5=C(C=C(C=C5O4)O)O)O)CO)O
Molar Refractivity :119.56 ± 0.3 cm3 (est)
Parachor :907.9 ± 6.0 cm3 (est)
Index of Refraction :1.712 ± 0.02
(est)
Surface Tension :78.3 ± 3.0 dyne/cm (est)
Density :1.574 ± 0.06 g/cm3 (est)
Polarizability :47.39 ± 0.5 10-24cm3 (est)