IUPAC Name :3-(1,3-benzodioxol-5-yl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
InChI :InChI=1/C22H20O10/c23-7-17-19(25)20(26)21(27)22(32-17)31-11-2-3-12-15(6-11)28-8-13(18(12)24)10-1-4-14-16(5-10)30-9-29-14/h1-6,8,17,19-23,25-27H,7,9H2/t17-,19-,20+,21-,22-/m1/s1
Std.InChI: InChI=1S/C22H20O10/c23-7-17-19(25)20(26)21(27)22(32-17)31-11-2-3-12-15(6-11)28-8-13(18(12)24)10-1-4-14-16(5-10)30-9-29-14/h1-6,8,17,19-23,25-27H,7,9H2/t17-,19-,20+,21-,22-/m1/s1
InChIKey :GWACEFYEIOPAJV-MIUGBVLSBR
Std.InChIKey: GWACEFYEIOPAJV-MIUGBVLSSA-N
SMILES :C1OC2=C(O1)C=C(C=C2)C3=COC4=C(C3=O)C=CC(=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O
MDL: MFCD00272142
Molar Refractivity :106.07 ± 0.3 cm3 (est)
Parachor :831.1 ± 6.0 cm3 (est)
Index of Refraction :1.689 ± 0.02
(est)
Surface Tension :80.4 ± 3.0 dyne/cm (est)
Density :1.601 ± 0.06 g/cm3 (est)
Polarizability :42.05 ± 0.5 10-24cm3 (est)