IUPAC Name :2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
InChI :InChI=1/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1
Std.InChI: InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1
InChIKey :OVSQVDMCBVZWGM-DTGCRPNFBG
Std.InChIKey: OVSQVDMCBVZWGM-DTGCRPNFSA-N
SMILES :O=C2C(\O[C@@H]1O[C@@H]([C@H](O)[C@H](O)[C@H]1O)CO)=C(/Oc3cc(O)cc(O)c23)c4ccc(O)c(O)c4
MDL: MFCD00016933
Molar Refractivity :105.98 ± 0.4 cm3 (est)
Parachor :842.3 ± 6.0 cm3 (est)
Index of Refraction :1.803 ± 0.03
(est)
Surface Tension :134.8 ± 5.0 dyne/cm (est)
Density :1.87 ± 0.1 g/cm3 (est)
Polarizability :42.01 ± 0.5 10-24cm3 (est)