IUPAC Name :2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
InChI :InChI=1/C22H22O12/c1-31-21-14(33-22-20(30)19(29)17(27)15(7-23)34-22)6-13-16(18(21)28)11(26)5-12(32-13)8-2-3-9(24)10(25)4-8/h2-6,15,17,19-20,22-25,27-30H,7H2,1H3/t15-,17-,19+,20-,22-/m1/s1
Std.InChI: InChI=1S/C22H22O12/c1-31-21-14(33-22-20(30)19(29)17(27)15(7-23)34-22)6-13-16(18(21)28)11(26)5-12(32-13)8-2-3-9(24)10(25)4-8/h2-6,15,17,19-20,22-25,27-30H,7H2,1H3/t15-,17-,19+,20-,22-/m1/s1
InChIKey :DMXHXBGUNHLMQO-IWLDQSELBD
Std.InChIKey: DMXHXBGUNHLMQO-IWLDQSELSA-N
SMILES :COC1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC(=C(C=C3)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
Molar Refractivity :112.23 ± 0.3 cm3 (est)
Parachor :887.7 ± 6.0 cm3 (est)
Index of Refraction :1.715 ± 0.02
(est)
Surface Tension :93.2 ± 3.0 dyne/cm (est)
Density :1.674 ± 0.06 g/cm3 (est)
Polarizability :44.49 ± 0.5 10-24cm3 (est)