IUPAC Name :2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
InChI :InChI=1/C21H20O12/c22-6-13-15(26)17(28)19(30)21(33-13)31-8-4-11(25)14-12(5-8)32-20(18(29)16(14)27)7-1-2-9(23)10(24)3-7/h1-5,13,15,17,19,21-26,28-30H,6H2/t13-,15-,17+,19-,21-/m1/s1
Std.InChI: InChI=1S/C21H20O12/c22-6-13-15(26)17(28)19(30)21(33-13)31-8-4-11(25)14-12(5-8)32-20(18(29)16(14)27)7-1-2-9(23)10(24)3-7/h1-5,13,15,17,19,21-26,28-30H,6H2/t13-,15-,17+,19-,21-/m1/s1
InChIKey :BBFYUPYFXSSMNV-HMGRVEAOBZ
Std.InChIKey: BBFYUPYFXSSMNV-HMGRVEAOSA-N
SMILES :C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O)O
MDL: MFCD01762823
Molar Refractivity :107.14 ± 0.3 cm3 (est)
Parachor :842.3 ± 6.0 cm3 (est)
Index of Refraction :1.774 ± 0.02 (est)
Surface Tension :116.1 ± 3.0 dyne/cm (est)
Density :1.809 ± 0.06 g/cm3 (est)
Polarizability :42.47 ± 0.5 10-24cm3 (est)