IUPAC Name :[4-formyl-2,3,4-trihydroxy-5-(3,4,5-trihydroxybenzoyl)oxypentyl] 3,4,5-trihydroxybenzoate
InChI :InChI=1/C20H20O14/c21-6-20(32,7-34-19(31)9-3-12(24)16(28)13(25)4-9)17(29)14(26)5-33-18(30)8-1-10(22)15(27)11(23)2-8/h1-4,6,14,17,22-29,32H,5,7H2
Std.InChI: InChI=1S/C20H20O14/c21-6-20(32,7-34-19(31)9-3-12(24)16(28)13(25)4-9)17(29)14(26)5-33-18(30)8-1-10(22)15(27)11(23)2-8/h1-4,6,14,17,22-29,32H,5,7H2
InChIKey :STINYPFJROKCKD-UHFFFAOYAE
Std.InChIKey: STINYPFJROKCKD-UHFFFAOYSA-N
SMILES :c1c(cc(c(c1O)O)O)C(=O)OCC(C(C(COC(=O)c2cc(c(c(c2)O)O)O)(C=O)O)O)O
MDL: MFCD00017418
Molar Refractivity :108.49 ± 0.3 cm3 (est)
Parachor :890.2 ± 4.0 cm3 (est)
Index of Refraction :1.724 ± 0.02
(est)
Surface Tension :112.4 ± 3.0 dyne/cm (est)
Density :1.771 ± 0.06 g/cm3 (est)
Polarizability :43.01 ± 0.5 10-24cm3 (est)