IUPAC Name :2-[2-[[3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methoxycarbonyl]-4,5-dihydroxyphenoxy]-3,4,5-trihydroxybenzoic acid
InChI :InChI=1/C27H26O18/c28-6-17-19(35)20(36)22(38)27(44-17)45-24-14(32)1-8(2-15(24)33)7-42-26(41)9-3-11(29)12(30)5-16(9)43-23-10(25(39)40)4-13(31)18(34)21(23)37/h1-5,17,19-20,22,27-38H,6-7H2,(H,39,40)/t17-,19-,20+,22-,27+/m1/s1
Std.InChI: InChI=1S/C27H26O18/c28-6-17-19(35)20(36)22(38)27(44-17)45-24-14(32)1-8(2-15(24)33)7-42-26(41)9-3-11(29)12(30)5-16(9)43-23-10(25(39)40)4-13(31)18(34)21(23)37/h1-5,17,19-20,22,27-38H,6-7H2,(H,39,40)/t17-,19-,20+,22-,27+/m1/s1
InChIKey :ADKKRTUFQLTGBL-NVHGRHHQBC
Std.InChIKey: ADKKRTUFQLTGBL-NVHGRHHQSA-N
SMILES :C1=C(C=C(C(=C1O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)COC(=O)C3=CC(=C(C=C3OC4=C(C(=C(C=C4C(=O)O)O)O)O)O)O
Molar Refractivity :144.76 ± 0.3 cm3 (est)
Parachor :1132.5 ± 4.0 cm3 (est)
Index of Refraction :1.773 ± 0.02
(est)
Surface Tension :113.1 ± 3.0 dyne/cm (est)
Density :1.838 ± 0.06 g/cm3 (est)
Polarizability :57.38 ± 0.5 10-24cm3 (est)