IUPAC Name :[8-[[5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-6-yl]methyl]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
InChI :InChI=1/C45H36O22/c46-22-12-23(47)20-10-34(65-44(62)16-5-29(53)39(60)30(54)6-16)42(15-3-27(51)38(59)28(52)4-15)67-43(20)19(22)9-18-24(48)13-33-21(36(18)57)11-35(41(64-33)14-1-25(49)37(58)26(50)2-14)66-45(63)17-7-31(55)40(61)32(56)8-17/h1-8,12-13,34-35,41-42,46-61H,9-11H2
Std.InChI: InChI=1S/C45H36O22/c46-22-12-23(47)20-10-34(65-44(62)16-5-29(53)39(60)30(54)6-16)42(15-3-27(51)38(59)28(52)4-15)67-43(20)19(22)9-18-24(48)13-33-21(36(18)57)11-35(41(64-33)14-1-25(49)37(58)26(50)2-14)66-45(63)17-7-31(55)40(61)32(56)8-17/h1-8,12-13,34-35,41-42,46-61H,9-11H2
InChIKey :FKRUMFFNBGSGGM-UHFFFAOYAD
Std.InChIKey: FKRUMFFNBGSGGM-UHFFFAOYSA-N
SMILES :C1C(C(OC2=C1C(=CC(=C2CC3=C(C=C4C(=C3O)CC(C(O4)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)O)C7=CC(=C(C(=C7)O)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O
Molar Refractivity :219.44 ± 0.4 cm3 (est)
Parachor :1694.3 ± 6.0 cm3 (est)
Index of Refraction :1.938 ± 0.03
(est)
Surface Tension :187.2 ± 5.0 dyne/cm (est)
Density :2.02 ± 0.1 g/cm3 (est)
Polarizability :86.99 ± 0.5 10-24cm3 (est)