IUPAC Name :1-[2,4-dihydroxy-6-[(2S,4R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-phenylpropan-1-one
InChI :InChI=1/C21H24O9/c22-10-16-18(26)19(27)20(28)21(30-16)29-15-9-12(23)8-14(25)17(15)13(24)7-6-11-4-2-1-3-5-11/h1-5,8-9,16,18-23,25-28H,6-7,10H2/t16-,18-,19+,20-,21-/m1/s1
Std.InChI: InChI=1S/C21H24O9/c22-10-16-18(26)19(27)20(28)21(30-16)29-15-9-12(23)8-14(25)17(15)13(24)7-6-11-4-2-1-3-5-11/h1-5,8-9,16,18-23,25-28H,6-7,10H2/t16-,18-,19+,20-,21-/m1/s1
InChIKey :NLGUKXQDDTZCDG-QNDFHXLGBE
Std.InChIKey: NLGUKXQDDTZCDG-QNDFHXLGSA-N
SMILES :c1ccc(cc1)CCC(=O)c2c(cc(cc2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O
Molar Refractivity :104.87 ± 0.3 cm3 (est)
Parachor :824.3 ± 4.0 cm3 (est)
Index of Refraction :1.665 ± 0.02
(est)
Surface Tension :72.8 ± 3.0 dyne/cm (est)
Density :1.490 ± 0.06 g/cm3 (est)
Polarizability :41.57 ± 0.5 10-24cm3 (est)