gastrodin

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IUPAC Name :(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-(hydroxymethyl)phenoxy]oxane-3,4,5-triol
InChI :InChI=1/C13H18O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11+,12-,13-/m1/s1
Std.InChI: InChI=1S/C13H18O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11+,12-,13-/m1/s1
InChIKey :PUQSUZTXKPLAPR-UJPOAAIJBX
Std.InChIKey: PUQSUZTXKPLAPR-UJPOAAIJSA-N
SMILES :O(c1ccc(cc1)CO)[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO
MDL: MFCD00272169
Molar Refractivity :68.41 ± 0.3 cm3 (est)
Parachor :550.7 ± 4.0 cm3 (est)
Index of Refraction :1.638 ± 0.02 (est)
Surface Tension :70.1 ± 3.0 dyne/cm (est)
Density :1.504 ± 0.06 g/cm3 (est)
Polarizability :27.12 ± 0.5 10-24cm3 (est)