aucubin

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IUPAC Name :(2S,3R,4S,5S,6R)-2-[[(1S,4aR,5S,7aS)-5-hydroxy-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
InChI :InChI=1/C15H22O9/c16-4-6-3-8(18)7-1-2-22-14(10(6)7)24-15-13(21)12(20)11(19)9(5-17)23-15/h1-3,7-21H,4-5H2/t7-,8+,9+,10+,11+,12-,13+,14-,15-/m0/s1
Std.InChI: InChI=1S/C15H22O9/c16-4-6-3-8(18)7-1-2-22-14(10(6)7)24-15-13(21)12(20)11(19)9(5-17)23-15/h1-3,7-21H,4-5H2/t7-,8+,9+,10+,11+,12-,13+,14-,15-/m0/s1
InChIKey :RJWJHRPNHPHBRN-FKVJWERZBS
Std.InChIKey: RJWJHRPNHPHBRN-FKVJWERZSA-N
SMILES :O2\C=C/[C@@H]1[C@@H](C(=C/[C@H]1O)\CO)[C@@H]2O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO
MDL: MFCD00136026
Molar Refractivity :79.20 ± 0.4 cm3 (est)
Parachor :658.6 ± 6.0 cm3 (est)
Index of Refraction :1.659 ± 0.03 (est)
Surface Tension :88.6 ± 5.0 dyne/cm (est)
Density :1.61 ± 0.1 g/cm3 (est)
Polarizability :31.39 ± 0.5 10-24cm3 (est)