1-caffeoyl-beta-D-glucose

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IUPAC Name :[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
InChI :InChI=1/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1
Std.InChI: InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1
InChIKey :WQSDYZZEIBAPIN-VBQORRLJBE
Std.InChIKey: WQSDYZZEIBAPIN-VBQORRLJSA-N
SMILES :C1=CC(=C(C=C1/C=C/C(=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O
Molar Refractivity :78.98 ± 0.4 cm3 (est)
Parachor :656.5 ± 6.0 cm3 (est)
Index of Refraction :1.682 ± 0.03 (est)
Surface Tension :98.5 ± 5.0 dyne/cm (est)
Density :1.64 ± 0.1 g/cm3 (est)
Polarizability :31.31 ± 0.5 10-24cm3 (est)