celereoside

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IUPAC Name :4-hydroxy-2-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-7-one
InChI :InChI=1/C20H24O10/c1-20(2,30-19-18(26)17(25)16(24)12(7-21)29-19)13-5-9-11(27-13)6-10-8(15(9)23)3-4-14(22)28-10/h3-4,6,12-13,16-19,21,23-26H,5,7H2,1-2H3/t12-,13?,16-,17+,18-,19+/m1/s1
Std.InChI: InChI=1S/C20H24O10/c1-20(2,30-19-18(26)17(25)16(24)12(7-21)29-19)13-5-9-11(27-13)6-10-8(15(9)23)3-4-14(22)28-10/h3-4,6,12-13,16-19,21,23-26H,5,7H2,1-2H3/t12-,13?,16-,17+,18-,19+/m1/s1
InChIKey :JMWIRXQFQXREAB-BGARTESOBY
Std.InChIKey: JMWIRXQFQXREAB-BGARTESOSA-N
SMILES :CC(C)(C1CC2=C(O1)C=C3C(=C2O)C=CC(=O)O3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
Molar Refractivity :99.96 ± 0.4 cm3 (est)
Parachor :812.2 ± 6.0 cm3 (est)
Index of Refraction :1.673 ± 0.03 (est)
Surface Tension :86.3 ± 5.0 dyne/cm (est)
Density :1.59 ± 0.1 g/cm3 (est)
Polarizability :39.63 ± 0.5 10-24cm3 (est)