glucoethyl vanillin
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IUPAC Name :4-hydroxy-3-methoxybenzaldehyde - (2R,3R,4S,5S,6R)-2-ethoxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol (1:1)
InChI :InChI=1/C8H16O6.C8H8O3/c1-2-13-8-7(12)6(11)5(10)4(3-9)14-8;1-11-8-4-6(5-9)2-3-7(8)10/h4-12H,2-3H2,1H3;2-5,10H,1H3/t4-,5-,6+,7-,8-;/m1./s1
Std.InChI: InChI=1S/C8H16O6.C8H8O3/c1-2-13-8-7(12)6(11)5(10)4(3-9)14-8;1-11-8-4-6(5-9)2-3-7(8)10/h4-12H,2-3H2,1H3;2-5,10H,1H3/t4-,5-,6+,7-,8-;/m1./s1
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InChIKey :KAAJLEHEKNBACP-ALZNSTKSBQ
Std.InChIKey: KAAJLEHEKNBACP-ALZNSTKSSA-N
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SMILES :CCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.O=Cc1cc(OC)c(O)cc1