"ChemAxon" . "115.95" . "0" . "2" . "42.97" . "1" . "1.53e-02 g/l" . "C[N+](C)(C)CCO[P@]([O-])(=O)O[P@@](O)(=O)OC[C@@H]1O[C@H]([C@H](O)[C@H]1O)N1C=CC(N)=NC1=O" . "[1-(2H-1,3-benzodioxol-5-yl)propan-2-yl](methyl)amine" . "InChI=1S/C6H12N2O3/c1-3(2)4(5(9)10)8-6(7)11/h3-4H,1-2H3,(H,9,10)(H3,7,8,11)/t4-/m1/s1" . "vanillate" . "52.32" . "[({[(2S,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]({[(2R,3R,4R)-5-[8-(dimethylamino)-7-methyl-2,4-dioxo-2H,3H,4H,10H-benzo[g]pteridin-10-yl]-2,3,4-trihydroxypentyl]oxy})phosphinic acid" . "OC(=O)C(=O)NC1=C(C=C(I)C=C1)C(O)=O" . "ALOGPS" . "0.16" . "42.26" .