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Found 50803 results

Search term: DATA_SOURCE in ('SMPDB Small Molecule Pathway Database')
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
913


InChI=1/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)
C6H5NO2123.1094238239878871123
3268


InChI=1/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
C4H3FN2O2130.07722331636825396233
730


InChI=1/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)
C2H5NO275.066622425723426557618
780


InChI=1/C10H9NO2/c12-10(13)5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H,5H2,(H,12,13)
C10H9NO2175.18422312041877166
185


InChI=1/C5H5N5/c6-4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H3,6,7,8,9,10)
C5H5N5135.126722312474317513760
1906


InChI=1/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)
C8H9NO2151.1626222953314533517
116


InChI=1/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)
C4H9NO2103.11982202467844404410
953


InChI=1/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)
C7H7NO2137.13621717411964931
1141


InChI=1/C4H4N2O2/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8)
C4H4N2O2112.0868216441478742034
1037


InChI=1/C7H5NO4/c9-6(10)4-2-1-3-8-5(4)7(11)12/h1-3H,(H,9,10)(H,11,12)
C7H5NO4167.1189214140912110
238


InChI=1/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)
C7H6O2122.1213214162454699688
3544


0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)
C13H18O2206.280821457327925402
331


InChI=1/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)
C7H6O3138.1207213786869133409
1091


InChI=1/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)
C2H7NO3S125.146921262929384486
1118


InChI=1/C10H12N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6,11H2
C10H12N2160.215721116422436810
872

InChI=1/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)
C13H16N2O2232.2783210100051521395
132


InChI=1/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)
C7H6O3138.120720999310181124
234


InChI=1/C3H7NO2/c4-2-1-3(5)6/h1-2,4H2,(H,5,6)
C3H7NO289.093220816342346200
548


InChI=1/C6H13NO2/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H,8,9)
C6H13NO2131.172920821412203261
1078


InChI=1/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)
C4H6O4118.088208154617102979
12345

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