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Displaying metabolites 1 - 25 of 114100 in total
HMDB ID
CAS Number
Name StructureFormula
Average Mass
Monoisotopic Mass
Biofluid Location
BosutinibThumbC26H29Cl2N5O3

530.446
529.164745233
    {[8-(2,4-dihydroxyphenyl)-7-(3,7-dimethylocta-2,6-dien-1-yl)-5-hydroxy-2-methyl-6-oxo-2H,6H-pyrano[3,2-g]chromen-2-yl]methoxy}sulfonic acidThumbC30H32O10S

    584.64
    584.171618404
      {[8-(2,4-dihydroxyphenyl)-5-hydroxy-2-methyl-6-oxo-2H,6H-pyrano[3,2-g]chromen-2-yl]methoxy}sulfonic acidThumbC20H16O10S

      448.4
      448.046417889
        {[7-hydroxy-6-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methoxy-2-methyl-3,4-dihydro-2H-1-benzopyran-2-yl]methoxy}sulfonic acidThumbC21H20O10S

        464.44
        464.077718018
          {[6-({7-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-2-(3,4-dihydroxyphenyl)-5-oxo-5H-chromen-3-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methyl}[3-(3,4-dihydroxyphenyl)-1-hydroxyprop-2-en-1-ylidene]oxidaniumThumbC36H35O20

          787.655
          787.171619947
            {[6-({5-[(6-{[(2-carboxyacetyl)oxy]methyl}-3,4,5-trihydroxyoxan-2-yl)oxy]-7-hydroxy-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-2H-chromen-3-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methyl}[1-hydroxy-3-(4-hydroxyphenyl)prop-2-en-1-ylidene]oxidaniumThumbC39H39O20

            827.72
            827.202920076
              {[6-({5-[(6-{[(2-carboxyacetyl)oxy]methyl}-3,4,5-trihydroxyoxan-2-yl)oxy]-7-hydroxy-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-2H-chromen-3-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methyl}[1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-ylidene]oxidaniumThumbC40H41O21

              857.746
              857.21348476
                {[6-({3-[3,5-dimethoxy-4-(sulfooxy)phenyl]-11-hydroxy-7-(4-oxocyclohexa-2,5-dien-1-ylidene)-2,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),3,5,9(13),10-pentaen-4-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methyl}oxidaniumThumbC31H29O16S

                689.62
                689.117082448
                  {[6-(5,7-dihydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl)-7-hydroxy-2-(4-methylpent-3-en-1-yl)-2H-chromen-2-yl]methoxy}sulfonic acidThumbC25H26O10S

                  518.53
                  518.124668211
                    {[6-(5,7-dihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)-3,4,5-trihydroxyoxan-2-yl]methoxy}sulfonic acidThumbC21H20O12S

                    496.44
                    496.067547258
                      {[6-(5,7-dihydroxy-4-oxo-2-phenyl-4H-chromen-6-yl)-3,4,5-trihydroxyoxan-2-yl]methoxy}sulfonic acidThumbC21H20O12S

                      496.44
                      496.067547258
                        {[6-(5,7-dihydroxy-4-oxo-2-phenyl-3,4-dihydro-2H-1-benzopyran-8-yl)-3,4,5-trihydroxyoxan-2-yl]methoxy}sulfonic acidThumbC21H22O12S

                        498.46
                        498.083197322
                          {[6-(5,6-dihydroxy-7-methoxy-4-oxo-2-phenyl-4H-chromen-8-yl)-3,4,5-trihydroxyoxan-2-yl]methoxy}sulfonic acidThumbC22H22O13S

                          526.47
                          526.078111942
                            {[5-hydroxy-8-methyl-6-(2-methylpropanoyl)-2-oxo-4-phenyl-2H,8H-pyrano[2,3-f]chromen-8-yl]methoxy}sulfonic acidThumbC24H22O9S

                            486.49
                            486.098453462
                              {[5-({6-[(acetyloxy)methyl]-4,5-dihydroxy-2-{[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxan-3-yl}oxy)-3,4-dihydroxyoxolan-3-yl]methoxy}sulfonic acidThumbC28H30O18S

                              686.59
                              686.1152853
                                {[5-({4,5-dihydroxy-2-[4-(7-hydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl)phenoxy]-6-(hydroxymethyl)oxan-3-yl}oxy)-3,4-dihydroxyoxolan-3-yl]methoxy}sulfonic acidThumbC26H30O16S

                                630.57
                                630.12545606
                                  {[5-(4-methoxyphenyl)-3-oxopentyl]oxy}sulfonic acidThumbC12H16O6S

                                  288.31
                                  288.066759409
                                    {[5-(4-methoxyphenyl)-3-oxopentan-2-yl]oxy}sulfonic acidThumbC12H16O6S

                                    288.31
                                    288.066759409
                                      {[5-(4-methoxyphenyl)-2-methyl-3-oxopentyl]oxy}sulfonic acidThumbC13H18O6S

                                      302.34
                                      302.082409474
                                        {[5-(4-methoxyphenyl)-2-methyl-3-oxopent-4-en-1-yl]oxy}sulfonic acidThumbC13H16O6S

                                        300.33
                                        300.066759409
                                          {[4-hydroxy-1-(7-methoxy-2-oxo-2H-chromen-8-yl)-3-methylidenebutan-2-yl]oxy}sulfonic acidThumbC15H16O8S

                                          356.35
                                          356.056588649
                                            {[4-(7-methoxy-2-oxo-2H-chromen-6-yl)butan-2-yl]oxy}sulfonic acidThumbC14H16O7S

                                            328.34
                                            328.061674029
                                              {[4-(7-methoxy-2-oxo-2H-chromen-6-yl)but-3-en-2-yl]oxy}sulfonic acidThumbC14H14O7S

                                              326.32
                                              326.046023965
                                                {[4-(7-methoxy-2-oxo-2H-chromen-6-yl)-2-oxobut-3-en-1-yl]oxy}sulfonic acidThumbC14H12O8S

                                                340.3
                                                340.02528852
                                                  {[4-(7-hydroxy-8-methoxy-2-oxo-2H-chromen-6-yl)-2-methylbut-2-en-1-yl]oxy}sulfonic acidThumbC15H16O8S

                                                  356.35
                                                  356.056588649
                                                    Displaying metabolites 1 - 25 of 114100 in total