metabolite_name fur-0-1P fur-0-2P fur-0-3P fur-0-4P fur-0-5P fur-0-6P fyuA-0-1P fyuA-0-2P fyuA-0-3P fyuA-0-4P fyuA-0-5P fyuA-0-6P ybtP-0-1P ybtP-0-2P ybtP-0-3P ybtP-0-4P ybtP-0-5P ybtP-0-6P ybtQ-0-1P ybtQ-0-2P ybtQ-0-3P ybtQ-0-4P ybtQ-0-5P ybtQ-0-6P L-Proline 986.789907 3216.09878 4028.54439 3677.30929 3269.49938 2563.7473 18329.6334 4132.50612 2821.82694 1952.54697 2395.56784 6191.11024 4182.60924 7211.2887 3982.68581 3841.28957 2666.90632 3721.40127 19069.6256 29679.8785 24668.8744 18464.284 16546.817 28479.8744 L-Glutamate 7526.1027 7498.23206 6636.29775 9334.26861 6083.34986 6224.92632 4769923.08 3594.15505 3193.45563 2879.58426 2596.76919 3640.7453 11277.6297 11891.3347 16301.8768 13295.2443 14914.1068 16171.2394 18370.5821 30178.0965 29215.1653 18421.8643 25950.4105 26076.1513 L-Aspartic acid 164.124147 191.422551 225.402983 253.895024 156.191251 151.086897 24838.4744 134.009375 108.521457 107.539062 123.677803 172.932173 263.659024 303.578058 286.521193 229.027772 263.401424 248.907545 179.570251 260.193418 278.042525 197.159045 213.099744 272.499526 Deoxycytidine 295.225627 136.631887 243.132093 275.765958 204.796461 192.758744 197.332525 136.903638 107.691271 107.82168 92.3542544 125.119394 15.2698091 34.249451 19.9925231 14.7894682 13.6995848 24.3218509 187.273049 112.605741 139.799984 175.882943 261.930844 154.171312 L-Citrulline 88.4233014 88.7245745 90.3825403 65.9646174 87.8613747 88.7408443 161.991533 140.453983 151.472324 106.385096 105.1525 169.410165 142.761777 175.846944 150.91422 167.76002 161.522968 162.54848 167.189166 214.140154 246.386832 141.054067 223.298112 302.466006 Cytidine 527.784321 555.675564 939.686213 653.239145 873.964991 781.124551 428.974606 341.059406 458.847517 453.777827 368.268993 511.976216 114.984441 237.130577 199.080297 165.04016 167.539961 174.194419 186.901017 198.723451 200.268576 144.158759 178.900449 185.358683 Histamine 3864.51011 3496.06222 4901.3858 2810.69608 3832.43616 3916.13417 2375.7933 1934.94726 2674.76119 1696.36893 1302.39202 2975.04108 1454.12579 2119.99269 1388.54084 1558.64915 1404.6812 1358.89233 3188.71908 5081.43049 4150.83134 3233.18006 5164.04832 6922.63658 L-Arginine 229.302681 2456.63053 3962.11253 569.464316 6228.20053 1277.57321 7083.65897 316.736842 1733.07657 1491.59143 1595.6016 1890.54122 4201.48066 6610.60363 1275.36642 2586.35737 2914.21529 2479.92051 1910.86375 3150.56285 3211.11407 1848.80529 2368.46815 4064.23768 L-Lysine 4811.26587 3521.93985 3430.66755 3018.52635 3103.93657 2325.05325 10307.7776 8620.99596 6801.58465 6923.94055 6620.7342 8186.41831 13067.8305 12714.4747 6302.73657 7386.64873 6842.69484 6570.00543 8320.666 5811.96575 8257.50706 7275.23583 9682.95682 9013.644 Thymine 30674.244 18636.7838 18795.524 28281.5032 17433.574 27396.6158 17890.6273 10377.4891 18758.1211 22766.369 20245.6705 25776.9367 18778.1543 34215.875 32392.2441 33870.7831 23757.6055 31568.3548 14264.3484 20170.1725 12068.3172 12428.0649 14486.5873 27740.7073 5-aminosalicylic acid 11639.2205 4660.82707 6200.60246 11982.1976 6370.08613 6077.03637 3977.47619 5113.78554 3983.67186 8558.65351 7715.00948 4320.15745 10451.0472 9856.56993 11658.9732 12782.4671 13577.9836 16154.2958 11314.1014 8235.74654 9214.29719 9799.30503 10446.448 11406.4405 Adenosine 5'-monophosphate 12156.6092 73911.0684 107335.977 106674.301 140930.379 110248.427 59379.7668 50389.9073 55512.1303 52942.5323 68508.4783 142113.541 207981.665 279580.38 238193.637 194293.576 238358.882 269098.686 221427.861 240573.774 232050.337 244656.232 210098.54 242684.009 Cytosine 3911.1325 3496.06222 5234.22024 2678.6437 3832.43616 3916.13417 3552.27187 2484.97416 2674.76119 1682.74908 1625.01142 2975.04108 1454.12579 2119.99269 1981.42275 1558.64915 1451.80714 1629.68995 2464.75467 3695.64279 3281.03862 3078.69673 3666.2703 4222.93396 Tryptophan 357505.135 233797.713 210485.589 224664.664 259168.262 391194.876 354602.368 246181.519 349933.453 467050.69 297886.853 343728.965 302846.062 325622.971 389605.605 299335.021 318201.328 331713.104 290811.03 301569.31 304623.81 382698.154 402823.595 346217.616 Adenine 218484.973 119618.775 147390.954 165672.936 160387.905 136168.854 196109.696 116331.834 121834.714 138370.97 111136.524 134878.086 20995.094 52740.516 71180.0215 41298.6867 32444.0507 39315.787 32186.738 28649.4561 31485.4668 31201.4297 40490.5648 41069.7763 L-Ornithine 2769.60171 1612.86279 1663.15534 2051.09114 1498.66571 1451.92083 3112.02878 2024.51771 2014.39996 3617.77284 3746.1313 3645.12869 2322.95023 3317.62779 4163.06231 3359.90998 2456.57507 3257.63051 3055.38317 2232.89193 2749.25971 3249.64668 3478.36197 2962.56842 metabolite_name Molecular weight RT (min) m/z L-Proline 115.13 1 116 L-Glutamate 147.13 0.9 148 L-Aspartic acid 133.1 1.05 134.11 Deoxycytidine 227.22 1.5 228 L-Citrulline 175.19 0.94 176.2 Cytidine 243.22 1.3 244 Histamine 111.07 1 112 L-Arginine 174.2 0.96 175.21 L-Lysine 146.19 0.8 147.2 Thymine 126.11 2.92 127.12 5-aminosalicylic acid 153.14 1.54 154.15 Adenosine 5'-monophosphate 347.22 1.51 348.07 Cytosine 111.1 1.5 112 Adenine 135.13 1.5 136 L-Ornithine 132.19 0.78 133.1 Tryptophan 204.23 5.71 205.1