metabolite_name S00020736 S00020737 S00020738 S00020739 S00020740 S00020741 S00020742 S00020743 S00020744 S00020745 S00020746 S00020747 S00020748 S00020749 S00020750 S00020751 S00020752 S00020753 S00020754 S00020755 S00020756 S00020757 S00020758 S00020759 S00020760 S00020761 S00020762 S00020763 S00020764 S00020765 S00020766 S00020767 S00020768 S00020769 S00020770 S00020771 S00020772 S00020773 S00020774 S00020775 S00020776 S00020777 S00020778 S00020779 S00020780 PROPIONIC ACID 6.464577459 8.186548675 865.973082 762.5866014 9.21924858 8.091435898 9.096209947 7.177494332 8.62976562 7.930020307 8.037684327 9.279291638 9.107754444 508.9363451 4.247815082 3.352819231 506.0175218 4.613651116 3.78219196 509.4104275 3.955202118 3.981798863 506.1719376 519.7380292 3.924434396 6.535604366 1298.322134 10.70648717 1238.159767 1084.213405 10.6228802 8.433573929 804.6864451 8.034097829 7.227799035 983.9984707 7.946260917 8.610824814 945.8600452 773.9115386 1089.995257 8.68067105 8.764786 1024.360217 1076.107142 ISOVALERIC ACID 2.23928905 2.332110954 306.218358 2.182019378 297.8944187 291.6962687 234.6792088 313.4292049 1.962604061 252.8983435 297.6791436 2.128993915 2.363676309 1.656997931 1.678867288 199.7125957 199.6187689 199.9014236 1.494045453 199.6383933 1.55977631 1.558075932 199.6109956 199.6579429 199.8115322 294.8583606 284.946974 2.06502995 1.754399911 260.736771 229.271193 1.889247906 2.016601741 250.232505 1.853321815 2.247249476 2.080061307 2.293417279 2.252933625 2.052358259 2.006187387 2.36438755 2.37506413 327.3737854 305.2379728 ACETIC ACID 4845.317744 52.22180825 5886.581008 5028.194797 66.33116945 44.90706153 56.69810631 8611.405609 58.77797893 64.18007698 7074.121767 72.00147579 69.81158325 475.6293609 3.133809965 410.4705787 413.2767481 941.0393832 386.0283637 476.8187173 2.97534056 4.507316925 3.210197895 4.197670264 530.283225 3967.382518 12419.99722 115.4851447 72.00366195 77.04548733 98.46244644 82.67264577 6212.013806 10987.71126 55.08733211 10681.49115 5119.304575 8753.971829 74.45122998 48.77398077 77.10325829 73.38083865 55.00459301 68.73016067 8347.038567 BUTYRIC ACID 11.01193256 8.864800594 1918.17204 852.4147317 17.88029183 1722.631064 10.18225056 16.64449794 6.975056043 2024.21362 21.99706446 3711.506377 1133.746909 430.1333896 426.0515917 425.3810028 425.2097963 426.3680728 3.187164796 3.033888984 3.388199372 3.317797186 3.341143661 3.060924194 3.245360443 9.3262202 20.40405342 2843.72867 12.10233134 23.02790493 1415.914561 10.50323609 1011.643331 647.600912 24.57815874 1488.747391 1083.863773 1246.8688 12.55824326 8.032638844 13.2071123 9.602341278 15.12110735 20.74723578 2126.750749 OCTANOIC ACID .290231314 .135490652 42.52917905 20.94283536 .312668504 29.31095912 .109222167 .201195667 .142874569 39.82728091 .159321382 16.24662255 14.38038137 13.47125749 12.58619447 14.93065455 14.37960195 14.29695822 .101853376 .107416567 .111868717 .122443572 .123017248 .103136802 .119942372 .229558194 .173076799 18.64664636 .124918362 .165761067 17.78119651 .131036719 16.78166686 21.48048609 .197013837 35.16203175 16.70510455 23.45827026 .173648555 .14849288 .207993399 .212604576 .222285076 .331477612 39.72407387 VALERIC ACID 3.215197814 3.065624113 457.0316787 353.7566918 4.251847419 453.8537014 2.599955429 3.62857392 2.921296921 420.191513 3.846674215 443.2922596 356.0127928 267.0545732 266.414878 267.4318239 267.2547297 269.2180053 1.994046342 1.906620226 2.082519928 2.086500119 2.058210335 1.929345954 2.047428047 4.433217438 4.592751122 484.4016007 2.941399253 4.013286406 342.38492 2.998373381 315.3921992 406.8163687 3.080568513 521.0012786 334.9942392 447.7901766 3.720931804 2.956853422 3.368789626 3.786153523 3.485160733 4.353279299 465.1903149 HEPTANOIC ACID .229603859 .196196713 32.68481338 .22662531 32.22563317 29.03706674 19.51825962 29.81545649 .198018662 29.08552218 24.87245294 .174810666 .191722449 .158980052 .159535895 19.30775036 19.14102299 19.20103941 .142097334 19.10347726 .14878179 .149071987 19.0975835 19.18479008 19.30462841 29.03667758 27.93609135 .187640496 .162640244 24.78421173 21.4418681 .165714648 .191477571 27.96037905 .194865835 .267219049 .195266743 .247651315 .222612092 .201727938 .21431252 .254016528 .242470807 35.52504372 31.98088115 HEXANOIC ACID 219.88882 1.040232901 2.039360109 189.2803445 296.7956967 226.3976796 83.71936538 2.32496836 141.6305847 2.798992838 1.807225194 1.810972026 113.5482811 63.04646137 .523872684 .454255442 66.78140622 .650946982 .460551445 66.87906107 .489252745 .520315881 65.73867873 70.15851008 .55032727 1.495291606 301.2253677 1.758391685 183.297957 264.2095109 1.470798247 1.07211226 123.3991507 1.618047999 2.455320403 2.239703173 1.210277434 1.727768807 1.673944479 1.208194933 2.076110232 1.639134009 2.08777719 411.1880039 361.2330472 metabolite_name moverz_quant ri ri_type pubchem_id inchi_key kegg_id other_id other_id_type PROPIONIC ACID 1032 ISOVALERIC ACID 10430 ACETIC ACID 176 BUTYRIC ACID 264 OCTANOIC ACID 379 VALERIC ACID 7991 HEPTANOIC ACID 8094 HEXANOIC ACID 8892