metabolite_name Raw_SmpID_1 Raw_SmpID_2 Raw_SmpID_3 Raw_SmpID_11 Raw_SmpID_10 Raw_SmpID_6 Raw_SmpID_7 Raw_SmpID_8 Raw_SmpID_9 Raw_SmpID_5 Raw_SmpID_4 Raw_SmpID_12 Raw_SmpID_13 Raw_SmpID_14 Raw_SmpID_15 Raw_SmpID_16 Raw_SmpID_17 Raw_SmpID_18 Raw_SmpID_19 Raw_SmpID_20 Raw_SmpID_21 Raw_SmpID_22 Raw_SmpID_23 Raw_SmpID_24 Raw_SmpID_25 Raw_SmpID_26 Raw_SmpID_27 Raw_SmpID_28 Raw_SmpID_29 Raw_SmpID_30 Raw_SmpID_31 Raw_SmpID_32 Raw_SmpID_33 Raw_SmpID_34 Raw_SmpID_35 Raw_SmpID_36 Raw_SmpID_37 Raw_SmpID_38 Raw_SmpID_39 Raw_SmpID_40 Raw_SmpID_41 Raw_SmpID_42 Raw_SmpID_43 Raw_SmpID_44 Raw_SmpID_45 Raw_SmpID_46 Raw_SmpID_47 Raw_SmpID_48 Raw_SmpID_49 Raw_SmpID_50 Raw_SmpID_51 Raw_SmpID_52 Raw_SmpID_53 Raw_SmpID_54 Raw_SmpID_55 Raw_SmpID_56 Raw_SmpID_57 Raw_SmpID_58 Raw_SmpID_59 Raw_SmpID_60 Raw_SmpID_61 Raw_SmpID_62 Raw_SmpID_63 Raw_SmpID_64 2-hydroxy-2-methylbutyrate 1.333612128 2.044154431 0.736040212 1.390957304 0.986406413 0.713635279 1.330531327 1.215673142 2.633720567 0.715142614 1.750071255 1.373376986 0.886888239 0.784016719 0.802982893 1.595324505 1.68905899 0.722576623 1.032286486 0.596037367 1.165842065 0.714389523 0.805919318 1.315691488 1.679957607 0.729072504 1.181434436 0.620944217 1.023094554 0.693753962 2.011604079 0.902792617 0.615718837 0.611990643 1.196803277 0.949307743 1.158999061 0.75375216 0.612309652 1.186833767 0.965279143 1.059304497 0.655630438 0.729671617 0.757266102 1.17895717 0.641700354 1.040993637 0.867765524 0.630007222 0.852351175 0.590453838 1.184697897 0.955619589 1.261464404 0.791972042 1.129756211 0.834675668 1.21354778 0.556845477 1.327536433 0.801407637 0.418211523 0.964030945 2-hydroxyglutarate 0.595655067 2.65041779 0.872876138 1.439699976 0.854259979 1.197434997 0.962289121 0.969984422 1.896917887 0.601380884 0.993966522 1.296122486 1.483137829 0.793893237 1.009633269 1.370476393 0.840503014 1.049482261 1.346883266 0.873375466 0.487053729 1.842050811 0.393773943 1.573222118 0.941808446 0.713914764 2.039642927 0.508841251 1.50330408 0.918677061 1.418568657 0.74753328 0.901692959 0.918489958 1.221377488 1.927521631 0.980076203 0.775180165 0.631982423 0.87026518 1.349751988 1.229947879 0.862910511 0.843052132 0.955173522 1.181009099 0.953134873 1.014737307 1.191625472 0.811939749 0.626112132 0.710094026 0.815229473 0.62980302 1.278178454 1.19039184 0.945896374 1.233577574 0.876000571 0.758369239 1.143538071 1.084112117 0.941577096 1.120828316 3-methyl-2-oxobutyrate 2.01086087 1.70229443 1.033649443 1.552400419 1.178215194 0.650878847 1.299971659 1.066365947 1.13082036 0.995967901 1.008842131 0.901877384 0.858443676 1.129543786 0.867343418 1.018336381 0.956421517 0.944043931 0.542089486 1.572492343 1.147587914 1.071504657 1.158988724 0.837431018 0.739592377 0.880123988 1.117879733 1.251433199 0.640881568 0.724986068 0.654011965 0.949879225 1.392855454 1.081796651 0.705015246 1.260181834 1.235843282 0.87269973 1.310963349 1.007184107 0.989095291 0.597586485 0.87568118 0.885137753 1.349292132 1.157584694 1.868272687 0.955653594 0.745202721 1.18338164 2.240667808 1.556510088 0.799780589 0.767847317 0.773781633 2.127809093 0.731396466 1.243382085 1.77982676 1.228356506 1.390024639 1.050184867 1.603755641 1.622462662 3-phosphoglycerate 0.905368932 0.896696216 0.46518563 0.372031683 1.08839882 0.37693026 0.864108232 1.788265039 1.185913254 0.416568414 0.338531359 1.261033918 0.390155757 1.245457954 0.425037153 1.619705449 1.641072381 1.154173982 0.526081734 0.756311548 0.754993761 0.414004074 0.730856191 1.073704545 0.368611424 0.331307043 0.881991679 0.648902474 1.286924478 1.65079258 1.664200288 0.553118988 0.375009368 0.479849708 0.453886135 0.642545628 0.865245945 2.335707563 1.548160075 1.39272039 0.834901921 0.744248546 0.628313371 0.732018184 3.487278116 1.558306223 0.464381051 0.491063218 1.11615792 0.986077286 1.010664675 0.375889828 0.877756875 1.188799813 0.600078499 1.109338666 2.0599214 2.725333897 1.458641818 0.3031187 2.121713813 1.592356773 0.564258601 0.66652414 Acetyl-coA 0.671214154 1.349904357 0.739140037 0.675023319 1.626850864 0.713076503 1.46623595 2.01046774 0.180562167 1.948107677 0.413794715 0.624095856 1.361774035 0.677321005 1.059150199 1.43675389 1.796700108 1.146015671 1.639024153 2.112887974 1.360106399 1.556364446 1.568374727 0.499769622 0.60825325 1.173340352 0.380062704 0.493835177 2.050254509 2.109299238 1.503612716 0.47188607 0.401353462 0.698595716 0.627601892 0.273898645 0.272680296 0.599110036 1.050524499 1.53491025 1.766497929 0.611173001 0.331681802 0.396072422 2.23610101 0.405954429 0.351484408 0.360749707 0.639865331 0.395422864 1.027442332 0.124536824 0.49300921 0.459741226 0.825029686 0.965765531 1.020883999 1.055105302 0.625524134 0.630469776 1.109804032 1.051004009 0.523283416 0.40264939 Adenosine diphosphate 1.277216996 0.861157174 1.024316894 0.806899784 2.041331729 0.87253128 1.199024169 3.572320866 0.799166518 1.281912651 0.573893635 0.601780573 1.034147473 1.814195454 0.459847787 1.694567754 0.802835133 1.891994663 1.632661091 1.833657043 1.427620201 0.685275864 2.121181966 1.248584871 0.801399988 0.79386106 0.813406431 0.726722807 2.529514169 1.994548045 1.473858881 0.218126193 0.477904248 0.669196465 0.461233935 1.236503715 1.245511828 1.956688301 1.126876005 1.173719047 1.836748312 1.004400713 0.512095234 0.483892892 2.318517593 0.711485655 0.965702171 0.45460174 1.041528873 0.72679687 0.633134157 0.406403685 0.629969908 0.956960375 0.704716082 2.378129456 1.803394912 1.357960195 0.750266967 0.579116408 0.992977393 1.575619095 0.610433104 0.776189688 Adenosine triphosphate 0.553187917 2.279848267 0.859160279 1.238692655 1.889541338 0.641012528 0.562242518 1.929430504 0.297398468 0.749288936 0.415526198 2.056506097 2.374976386 1.146068215 0.720509669 1.829342585 2.197254062 3.10525176 5.908846364 3.281842631 1.48867452 1.523363081 2.956080951 1.602219571 0.394041345 2.964694374 0.71912473 0.372793125 2.443769042 1.248792183 1.728643081 0.136139324 0.433889898 0.327779809 0.185163701 0.959380723 1.279868718 1.221237823 0.853800902 0.986760963 0.985250591 1.597421185 0.563871192 0.26515223 0.995385062 1.099086508 0.314183437 0.617696195 1.351444086 0.723406321 0.747516433 0.314800819 0.55183636 0.861925568 0.895252277 0.982019861 1.86561044 1.145026097 1.639367381 0.219327345 1.282699248 1.746284659 0.779527526 0.513415911 Arginosuccinate 0.782125372 1.17302444 1.152774745 1.086989527 1.23385841 1.269317608 0.920853136 1.147055943 1.082739148 1.487965041 1.153942841 0.773870315 0.879712119 1.0454292 1.267239738 1.156604216 1.090129071 0.938253108 0.980237319 1.23035399 0.918996891 0.72570503 1.208050002 0.788206428 1.149123005 0.913366114 0.913692495 0.846797959 0.936325262 0.987896658 0.972803946 0.688541911 0.854808723 2.197598788 1.185464686 0.919152523 0.837576972 1.065424302 1.093934567 0.685929693 0.722397014 0.847777638 0.803607838 0.836639198 0.663409171 0.777159919 0.946930201 1.266684744 1.29764941 1.131888233 0.863501248 1.195053166 0.998342374 1.048934697 0.975940757 0.777832725 0.88871314 0.769097618 0.797997389 1.337545908 0.659331496 0.705079778 0.965909475 0.889395532 Biotin 0.366513732 0.243439814 0.318635755 0.579713383 1.033164316 1.58866177 0.208621363 0.645378388 0.331100796 0.693867974 0.577387824 0.085746076 0.270805451 0.844302839 0.629779853 0.319378882 0.170162061 0.205818816 0.093944332 0.074458113 0.904807203 0.097769826 0.709192934 0.250048873 0.971115466 0.253087313 1.827456906 0.222641765 1.362378091 0.661072489 1.712758539 0.983322693 1.839916712 1.711634053 1.504808515 2.125995756 2.694571357 1.237334807 1.382883755 0.894996538 1.649479027 1.032478858 1.801336787 1.110728238 0.966176833 0.897084464 1.29016832 1.728163337 1.452638958 0.766258043 0.93559406 1.299889755 1.434147093 1.518348269 1.593049815 0.168166962 1.356251017 1.08980139 1.115998153 0.872628079 0.735312386 0.769842701 1.017879336 1.21652989 Cholesterol sulfate 0.727419135 0.653163806 0.596254575 0.515911155 0.840079155 0.672366601 1.33368044 1.447756495 0.954117522 0.906926862 0.56162423 0.431227014 0.548714783 0.512244802 0.619720213 0.638547961 1.311909714 0.894842207 0.700921353 1.249930103 0.53373552 1.180220509 0.716806286 0.747961046 0.69125906 0.683651138 0.547293921 0.545657674 1.207609518 1.588769001 1.97940742 0.437663488 2.517977177 0.813760926 0.682011905 0.359849963 0.884210388 0.835877985 1.338442247 1.186143594 1.397583168 0.71389553 0.219449662 0.577476579 1.133661756 0.553932404 0.538127661 0.260856107 1.062725339 0.757137171 0.453652217 0.669567663 0.862443222 0.386706185 0.96871866 0.827155738 0.891629682 0.910859983 0.89076854 0.630074367 0.637483522 1.159855906 0.920134625 0.361479605 Citraconate 0.821254394 1.484482116 0.633207849 0.853500367 2.460019787 1.16538843 0.99849867 0.810014195 0.973443894 2.11983902 0.741064148 1.275659273 0.8524345 0.572201027 0.735579252 1.270400396 1.48215424 0.497102633 0.976206309 0.719265151 1.370161741 1.778369484 5.889627979 1.253678797 1.035936666 0.468246892 1.189759467 0.476138969 0.759400975 1.253834814 2.03344779 0.454068633 0.474711846 0.550292609 0.56598817 1.363400423 1.380842527 0.664378644 0.576718897 0.775152427 0.72828846 0.6469097 0.793494627 0.497772986 0.888909718 1.278355904 0.557180576 0.538826017 0.805564571 0.518101181 0.61060876 0.543716013 0.654384963 1.233859447 1.240491623 0.787276385 0.951949166 1.611841846 0.98683705 0.562994344 0.758842191 1.746693017 0.417572264 0.766391481 Deoxycholate 0.556748323 1.797191752 1.152946121 0.54503488 0.883072973 1.004339821 1.0174598 1.300717841 0.262388411 0.488962759 0.520219743 0.943025402 1.37813933 0.586808965 1.336448776 1.239474388 1.273610419 2.242471309 2.033125039 2.468584413 0.609560298 1.222953553 0.895505129 1.154678336 0.99625078 0.753019459 0.578015732 1.010171673 2.087811412 1.863610497 1.683236627 1.440204232 0.315780682 0.431452535 0.325949241 0.306438685 0.463110827 1.408165413 1.27752489 1.188028207 1.372989389 1.034208868 0.586944576 0.337751423 1.523205627 1.116035012 0.328536963 0.484940632 0.876015257 1.502522143 1.377219115 0.465142684 0.719709299 1.225606095 0.628583215 1.590339906 0.963615949 1.351176375 0.796677379 0.455258149 1.404596437 1.065497749 0.847778386 0.608286093 Erythrose 4-phosphate 1.330571519 0.90036005 3.14205554 2.848970283 4.131670792 3.311312888 2.289869965 1.557590635 0.111396575 1.620577458 2.400720987 0.681465314 0.403989096 1.554778442 2.178692788 0.734674531 0.852670522 1.246287749 1.125152742 0.634767713 0.83675549 0.188343168 2.714889254 0.433074988 2.742742145 1.497828657 1.06440509 0.499638298 2.458824945 0.70004615 4.573618608 0.187493635 0.975926357 0.546679987 0.508958946 0.501903476 0.271487766 1.242320115 0.812384664 0.522710967 0.696889259 0.793315992 0.173885235 0.401771503 0.19866083 0.365017037 1.364696922 1.414407887 0.969427163 0.740605307 0.411957834 1.592215975 0.424580804 0.842881696 0.991895328 0.953514728 0.248596267 0.761305745 0.310713822 1.33424865 0.34415929 0.473730866 0.497129734 0.546177509 Fructose 1,6-bisphosphate 0.895869938 2.423891929 0.935821161 0.640805261 4.26563243 0.449412607 2.039212157 12.35248238 0.306324281 0.507468377 0.397718064 1.033662178 1.524113478 2.693077773 0.733293692 3.836965646 1.709997329 9.797900329 2.497671878 1.264858835 1.040891637 1.027524795 0.909993983 3.074209905 0.81406951 3.053654515 0.369402851 0.602968036 4.168857212 3.240220968 2.210592282 0.269114242 0.283137512 0.43683875 0.551913357 0.827360918 0.618857609 1.73431263 1.383040055 0.921301487 2.447045719 1.852578031 0.564177193 0.440142817 2.72554566 1.2532635 0.576361424 1.241061108 2.943121634 0.578608067 1.00967996 0.378004451 0.549117596 1.294018283 0.882091121 5.378082282 3.075286313 1.834701012 0.89727707 0.403531919 1.50018662 1.13977177 1.055634368 1.023382906 Fructose 6-phosphate 2.354940472 1.25106742 2.173351953 2.94676787 2.15328905 2.717980438 1.909872515 1.682549223 0.288563908 1.437154339 1.983935199 1.33873442 0.362776203 1.869207277 2.255252761 0.930178188 0.985793902 0.845736833 0.935312453 0.346735144 2.026013194 0.119895736 2.38173537 0.309578516 2.719227153 1.388020738 1.103175281 0.204268979 1.339055345 0.532765963 0.912795796 0.159900785 0.498890321 0.403918578 0.712385069 0.568698078 0.551857676 1.163132158 0.921637018 0.760273474 0.404330895 0.475727806 0.164099077 0.215939249 0.130335427 0.230592691 0.723461725 0.543302633 1.301667604 0.560256705 0.328762864 1.474765975 0.504978278 0.625764018 1.261893956 0.565280747 0.280807885 0.783626624 0.363649723 0.943612308 0.332831324 0.307164825 0.246299415 0.555280935 Glucose 1.014890541 1.130741742 1.523678883 1.133608715 2.017217789 1.502038183 0.699819266 0.939459637 0.737357048 1.214665379 1.83487755 0.690736219 0.77674975 1.295543756 1.240897405 1.849921624 0.881564536 0.76405797 0.872789591 1.262465042 1.099051276 0.651517409 1.538521008 0.395194381 1.013189243 1.192322629 0.703787739 0.471246499 1.014497351 0.590425627 1.003206058 0.811088522 1.070112581 0.885304392 0.796891677 0.691928779 1.040520099 1.133306378 0.960229949 0.7718948 0.839409272 0.781485608 0.576632371 0.841691614 0.631928083 0.558659799 0.911031002 0.828520578 1.133577298 1.270032236 0.904006006 1.278485751 0.837390256 0.958753606 0.919188516 0.577456111 0.841953418 0.599111557 0.655784981 1.928079087 0.648478633 0.541524538 1.068312132 0.724188544 Glucose 6-phosphate 1.285868365 0.826349952 2.931592569 3.191244312 2.918246669 4.660269208 2.174106492 1.69185191 0.168843953 2.303632762 2.778726836 0.706412784 0.470738904 2.497167447 2.722272116 1.026936471 0.589901783 1.120827808 1.229252515 0.585718848 1.163927084 0.129384111 2.361743955 0.3509049 2.834201397 1.766486866 0.918705781 0.238280859 1.371184882 1.372986026 1.059101782 0.129612972 0.541661498 0.380555218 0.461386691 0.685566874 0.510278563 0.829704573 0.945303459 0.601869148 0.509278001 0.48506394 0.179067107 0.186599671 0.169422069 0.400496676 1.005097007 0.897550432 1.217254891 0.445497588 0.39675162 1.897056131 0.46491036 0.713301019 0.843661039 0.678885602 0.238689513 1.034830084 0.37910867 1.4109519 0.285293506 0.498967291 0.238223397 0.54827268 Glutathione 1.23885385 1.30505325 0.929953421 1.076997844 0.94680081 0.624504415 0.608642945 1.5117992 0.680111514 0.547955267 0.357274753 1.775856102 0.839074224 0.753826147 0.934917744 1.048003723 1.109300648 0.859528662 1.52836051 0.546672748 0.369156794 1.273137568 0.901172412 0.908455248 0.475890517 0.603446898 0.697740818 0.732852768 1.035277015 0.753024842 1.155243491 0.797169123 0.64693073 0.610445366 1.398274309 0.757901625 0.900666463 1.971798219 0.953033353 0.947191772 0.669719655 1.020042027 0.799429126 0.635377316 0.983627663 0.906315953 0.450314448 0.466858235 1.065554281 0.918197538 0.266653196 0.783161916 0.685824341 0.87218527 1.262629776 0.510744765 1.452528684 1.294831574 1.220723117 0.31478496 1.763116815 0.839255225 0.942784181 0.994943404 Glyceraldehyde 1.67601241 0.96787896 1.143806466 1.020427819 2.061030293 0.526175606 0.697137502 0.788925228 0.362411612 2.021428062 1.273776071 1.719463166 1.024880425 0.773618281 1.517073813 0.776348678 0.77632494 1.084269072 2.889828167 0.79271488 0.74184123 0.908487724 3.605529766 0.992292892 0.609034597 2.274508626 0.617130652 0.713332429 0.5492898 0.752697806 0.908025974 0.522968368 1.092951808 1.13348574 0.925679552 1.045722842 1.41283726 1.160517527 0.944396585 0.71270761 0.861585911 1.002331029 0.753673643 0.533567146 0.93221076 1.452170012 1.195728104 1.079696965 0.921965736 0.441119788 0.951257421 0.930683942 0.796941585 1.023755704 0.710493379 1.725272821 0.983273468 1.378128336 1.974587498 1.269997947 0.552152581 1.292604312 1.067277871 0.421685511 Glyceraldehyde 3-phosphate 1.053180897 0.920475789 0.588959592 0.71777359 1.16604796 1.01052684 1.465869403 1.369197787 1.424029888 0.628903634 0.736423829 0.873715535 0.427938902 1.825403251 0.526468834 1.518642502 1.870641744 0.95382442 0.591298894 0.418381158 0.870011569 0.536925044 0.871279264 0.84037854 0.869905785 0.591554189 0.985103228 0.449718261 0.912583 1.753889613 1.627802347 0.344869281 1.162026836 0.832765719 0.766211091 0.641022932 0.750134503 1.715102826 1.142907745 1.103664661 0.625216559 0.541765361 0.378862907 0.452723448 0.775869351 0.780142268 1.08663083 1.163663601 0.973603778 0.707083401 2.247348129 0.717170955 0.677839729 1.453130352 0.944186868 0.77643691 0.789560045 1.899686234 0.889311184 1.276318526 0.618114685 1.086948534 0.47503438 0.776361899 Guanidoacetate 0.694790287 0.624834876 0.944857045 0.818775242 0.856368211 1.368452341 0.800965907 0.829576219 0.89180268 0.753815188 0.618899068 0.36921987 0.586335545 0.739302606 0.719131938 0.451860937 0.512078564 1.275263566 0.450538811 0.330656751 0.565585088 0.617701046 0.573972275 0.599969366 0.440990917 0.403875406 0.791606343 1.58819951 0.443069753 1.317730804 0.712776071 1.016094386 1.270797925 1.143017268 1.508983462 1.095522915 0.747882179 1.306143257 0.845301705 2.0269375 0.793057893 0.420343062 0.68844736 1.005927861 0.966546477 0.832295481 1.407912905 1.080756654 1.005538098 2.08569209 1.152159129 1.584108719 0.922272082 1.099511901 0.886572126 1.203283241 1.007884302 1.453284111 1.333224319 1.196277257 1.067080315 0.597476583 2.020333152 0.877534728 Homocysteate 1.039977003 0.317917857 1.038350697 0.68202801 0.330363295 0.473991553 0.339458307 0.70716491 0.799494977 0.783900758 0.678420865 0.438862078 1.398436753 0.862638385 0.359871118 1.561572023 0.171153636 0.808289301 0.436078175 0.597005277 0.417179461 1.352958309 0.323419469 0.921203434 0.309769227 0.198393093 0.670088712 1.930707474 0.29438361 0.749320401 0.644221982 0.928999154 1.710335322 2.184880836 0.896408849 0.711807671 1.247651707 0.250491281 1.064958647 0.369779249 1.62506142 0.34818926 0.807740105 1.29017171 0.833296868 2.865288504 0.683472617 0.846137951 0.893806197 0.418681893 0.523784618 0.788017502 0.932307106 0.562135893 1.159151109 0.595032672 1.363911748 0.629672483 2.152664327 0.404910655 1.73369528 1.378493908 2.057960944 2.486998827 Hydroxyisocaproate 1.407591369 0.588704884 0.892576539 0.670399065 1.674270167 1.031598273 0.822851762 0.680059414 0.568546499 1.617412052 0.848425024 0.342423823 1.40669317 0.897072538 3.068698397 0.522523463 0.519613829 0.854961724 0.526603826 0.478759073 1.943925313 0.358308958 1.828987464 0.666147165 0.714350118 0.53798817 1.127608261 0.647425889 0.849412382 0.691395654 1.127602918 0.791651233 0.528197902 0.464998277 0.603852574 0.867629137 0.88983657 1.609412408 1.062931142 0.812634551 1.142162526 1.036156647 0.830610776 0.641577216 0.917880166 0.694118145 0.677002016 0.914267531 0.865430874 1.033252935 0.847013353 0.6781474 1.36561871 0.845825379 1.037525103 0.732584407 1.027394681 0.706953654 1.046755769 1.207217944 0.866440016 0.987195056 1.826664084 0.889825833 Inosine 1.237615301 0.427560486 0.642841302 0.390714177 1.00746809 1.437178916 0.282674746 1.160992288 0.301370816 0.878405866 0.320668761 1.823166419 0.424034061 0.876116213 2.036262667 0.53580675 0.232525927 0.254628455 2.094497845 0.181489775 1.133799083 0.422634593 1.333004006 0.459012986 0.748190232 3.022361118 1.204471666 0.221252856 1.069017911 0.653404095 1.33597207 0.411605769 0.948290934 1.075409026 2.644498387 1.154989533 1.594874337 0.936159071 1.794604236 0.832346269 1.132526639 0.562089621 1.489694913 0.568041982 0.479477755 0.491670983 0.979471265 1.551486681 1.28470195 0.504445815 0.76560477 1.361412037 0.822523519 1.318152638 1.215345617 0.159142643 0.785805423 0.715916961 0.422965803 1.245037469 0.452166176 0.231792755 0.52367341 0.707720721 Isocitrate 0.946467555 3.455121514 0.955332257 0.254509857 3.431766834 0.695584079 0.586529102 0.586522747 1.13758508 1.351019785 0.299799954 2.819141633 1.067566329 0.339840304 0.988297307 0.760891677 1.391279429 0.449959441 2.028880239 0.937547479 1.202431771 1.28902605 6.300858069 1.611458773 0.577843521 0.527271174 1.856475144 0.245076049 0.997686042 1.200351522 2.414843602 1.301846676 0.422785084 0.243390534 0.562721994 1.02620086 0.968934691 0.879983743 0.787411086 1.423532917 0.657525115 0.736153193 0.61147226 0.785750439 0.747137739 0.913149817 0.377370085 0.312134185 0.414235597 1.057632872 0.625774968 0.263908743 1.083046795 0.596826399 0.66150716 0.398183345 0.360253164 1.006326968 0.403687632 0.600492856 1.104743475 1.793938817 0.142287214 1.197405681 Kynurenine 0.668175418 0.902094444 0.301134386 0.47232578 1.470005983 0.436175343 0.677469755 0.491197919 0.885112499 1.28079246 0.209802202 0.283234242 0.83307063 0.821541455 0.596238937 1.379631724 0.511558667 0.994477438 0.338593091 0.782608752 0.336114862 1.343535636 1.096532822 0.928285607 0.258347549 0.407998459 0.259292493 0.48412224 0.298476761 0.885374374 1.119710513 0.56485378 1.354327105 1.072081067 1.663310852 0.987999556 0.903287862 1.143697268 0.80096841 0.873616226 1.381735072 0.324253685 0.820492954 1.025114174 0.976196159 0.984825073 1.256363752 0.899362612 1.146276736 0.881514653 1.026910201 1.033195047 0.581667963 0.981243263 1.469419149 1.37869723 1.120966875 0.882107988 1.265259536 0.982537637 1.056967728 1.585385154 0.896732096 1.168687644 Lactate 0.895673432 1.032159983 0.905001676 1.337258179 1.447623593 1.423304073 0.870696121 1.124944094 0.767808005 1.106603698 1.3998322 0.658576062 0.781044572 1.399270076 1.297441294 1.351940755 1.216740178 0.835680497 0.8467337 1.210104476 1.30643958 0.579550289 1.147472985 0.687947926 1.178055035 0.886745798 0.82073326 0.662375788 0.714935697 0.730341636 0.828702788 0.601015687 0.839289944 0.88385203 0.836403661 0.774621267 0.854019241 1.086553584 1.166335531 0.700970847 0.793455572 0.709986194 0.755599555 0.732610872 0.594635617 0.63693564 0.982042094 1.254230854 1.187216899 1.05731908 1.008132617 1.402101333 1.008121215 1.105381016 1.224220536 0.79572606 0.880280965 0.743210278 0.713935812 1.384596646 0.601366915 0.601627017 0.771535292 0.575228944 Malonate 0.957941132 0.443180136 0.83590555 0.339475722 1.127684588 1.005996796 0.206041999 0.821519658 0.215598901 1.133433699 0.569293362 0.425513901 0.230204989 0.401452915 1.403866985 0.366262722 0.203254248 0.342796155 0.793251156 0.762307252 1.402330218 0.313543102 0.539709583 0.265369212 0.552034952 0.903119834 1.103053081 2.237416333 0.917232613 0.557815494 2.094747008 0.354000719 0.871281778 0.996547453 4.930159585 1.118975505 0.596527133 0.311586195 2.184712849 3.739515564 1.464622668 0.727567329 0.562136673 0.724272095 0.263853113 0.246663151 1.058317615 1.820421007 1.018020338 0.73329731 1.127897482 1.03169249 1.449380396 1.467464216 1.141234582 0.360761714 1.10852891 0.947730547 0.811513574 1.070055678 0.325003633 0.244579152 0.528579449 0.574515021 Malonyl-coenzyme A 0.498778277 0.515846316 1.12653558 1.414894225 1.026812314 1.373705946 1.53984006 1.938995313 0.305813614 0.716039947 0.702229537 0.685744549 0.829644945 0.697077517 0.817794799 0.536594154 1.648933317 1.147966218 1.618506017 1.065896697 0.413105994 1.751042351 1.247959556 0.534180992 0.870715285 1.301808398 0.353632322 0.60415848 2.086624126 1.052835748 1.474604194 0.882980328 0.557477827 1.176581336 0.365147052 0.107222383 0.314901848 0.990020251 1.982793239 0.981620489 1.767731829 0.90198274 0.617110242 0.323724269 1.572229338 0.387394896 0.566589975 0.562449401 0.79732143 0.689747277 0.870715285 0.283007086 0.836614213 0.229676406 1.048975892 0.551072049 0.801320316 1.761602988 1.61285447 1.25049578 0.722667275 1.511233858 1.666383191 0.495901319 Mevalonate 1.069137832 0.512463598 1.139699709 4.109698935 1.433559826 1.832928002 1.126626785 1.337278411 0.34730376 0.444429982 3.034655295 0.281707541 1.000683876 2.494265077 1.934858753 1.653875422 0.356025346 1.012288063 0.3552067 0.301281617 5.909761505 0.160198229 2.95510765 0.11677734 4.601444327 2.997633238 0.810253812 0.065057506 1.136604765 0.098435804 0.27143641 0.042847235 0.567247699 0.462683246 0.487584474 0.621183355 0.750249616 0.767369232 0.353196377 0.130289852 0.187308318 0.336812014 0.460482318 0.171012943 0.06507323 0.160446645 0.47164986 1.300836884 1.458279265 0.191480411 0.305368926 1.650419783 0.366402136 1.411125472 2.556466203 0.436676192 0.517579129 0.231087482 0.26358347 1.771200361 0.112318628 0.111107224 0.238067211 0.34012406 N-Acetyl-L-Alanine 1.188539734 1.031287611 1.384197746 1.293838008 1.497163521 1.365203477 0.860749693 1.394425725 1.211290726 0.991156722 1.172757438 1.04070513 1.350692232 0.941775869 1.528597774 1.38557453 0.973042329 1.440484934 1.270082205 1.402111816 0.641882774 1.07567526 1.429884116 1.338543928 1.372315226 1.528532843 1.139042037 0.754610218 1.06179545 1.165385554 1.052489789 0.396121149 0.800468673 0.834345963 0.931690469 1.379750707 1.011067209 0.82412634 0.750244761 0.331650394 0.780446975 1.084566425 0.77061644 1.118587875 0.624440185 0.527760004 1.074458875 1.165110527 0.675176004 0.553035101 0.483124996 0.971057115 1.104522628 0.9589134 1.068697488 1.229151344 0.834190751 0.752520053 0.462835919 0.709072252 0.554230691 0.785490912 0.837129345 0.7611958 N-Carbamoyl-L-aspartate 0.376407146 0.403774006 0.233237362 0.406020346 0.533475807 0.228227214 0.467704892 1.633694937 2.258368692 0.231659619 0.378685856 0.355239335 0.27852418 0.645732223 0.109875027 1.829792105 0.693217733 0.44760788 0.32397378 0.313190081 0.209680435 0.228320544 0.204489153 0.574319659 0.282861618 0.129094052 0.928504471 0.93071393 0.603391302 2.174977894 0.838727252 0.79600565 2.369529716 1.706430533 0.404119494 7.269623977 1.614309256 1.107501687 0.987320802 0.724880596 0.769503476 0.553826729 0.696533139 1.574369717 1.189951383 1.124397692 0.336709849 1.377044978 1.54275431 1.352663704 1.634341308 0.239810491 0.572800476 1.121524297 0.990585819 1.039537443 0.881399405 1.677513288 0.912994304 0.750066289 0.573190806 3.414806053 0.672294729 0.803179135 Niacinamide 1.016261389 1.13794894 1.102789627 0.618087142 2.167906809 1.183155906 0.86821394 1.274605398 2.360902817 1.621615644 0.426849492 1.167454749 1.790861418 1.49790096 1.327159678 1.48464119 1.16367727 0.869635595 1.461249688 0.822195374 0.846883164 0.999452761 2.490226261 1.404232241 0.81617087 1.99136055 0.822783845 0.384059011 0.496712092 1.872818432 0.968440534 0.771403959 0.849885308 0.928797979 0.726124339 0.621322478 0.715567457 1.191657748 1.215859929 1.01616212 1.316141746 0.39213478 0.454955712 0.776705548 0.723995736 0.606705495 0.757101283 1.053798398 0.905139938 0.623843151 0.490034994 0.895519225 1.083924908 1.233385273 0.924290142 0.965828028 0.84073715 1.034430302 0.63815445 0.792703291 0.730429939 0.554120966 0.525145412 0.847071744 Oxaloacetate 1.153186234 1.256517058 0.730492656 1.09593943 1.392478411 0.904786838 0.620064017 1.285118728 0.919646617 0.981620376 1.012805413 1.245053458 0.648501305 1.049024206 0.955611178 0.889860493 0.793224118 0.645368925 1.442335815 0.993985143 1.097283252 0.741351195 1.089807616 1.04693479 0.975325086 1.493585574 1.331083903 0.510768717 0.93271343 0.577085177 0.881010452 0.735162719 0.715364344 1.076298222 1.669417021 0.871123074 0.835083506 0.833391092 0.855960002 0.799189746 0.772678497 0.903858539 0.74614247 0.638891719 0.598116506 0.570427218 0.972468342 1.093066127 1.171267623 0.609761194 0.813243875 0.671214985 1.373818529 1.189802346 1.565213477 0.441142176 1.051373156 0.784390499 1.211158917 0.631017917 0.827493106 0.527629321 0.734250479 1.446498628 p-aminobenzoate 0.791968287 0.612738571 1.266053902 0.638070376 1.253366732 1.283738491 0.66723235 1.365165694 0.772840679 0.927442755 0.545665794 0.700749572 0.801309781 0.81967789 2.039618211 0.939636244 0.558848214 0.35483597 0.82473619 0.273364642 0.79632371 0.68461611 0.949368932 0.48422924 0.560064781 0.968951516 0.714158946 0.178146266 0.835715552 0.420450677 0.768643953 0.485855808 1.25339855 1.338913041 2.668371297 1.234317434 1.91161331 0.793010322 1.638925483 1.026290451 1.140157231 0.692535401 1.296026633 1.014304977 0.83273863 0.981870177 0.817435973 1.974589062 0.933014527 0.640273975 1.061251568 1.213151221 1.403083547 1.890299777 0.873304623 0.240583088 1.022356358 1.055786354 1.114106132 1.153516836 0.57337094 0.386478615 0.487073422 0.843564707 Phenyllactic acid 0.616072455 0.558141605 0.415248381 1.013548986 1.60073979 0.892541636 0.562175789 0.460306541 0.484037057 1.501796556 1.571763114 0.533210527 2.034687665 1.185950814 2.867356032 0.514700849 0.62504841 0.954397519 0.644039347 1.125104303 1.435087378 0.517547332 1.655280467 0.593426762 1.083027226 0.424349312 0.687978641 0.310188608 0.66141086 0.40359124 0.624671967 0.631483143 0.86430559 0.879948515 0.391131466 0.515043931 0.637558748 0.955719313 0.875683105 0.751936571 0.82877964 0.878777075 0.669471156 0.738349552 0.646198304 0.71193045 0.820344405 0.746576047 0.689400244 0.507099581 0.975644569 1.030141366 0.792538584 0.736237637 0.658037913 0.425237766 0.886370973 0.5322472 0.822038843 1.066808708 0.639053042 0.824791276 1.286195111 0.571317451 Pyroglutamate 0.81490074 1.765064319 0.868406472 1.150669939 0.980068743 0.680804102 0.317283986 1.099773334 1.688986359 0.571896835 1.085693893 1.367612756 0.983094048 0.656971452 0.753047819 1.686568118 1.067270152 0.69217973 1.160170986 0.445576155 0.566982985 1.089001718 0.528516648 1.51636465 0.730466521 0.612180441 1.541550688 0.593894575 1.117857836 0.903528279 1.65184395 1.284184733 0.818363108 0.725828181 2.214387235 1.399907297 1.199198143 0.838516386 0.779492394 0.663320357 0.909552017 0.932055103 0.902177007 1.131514832 1.258150515 1.171181555 0.74738523 0.70825191 1.902582922 0.793708658 0.615179679 1.161477391 0.834217969 0.651223474 1.180682782 0.638195389 1.754789249 1.716227856 0.837867208 0.507189577 1.806051701 0.690080015 1.320611037 1.490994806 S-adenosyl-L-homocysteine 1.077608409 1.39667481 1.192479582 0.747923011 1.545736707 1.403025828 0.853640902 1.133600034 0.81700527 1.187241142 0.604472119 0.680275643 0.699837589 0.598581288 2.105587467 0.908252496 0.487833201 0.454634602 0.978086006 0.435683853 0.758635374 0.702004759 0.972077389 1.312250643 1.040571628 1.205779248 0.783964461 0.745632537 0.745170438 0.821715864 0.659686901 0.586492024 0.727487589 0.700349938 1.470171967 1.153655818 1.007599845 0.453523293 1.173367253 0.87126671 0.89629765 0.658246323 1.291434339 1.28544553 0.980675025 0.706704516 0.87371048 1.527260344 0.943357945 0.889876728 1.092870482 0.902786747 0.679744962 0.849480141 1.31141605 0.931197744 0.807334991 0.865879636 0.405002195 0.62908235 0.903126487 0.342750665 0.921525082 0.712208026 Succinate 0.959713758 1.406867552 0.559744718 1.040570577 1.501751817 1.056085803 0.773887119 1.146413977 0.83899866 1.014834914 1.202073164 1.392768123 0.630790001 0.752157815 0.799096598 0.700610117 0.746083275 0.830881388 0.815911879 0.616328417 1.405699515 0.580606855 1.094347669 0.443802028 0.779650011 0.374223601 1.623620507 0.185506477 0.638606514 0.667496334 1.227962865 1.044539897 1.254787518 1.348030158 1.626336907 1.300072793 2.87907467 0.906876558 1.161249088 0.728201504 1.119188431 0.76338819 0.815912734 0.800540897 1.066339087 1.090851299 1.007016241 0.964464735 0.736432189 0.412974455 0.780770072 0.639093722 1.324372862 1.445570957 1.28685841 0.359976042 1.383714638 1.839997896 1.455670325 0.571103117 1.117353473 0.976539489 0.283015197 1.068475822 Taurodeoxycholate 0.245219191 0.495468183 0.284761849 0.205090377 0.563081399 0.025777532 0.137362184 0.092702922 0.343193217 0.592767216 0.212454554 0.163325416 0.262192848 0.087840266 0.23751826 0.147828218 0.039974605 1.29709022 0.19262869 1.401992141 0.066059864 0.552076807 0.603639868 0.569578726 0.344055231 0.293743473 0.433219769 0.971264568 0.408134914 0.207295268 1.057075222 3.265515129 0.312611648 0.431508101 0.155794999 0.093312865 0.75708318 2.13709598 7.496597396 0.191455666 0.317136839 0.522266573 0.933684283 0.319468566 3.86261762 0.622172445 0.354914896 0.100881693 0.124159976 4.67794328 1.027560425 0.301401152 0.332721595 0.124882005 0.098261892 0.094235948 0.059737234 0.213071303 0.150985281 0.665753682 1.133324595 1.37179957 11.84787046 0.167003032 Thiamine Pyrophosphate 0.906515237 1.376498984 1.039050789 1.261037912 0.956659675 1.350462885 1.002766422 1.29033887 0.433267609 1.566950037 0.613145846 0.902631033 0.967046316 1.086268984 2.067571613 0.678399861 0.740226484 1.430308173 1.234431236 1.331779098 0.852699565 0.830690448 1.20078067 1.495149137 1.951199373 0.971101042 1.033200308 0.649959435 1.082677113 1.789420325 2.165175121 0.440045294 1.984897069 1.73887746 0.826008594 1.407136365 0.582240029 0.711727675 0.904293995 0.450990086 0.845968253 1.029654281 0.584258438 0.457050151 0.850986274 0.532582823 1.426239351 0.682358277 0.846990205 0.220384245 0.647939419 1.277415326 0.848796998 1.044453844 0.969594525 0.964977242 0.789777425 0.944359109 0.665990283 0.716680305 0.529154581 0.951791254 0.610855005 0.988718429 Thymidine 2.371731287 0.917862487 3.536442804 2.269472949 2.259454012 3.937678082 1.642675397 1.244970325 0.151105351 1.860666042 2.493154445 1.077300064 0.476438142 2.00269397 2.393306716 1.029526585 1.083354714 0.995407862 1.209584469 0.651061442 1.146361097 0.237564658 2.922493003 0.290039765 2.477136493 1.584152511 1.067241771 0.280807986 1.663365243 0.749933591 0.966812428 0.193438404 0.594735164 0.426713152 0.50470256 0.583623501 0.485161302 1.247520143 1.247093659 0.75501914 0.498793515 0.548695804 0.218712393 0.262088233 0.201141999 0.335181508 0.917824481 0.562279161 1.120907676 1.166520586 0.36009253 1.238388223 0.513413596 0.632000823 0.866581711 0.460903622 0.38579364 0.871800889 0.412107765 1.040394171 0.43383511 0.422631028 0.311197657 0.553101032 Uracil 3.689424863 0.28265379 0.970830845 0.325803441 3.070597078 1.510282301 0.474961102 0.548921469 0.457542871 1.4922425 0.287077269 0.116951198 0.556486278 0.609066859 2.868783352 0.226144344 0.119430089 0.124434845 0.141909261 0.06382871 1.302746635 0.15585281 0.830466194 0.118951453 0.305141728 0.272588403 0.274681486 0.116303371 0.270797035 0.217890041 0.943602192 0.373443089 1.75277999 1.751114604 1.94649714 0.953407253 3.719827904 0.66972905 1.94598553 1.634889875 0.653216768 0.177999181 2.344952519 1.221681019 0.38638584 0.598495005 0.500543452 2.388987125 0.857698774 0.521098001 0.704097414 0.747410364 1.725672923 2.134392992 0.947433331 0.11741613 0.721835064 0.641062301 0.371965305 0.654532738 0.38321266 0.226069213 0.472452594 0.516244045 Uridine 5'-diphosphate 1.202407265 1.405110657 1.153264646 1.461182265 4.94125256 0.513406588 1.648309276 3.510126765 1.006203987 2.125171187 1.494122666 0.85582522 1.141164732 2.377556455 1.135382934 3.079732586 1.138219703 1.591751634 1.66351282 1.363992374 1.785823145 0.777250785 2.844529082 2.332915373 0.958692835 1.278336714 0.528635233 1.035529408 1.838515889 1.088794845 0.946610833 0.689895095 0.326044088 0.291371545 0.295823143 0.866826833 1.16438961 1.192019731 1.007914851 1.150313125 0.738505383 1.332433215 0.246744394 0.800076996 1.229597548 0.285624902 0.420330089 0.548394752 1.323322146 1.345026782 0.628019901 0.358115399 0.618860951 0.405603169 0.82775663 3.143100897 1.295165902 0.806219985 0.945968015 0.447458503 1.195841994 1.133712098 1.025838701 0.398777475 Xanthosine 0.950270857 0.644107231 0.628501229 0.452272813 0.479669292 1.443147678 0.322886764 1.160721124 0.120535084 0.342143953 0.197409581 0.211674073 0.464741835 0.566207555 1.723041876 0.31010916 0.172681431 0.292666962 0.247486996 0.186789261 0.974364921 0.197191441 0.631376884 0.311873372 0.681587363 0.387057292 1.21611667 0.579995377 1.186517615 0.684183614 1.014714465 0.519842009 0.882841738 0.894638682 2.827224578 1.057826962 1.86277779 0.988660386 2.27902766 1.995398959 2.149156342 0.630961157 1.307720908 0.316839986 0.523686269 0.81683028 1.22296461 2.280735716 2.914537326 0.884412596 1.223483452 3.309017607 0.770574931 1.39485347 2.078789389 0.292066973 0.603969069 1.238092568 1.100554959 2.450175775 0.74750265 0.230155618 0.742456447 1.295765268 Xanthurenate 1.149955868 0.586181766 0.790933617 0.323395203 0.87808011 1.207953824 0.916212422 0.311440612 0.607490035 0.792453857 0.31688936 0.383550724 0.688034716 0.942399618 1.937185309 0.524312146 0.759621915 0.697811181 0.583880601 0.650354101 0.519605985 0.364792665 0.89785322 0.807649164 0.448403587 0.657887284 1.112192796 1.073934359 0.57955965 0.476328671 1.099213418 1.04921655 1.04281593 1.075252443 0.788497907 1.504962291 1.569882991 0.82510357 1.27410832 1.010223838 1.124551909 0.862234995 0.965903989 1.212286434 1.553832224 1.097007719 0.995117343 0.709952423 0.646120891 0.728115508 1.165010185 0.571611777 1.119790972 1.069508565 1.320462966 0.915750016 1.567693569 1.179196236 0.721220389 0.727764845 1.466468197 1.528576534 1.021851837 1.444815576 metabolite_name KEGG HMDB 2-hydroxy-2-methylbutyrate - HMDB0001987 2-hydroxyglutarate C02630 HMDB0059655 3-methyl-2-oxobutyrate C00141 HMDB0000019 3-phosphoglycerate C00597 HMDB0000807 Acetyl-coA C00024 HMDB0001206 Adenosine diphosphate C00008 HMDB0001341 Adenosine triphosphate C00002 HMDB0000538 Arginosuccinate C03406 HMDB0000052 Biotin C00120 HMDB0000030 Cholesterol sulfate C18043 HMDB0000653 Citraconate C02226 HMDB0000634 Deoxycholate C04483 HMDB0000626 Erythrose 4-phosphate C00279 HMDB0001321 Fructose 1,6-bisphosphate C05378 HMDB0001058 Fructose 6-phosphate C00085 HMDB0000124 Glucose C00031 - Glucose 6-phosphate C00092 HMDB0001401 Glutathione C00051 HMDB0062697 Glyceraldehyde C02154 HMDB0001051 Glyceraldehyde 3-phosphate C00118 HMDB0001112 Guanidoacetate C00581 HMDB0000128 Homocysteate C16511 HMDB0002205 Hydroxyisocaproate - HMDB0000746 Inosine C00294 HMDB0000195 Isocitrate C00311 HMDB0000193 Kynurenine C00328 HMDB0000684 Lactate C00186 HMDB0000190 Malonate C00383 - Malonyl-coenzyme A C03188 HMDB0001175 Mevalonate C00418 HMDB0000227 N-Acetyl-L-Alanine - HMDB0000766 N-Carbamoyl-L-aspartate C00438 HMDB0000828 Niacinamide C00153 HMDB0001406 Oxaloacetate C00036 HMDB0000223 p-aminobenzoate C00568 HMDB0001392 Phenyllactic acid C01479 HMDB0000779 Pyroglutamate C01879 HMDB0000267 S-adenosyl-L-homocysteine C00021 HMDB0000939 Succinate C00042 HMDB0000254 Taurodeoxycholate C05463 HMDB0000896 Thiamine Pyrophosphate C00068 HMDB0001372 Thymidine C00214 HMDB0000273 Uracil C00106 HMDB0000300 Uridine 5'-diphosphate C00015 HMDB0000295 Xanthosine C01762 HMDB0000299 Xanthurenate C02470 HMDB0000881