metabolite_name C4 C5 C7 C8 C9 C16 C21 C25 C31 C37 C38 C40 C45 C46 C47 C49 C51 C53 C28 C30 CE54 CE55 CE57 DE55 D10 D11 D12 D13 D15 D16 D19 D20 D21 D22 D23 D25 D26 D27 D28 D56 D58 D59 DE5 DE10 DE11 DE12 DE51 DE52 DE54 DE53 1-Methylhistidine 0.08105362056 0.007876834817 0.006511612943 0.01776595078 0.005132356652 0.004600107381 0.03567500058 0.01398978763 0.01155666229 0.009460582802 0.02243024001 0.0111492083 0.01660449995 0.02198977797 0.005459288342 0.006332867661 0.005364361707 0.003352103963 0.005011552597 0.02099468791 0.01062458448 0.01018654131 0.01124071283 0.01075997887 0.01124410724 0.009257611887 0.03309557681 0.01400488122 0.007298445048 0.007750042538 0.0147254241 0.00696933199 0.01192465551 0.007054141183 0.00407493646 0.01840585021 0.01951551909 0.01086043277 0.01992816434 0.01553284634 0.007775861113 0.008420896973 0.007199537018 0.009465295839 0.00988765314 0.0146865931 0.01281388902 0.01258782563 0.01544753037 0.01090461745 2-Hydroxycinnamic acid 0.08605961528 0.0968126747 0.1784199975 0.1400520982 0.1037995711 0.137841637 0.1491158444 0.1333941655 0.111476903 0.09869294127 0.1928290873 0.135899559 0.1215281198 0.1007648791 0.07919159437 0.07381445674 0.07339164413 0.1584966039 0.09808343634 0.06831601327 0.1652935641 0.1054030803 0.06299572418 0.112838078 0.1595803387 0.1087513394 0.1447364858 0.06045378846 0.07299131756 0.1110309359 0.1434989078 0.06992531554 0.07993832731 0.1012614782 0.08789881165 0.132259581 0.08874270438 0.08790598592 0.1191270473 0.06491969307 0.06740520152 0.08232226401 0.101549667 0.1316718166 0.09588080801 0.05964599198 0.1010199358 0.06964409375 0.1024641043 0.07438466612 2-Oxindole 0.001478623999 0.002819685507 0.00150194064 0.00288287397 0.00163080545 0.002508756837 0.003151926712 0.005491125563 0.002014233302 0.001885894621 0.001699600533 0.001522278378 0.002878451214 0.002170452972 0.003954622887 0.00190352641 0.001965358054 0.001468242903 0.0006383032089 0.001981692909 0.003321994352 0.005598073511 0.001617286182 0.001803290699 0.001751674402 0.002625921704 0.000518071243 0.003320043265 0.0005171219206 0.001494210613 0.0001986697532 0.0007727792443 0.0007605922865 0.002202970815 0.003893817332 0.003385542221 0.001416684719 0.001269498447 0.001957426579 0.001143159072 0.001430374744 0.001201811496 0.004601932808 0.0003849527473 0.002106975446 0.002231903824 0.002412595678 0.00500505054 0.007962678473 0.01074275682 3-Phenylpropionitrile 0.02833222727 0.01284851722 0.03050316875 0.01733184711 0.0180639094 0.0291635396 0.04471262404 0.02033626073 0.01987254246 0.01326778043 0.02094606567 0.01525878481 0.02604708568 0.02124699776 0.01124414277 0.008142649838 0.006611071412 0.007955569046 0.01568318061 0.01782053671 0.04170880141 0.01842899 0.0174091016 0.02111628412 0.01741577034 0.02591182515 0.02196930649 0.01605906847 0.0151358114 0.02017909769 0.03010467385 0.02133789641 0.01215525468 0.01246423397 0.01949498316 0.03305029514 0.02190354332 0.01923326352 0.0204444393 0.01394831413 0.02231591262 0.01546454484 0.01317834602 0.01895596972 0.02586467146 0.01992001364 0.01800803911 0.03036033576 0.02366282339 0.02738644414 4-Acetamidobutanoic acid 0.09611489886 0.02792252579 0.06417903108 0.05946815862 0.02536999682 0.06916211296 0.1284105442 0.08234417338 0.08692603559 0.07600805871 0.02814929806 0.05977070563 0.02930813475 0.09750047621 0.03871310472 0.00465257793 0.002650317619 0.001107515471 0.01657532363 0.04100221799 0.09945874533 0.008634974753 0.03664117139 0.01887368692 0.0602762409 0.04915910852 0.02332270338 0.07363903736 0.02529654767 0.1317537224 0.1224818057 0.0730302253 0.04641311044 0.06917316269 0.1341829842 0.08998968091 0.0676171 0.05227161719 0.09289428583 0.04654660993 0.113894204 0.04734320522 0.07462402038 0.06947751953 0.1117600406 0.08128251278 0.05280560798 0.08856499622 0.05167274512 0.130420341 4-Guanidinobutyric acid 0.2433975983 0.07388972577 0.2137945479 0.09777768137 0.1313627042 0.2337227178 0.4319742182 0.2364552578 0.2251756427 0.1067003719 0.1330838117 0.1605287359 0.08691257978 0.1918614565 0.05341829211 0.03050155861 0.02087079946 0.004710293857 0.1657093098 0.1203839522 0.2637341202 0.2170637546 0.207236208 0.389492768 0.1280178268 0.3856385702 0.5524444075 0.2973279902 0.2421513236 0.1008475202 0.2989675644 0.3100937279 0.2618907466 0.1756877689 0.2854076107 0.4532072897 0.3753303849 0.2447586299 0.1827264682 0.3759468594 0.3176003491 0.1428431485 0.4214971475 0.2016276155 0.2623288659 0.2435868457 0.2030873137 0.412135185 0.5232000264 0.4450063648 4-Hydroxybenzaldehyde 0.01976542675 0.01910918267 0.0353733257 0.03143115992 0.02363282628 0.03075457147 0.03196673836 0.0275704419 0.02466925748 0.01952787499 0.04707179537 0.02959850519 0.02919916581 0.02101161539 0.01628979931 0.01446275337 0.01577676837 0.03328055143 0.0219379478 0.01518064713 0.0307943011 0.0242547278 0.01581682607 0.02503542746 0.03247215096 0.02517758937 0.03394265428 0.01399829515 0.01632010013 0.02120154298 0.03012570422 0.0185316043 0.01636866754 0.0203795918 0.02031177118 0.0267320277 0.0149473465 0.02151704516 0.02543609107 0.01593035083 0.01445915266 0.01683869238 0.02241625437 0.02816345618 0.01963771609 0.01241728617 0.0217609438 0.01827414441 0.02274594066 0.01584273224 4-Pyridoxic acid 0.0005840057738 0.0003449878396 0.0003435018053 0.0003200018371 0.0004549163649 0.0004521754974 0.001235985296 0.0007333678437 0.0004911822644 0.001537531418 0.0002912656735 0.0002641312254 0.0002624535126 0.0003070267219 0.0002984595776 0.0001936527291 0.0001979415597 0.0001517399426 0.0003478281945 0.0004225757615 0.0004304712775 0.0005369913271 0.000370532559 0.0005872262762 0.0002622263877 0.0005101112908 0.0005911359583 0.01511322415 0.0004645446577 0.0004427306467 0.0007335476513 0.0007464992992 0.0006391825188 0.0003861435191 0.02241473232 0.0008310574253 0.01683192289 0.0003113493514 0.0003514603701 0.0008038215586 0.01842689087 0.0004868159431 0.01759993825 0.0005389314737 0.0006436516167 0.04840861479 0.0006800554871 0.0005449440481 0.0005827232253 0.0007147048626 5-Aminovaleric acid 1.269702127 1.617114581 2.358347408 2.648416203 1.316033399 1.234028955 1.775963624 1.659556211 1.360768838 1.478092305 2.436416166 1.651408325 1.701378693 1.589024456 1.35014536 1.83956616 1.489637545 1.915721758 1.187603494 1.774072389 2.371514179 2.256489262 1.440093444 1.302068861 1.731975656 1.527519988 2.300522345 1.131571549 0.8996114599 1.715822893 1.771171955 1.11517133 1.057574048 1.210595394 1.083378802 1.808666887 1.358473984 1.048059505 1.503888859 0.9484930919 1.586733796 1.101243671 1.264433077 1.427615846 1.043137571 1.210188147 1.412345941 1.455211016 1.076032908 1.110577365 8-Hydroxyquinoline 0.01742378243 0.01608789877 0.02896105778 0.02338552993 0.01744986028 0.02525701901 0.03019114268 0.02164821458 0.02090646745 0.01815818937 0.0241406191 0.01990358414 0.02391545557 0.0218242517 0.01533548701 0.01842905096 0.01617465336 0.01951889126 0.01550359048 0.01646838645 0.03034454705 0.01985059781 0.01939350153 0.01713184816 0.02384614842 0.01909743113 0.01828118235 0.0115458699 0.01240019045 0.01201622096 0.01927760552 0.0157149836 0.00825479408 0.01300851261 0.01526467105 0.01979981013 0.01427140909 0.01799971633 0.01946829826 0.01381933845 0.01400815287 0.01128945959 0.0116492929 0.01410254419 0.02170562488 0.01724941232 0.01415076822 0.01537182222 0.01664172999 0.01748244941 9-Methyluric acid 0.01718363957 0.007801120969 0.01181684439 0.01539631923 0.006612663838 0.01175900652 0.01774898881 0.009754152825 0.009603830019 0.009440031045 0.01054656402 0.01089482494 0.005796262953 0.01680235278 0.007428457191 0.0006109438584 0.000206350434 0.0002183812083 0.004426857762 0.008320727436 0.02390570412 0.009309092682 0.007134561306 0.009831786121 0.0143050936 0.05776923028 0.01920560148 0.031652313 0.04443294929 0.02313663437 0.05077426558 0.04929219822 0.04744676043 0.01214967479 0.05284322598 0.0750223648 0.02484885085 0.02396184595 0.03970417623 0.02904165346 0.036366637 0.0376332992 0.05695445452 0.0244999402 0.04497252947 0.04563860207 0.0357508543 0.0750160657 0.02381213342 0.06909361309 Acetylcholine 0.1247527987 0.1507677438 0.1213519046 0.1416053813 0.0987331934 0.1013303873 0.135069786 0.09694264828 0.08903178288 0.1355443452 0.1074804217 0.1600561049 0.1208392575 0.1635154708 0.1413309016 0.08510204567 0.1115264059 0.1315426297 0.09523965633 0.1539237639 0.07873955921 0.1208637237 0.09870328329 0.1223858626 0.1060121907 0.1241353576 0.1242720503 0.09234385967 0.08911890068 0.09263698026 0.07783523056 0.07891707854 0.08497968294 0.08979061669 0.1105544069 0.1345681864 0.1212128569 0.1038811977 0.1034380804 0.04685919979 0.1193450566 0.1398364436 0.05803639953 0.09251616329 0.08041865093 0.1076343664 0.0997740826 0.1290554018 0.0872427511 0.08293223786 Acetyl-L-carnitine 0.1073028548 0.2865546419 0.6737155583 0.8240793586 0.1332276808 0.4574995807 0.7813769869 0.3777930878 0.2662029366 0.4852823996 0.8453737168 0.4597725227 0.8677495266 0.2696899741 0.48690522 0.2845475221 0.288061538 0.3024938668 0.06559791939 0.2473441397 0.4914146142 0.5522011415 0.3315352288 0.0798705546 0.3350815977 0.4471014547 0.5376840756 0.2939528563 0.2051135356 0.4680618003 0.5467592252 0.5360590577 0.565030268 0.4888140112 0.4231413454 0.5887228722 0.4006451657 0.6080616388 0.9160138455 0.3669971484 0.7657672555 1.267717945 0.526888255 0.3300273262 0.2117080649 0.1024816072 0.1168062442 0.9202916358 0.6760523436 0.8216345407 Bilirubin 0.06545899395 0.02346284817 0.06173802159 0.0582070203 0.01494673921 0.07230589581 0.02436020275 0.01532804461 0.04110484822 0.08079923712 0.02251057272 0.04199009505 0.02874489478 0.07401661092 0.0621991203 0.04193933876 0.03279199912 0.08970771536 0.02080214079 0.04184615348 0.02872502309 0.01046268176 0.05155485094 0.02430669234 0.01649207619 0.03949437573 0.01384667495 0.02087864598 0.01037949276 0.009587523172 0.009158603752 0.03289322314 0.01322962392 0.01363309301 0.01632738348 0.03115128053 0.01333709991 0.01663206325 0.02983010991 0.003222581843 0.02500955239 0.01779241191 0.009593070082 0.03897007602 0.06165873073 0.01968155064 0.01798796501 0.0134448186 0.01071280386 0.04085859323 Choline 0.5551172208 0.4681116134 0.5080365271 0.442214922 0.615116569 0.4234677734 0.6592104303 0.5186290221 0.4222247601 0.5303526402 0.5486982453 0.5257990921 0.5867275069 0.5253236936 0.4326374329 0.4182228594 0.3884604216 0.3876601264 0.6550458107 0.7506432189 0.5662372944 0.6817678754 0.5938205258 0.9037204073 0.4228234129 0.6597220208 0.4891679142 0.284392918 0.5082072345 0.6187085957 0.5011177602 0.4038761865 0.2691464699 0.3549032974 0.4925091069 0.4608641834 0.4954579432 0.451969824 0.05118742481 0.2732296694 0.4713136036 0.7072021821 0.5888294364 0.5194823242 0.4292477067 0.446255332 0.4282813905 0.7278960613 0.8590753118 0.9616195151 Cortisol 0.00252007657 0.008584247589 0.005173192319 0.003605708541 0.005525690631 0.007155943874 0.009262275457 0.004269502262 0.003038603239 0.003197005428 0.01607649064 0.003868950203 0.00800097592 0.002564763256 0.003093835364 0.009960781575 0.003927154552 0.003215399028 0.001992858221 0.005066509111 0.009193819816 0.00418713911 0.004691240362 0.003474790259 0.00212403015 0.002059610754 0.00711261305 0.007035094002 0.002844840255 0.003856741715 0.004259309874 0.00222129399 0.009889537585 0.005670315019 0.008974697104 0.01761295359 0.006328841478 0.005152185982 0.008584522377 0.0108064395 0.007815672989 0.004926265237 0.004546699061 0.0009446967367 0.00600212805 0.003638281782 0.005323284157 0.005088243095 0.005964363488 0.006128060999 Creatine 0.1585718931 0.1901808644 0.2057236953 0.0716382526 0.3033506599 0.1423476286 0.2118113348 0.5045130339 0.2060300837 0.1001292812 0.55370795 0.08157265759 0.3564449115 0.1938220713 0.1035848728 0.3875050833 0.1539635421 0.2439465974 0.2592028515 0.5174782574 0.5996383648 0.333363746 0.4112092339 0.3085666031 0.1291279267 0.265208283 0.3721642634 0.2541919021 0.1287262475 0.1706649442 0.3830615605 0.09647778883 0.08669669671 0.2656474114 0.06043255427 0.2834922237 0.1012591699 0.208465874 0.05011921413 0.3506318445 0.09047863092 0.1872964291 0.3918212225 0.1539593473 0.09269810265 0.1009488778 0.2364042132 0.2183863408 0.1254872999 0.3633926636 Creatinine 0.3001576736 0.3218518814 0.3175019459 2.41216241 0.2414562447 0.3368374964 1.587503593 1.329206456 0.2037220999 0.3182844379 1.409710722 0.4183939216 1.153865108 0.4307812427 1.146789228 0.9324035154 0.2165726878 0.2630297266 1.249806127 1.453552986 0.3587105568 0.3140331584 1.470634161 0.3056883633 0.284544055 1.103408483 0.210697297 0.6982169864 0.994062488 0.267557467 0.2661829863 0.2348281748 0.3321880741 0.2537590145 0.3248772683 1.317689857 0.2122456179 0.9067301803 0.2622892047 0.1983872351 0.8186162239 1.096113949 0.1525213119 1.253440125 1.191393988 1.116913674 1.02913937 0.8822908197 0.4923100783 1.180848563 D-(+)-Pipecolinic acid 0.05125333498 0.08648764318 0.03984062276 0.06057789684 0.0335073272 0.07461705677 0.0762954349 0.0435414958 0.04819052951 0.0269637184 0.1060187539 0.1104656121 0.101168587 0.09934231122 0.1549856182 0.1157305814 0.2327947391 0.1767445908 0.07217299572 0.07599336117 0.09007328349 0.07257789798 0.02921286974 0.09230130032 0.02142308859 0.241096225 0.2243179492 0.2122916947 0.04441053779 0.1081657792 0.02384816869 0.1148292977 0.05194992983 0.01697060727 0.1795748916 0.06507781713 0.09499054027 0.01836917385 0.09367117278 0.01591268371 0.09640735772 0.1270469175 0.2344131736 0.055272395 0.06203727155 0.06921509295 0.01292567684 0.07604611952 0.07814517926 0.02548461374 D-(+)-Proline 1.177363794 1.646685208 1.432766307 1.850740081 0.8232519863 0.6936407962 0.9250071491 1.032113839 1.090762209 1.408390647 0.9442658799 0.936089991 0.7643436026 1.289903191 0.783581714 0.6506096755 1.042838241 0.9606644151 1.029665198 0.9607556124 1.192367744 1.988588743 1.232373227 1.26265906 1.314472637 0.7591103417 1.151813968 0.5034150651 0.6702627231 2.644032964 1.302069587 0.7140479716 0.6155426899 0.8448620284 1.034068239 0.8792215238 0.7704422638 0.6171481544 0.9250661206 0.6886178959 0.574021589 0.5454356229 1.258193296 1.009137923 0.8129471337 0.7395462535 0.7047501182 0.5450446547 0.9373553805 0.6048650112 D-(+)-Pyroglutamic Acid 0.07521420436 0.02368545693 0.1161952599 0.1419737905 0.1289725012 0.1293286919 0.1297703052 0.114810232 0.1143127062 0.1150194341 0.1513909376 0.1884688222 0.1311419308 0.1380747344 0.1619941565 0.2208738877 0.2071109984 0.1931648178 0.1063930302 0.06725470376 0.07507558954 0.08948002281 0.08735309185 0.1089126932 0.1875333354 0.05215479594 0.08288737679 0.1260164542 0.05856532156 0.0794048822 0.08722836658 0.1023726551 0.08326419835 0.1615325156 0.1173720236 0.09208317425 0.0802016125 0.1294625473 0.133106035 0.08786700601 0.1185638546 0.1316485141 0.03852402875 0.08779103523 0.09899114363 0.1069958673 0.1018337423 0.07890871393 0.07239873927 0.07130944179 Decanoylcarnitine 0.02714603593 0.08651310051 0.02043742807 0.07821019624 0.06069850335 0.008105680659 0.03477531394 0.01353118723 0.01583029412 0.02416754938 0.006133363241 0.007729469657 0.04139322267 0.01050263843 0.05460856758 0.03049108178 0.01575596495 0.07267328741 0.01024566201 0.08122727354 0.01224992935 0.01316352091 0.02184327855 0.009785991863 0.00344008895 0.01248122587 0.03769955847 0.01687184224 0.02532428035 0.02628729371 0.007699043345 0.07344547308 0.03966297031 0.02692714919 0.02232098899 0.03474882861 0.01647531858 0.05557748301 0.06505252323 0.01584118771 0.05822040274 0.06204345817 0.00889642335 0.01351046439 0.04487636106 0.03920635541 0.04293499428 0.2032284459 0.04237783593 0.02717739268 D-Erythro-sphingosine 1-phosphate 0.01107383569 0.01293700748 0.008891306748 0.01609647739 0.01754526088 0.004810971645 0.007819690912 0.008052056059 0.0106954028 0.00616106081 0.009291246789 0.006231934485 0.02231366965 0.01498358338 0.01645458394 0.02241504532 0.01707632667 0.02407932392 0.0133921607 0.01150549431 0.02096300086 0.011929384 0.01556664396 0.02093125914 0.01014695856 0.01036180875 0.01151727338 0.003781880572 0.01191960797 0.01934524755 0.01907337064 0.01672700345 0.0241045011 0.01383935129 0.01225640853 0.0177344044 0.008773464704 0.01575281548 0.01218431083 0.004884098857 0.01649295242 0.02033063822 0.01015493079 0.01491597251 0.0117173214 0.00789402882 0.01312028609 0.009210184568 0.011344081 0.01084193471 DL-Arginine 0.06121164278 0.08311531721 0.1217686139 0.06389482123 0.1158909142 0.1043326492 0.1425412561 0.06390107638 0.118828409 0.09269605889 0.2526196233 0.0707156969 0.1269546078 0.1172261156 0.1283304934 0.07904407416 0.03196334136 0.1074185256 0.08526065412 0.1365378192 0.06805819525 0.07019539851 0.07557051465 0.1521557838 0.1468669447 0.1083658025 0.2126396613 0.1243588768 0.130425335 0.2245989467 0.07766788235 0.1072010074 0.1710825227 0.1003036245 0.1387144108 0.1377466031 0.08979290914 0.07709844839 0.07680965088 0.08820782358 0.1036298198 0.05504433998 0.2224638612 0.05722568838 0.04045640579 0.0459623309 0.1406385471 0.07537390441 0.1199415103 0.0412396053 DL-Carnitine 1.30318928 1.490522097 2.263580966 2.425532949 1.996706446 1.651100041 3.173055293 2.079988922 1.057844004 2.651531925 3.189391952 2.70649346 1.726988503 2.098100859 2.704048849 2.588903185 3.057573883 2.112862625 1.66457033 0.3596778301 2.618670615 1.923179246 2.44883536 2.039129326 2.726712452 1.708210561 1.826201451 1.550098582 1.871509355 2.67933751 2.258913448 1.584238762 2.186504195 2.135781415 1.337643595 3.172565539 2.598989694 2.459207019 2.748554289 1.062300513 1.35868917 3.006173663 1.753717363 2.250387086 1.566511132 2.143068696 2.466187615 1.771387249 0.9862719662 1.377595269 DL-Glutamine 0.205560947 0.1408599048 0.1128846602 0.1620224043 0.1208168801 0.04397847283 0.1370698325 0.09042440903 0.1991002487 0.1272624975 0.1673188744 0.1475919653 0.1304133946 0.1484813273 0.1597621493 0.1155050257 0.1163634034 0.07828399139 0.1333933997 0.145878692 0.1249053138 0.1435353569 0.1228255232 0.1812608091 0.1693394031 0.1427783277 0.2043915784 0.1603291567 0.1368986608 0.1800201278 0.1444823143 0.1111166218 0.1094715946 0.1455702648 0.02139287937 0.1082628738 0.01899089694 0.1469620109 0.1194510136 0.1057714129 0.1124432462 0.1358827772 0.1466643669 0.1677711417 0.1724843407 0.159337183 0.2169269456 0.1393520833 0.08336096592 0.0943991615 DL-Lysine 0.1319697238 0.1237785518 0.150414998 0.06527821343 0.09422211894 0.04549368212 0.07162237673 0.1085485525 0.0706939865 0.05322310337 0.07895870895 0.06597049227 0.1394585823 0.1170273582 0.1124148524 0.09269672266 0.08967705437 0.0496939854 0.05716518547 0.1685986991 0.1213726302 0.1283789335 0.07827884709 0.1691274776 0.0759024791 0.1430635426 0.07006725667 0.05261201167 0.04920985068 0.1253864579 0.09844810525 0.1424692648 0.04303945925 0.1068896689 0.05913260844 0.08680515962 0.1047548514 0.09738274658 0.09189625668 0.03539279525 0.04533273225 0.1277212285 0.1150371407 0.05433688778 0.04833080503 0.04983741001 0.1253119773 0.1390740413 0.04371808391 0.09947131029 DL-Stachydrine 2.321217923 0.1890164634 1.254643511 1.179669786 0.1414188301 0.1785986056 0.9158411482 0.3371134071 2.722352903 0.2300242331 0.3108422285 0.3645387702 0.4102332653 0.3170259988 0.2485549885 0.2037914573 0.4639300112 0.3040566575 1.014806364 0.2036129408 2.267610632 0.4294779586 0.4433955651 0.3999424626 1.455793861 0.5956295508 3.580445723 1.687844883 0.5256879072 0.7001707603 3.316326947 0.3038183573 2.245761381 0.1633060274 0.4550211139 1.538549145 0.7443351423 0.6137225566 2.57535407 1.853149021 1.972574703 0.2280360445 1.911534562 0.4639631118 1.47618728 1.549326639 1.686664189 1.33337285 2.634122006 1.922906653 DL-Tryptophan 0.952028017 1.020614809 1.618933624 1.252476184 0.9182991792 1.287097815 1.531587489 1.162966894 1.103025265 1.073060419 1.406872794 1.059433663 1.380839625 1.258787267 0.863487941 1.02802046 0.9802032415 1.116512044 0.9472432355 1.065670515 1.67065882 1.15760484 1.079049196 0.9289143237 1.29763664 0.8903045155 1.102510552 0.5004920422 0.6676264688 0.7127295136 0.9958179895 0.6937714054 0.3890475937 0.6739074008 0.6654083953 1.093679223 0.6826669394 0.9918917579 1.030119354 0.6593142798 0.7061338754 0.5984037041 0.6107913158 0.7475823912 1.060730179 0.789978472 0.65692417 0.7640339621 0.802914049 0.7071707807 DL-α-Aminocaprylic acid 0.06971643605 0.005743503951 0.04018753515 0.02216253995 0.01492104481 0.03698618236 0.08090036563 0.0309330318 0.02055544208 0.01301993198 0.01637036857 0.01613999671 0.02394082631 0.03633760738 0.01164420018 0.0006458789565 0.0002755166856 0.0001674013573 0.01228377544 0.02931676789 0.1009848257 0.02115196266 0.01108507886 0.06522125121 0.01902519284 0.1544726667 0.1257340964 0.1058537953 0.05705598404 0.05901612298 0.1868004186 0.1048195333 0.1158779309 0.01898867726 0.1336964058 0.3183300145 0.1152283983 0.06306678181 0.05722652396 0.02365556095 0.149393064 0.06283721121 0.08893818723 0.08330136118 0.08014412417 0.07776772208 0.1223641828 0.2789679587 0.08920508426 0.1933194779 D-Sphingosine 0.00329113306 0.003564501163 0.004035423265 0.004554644004 0.002436815158 0.001369770639 0.002106625085 0.00138234178 0.004300029034 0.002668952797 0.003226577304 0.002049254198 0.00360387824 0.003781298289 0.003343883494 0.004832008351 0.004486774499 0.004684087579 0.0030446623 0.002911681324 0.00457258297 0.01159109748 0.009903043348 0.006480325734 0.002400554764 0.001966953383 0.002181907975 0.001395436021 0.003087749812 0.01017529 0.005322739537 0.005374335293 0.003552030426 0.004457601691 0.004898346277 0.005444586828 0.006171898407 0.004591891893 0.004246302508 0.008266610555 0.005950008794 0.007354605375 0.00812124964 0.006299479231 0.002704559036 0.002440653573 0.002634708592 0.004813654035 0.002101731635 0.001272978207 Hexadecanamide 0.2381405875 0.1407738241 0.1203372639 0.3058672648 0.3272622295 0.08668873556 0.1812830131 0.1058772159 0.1635034496 0.1220763138 0.2099657862 0.08557531277 0.4292308273 0.2596283221 0.2125021225 0.4043299901 0.2375991909 0.4669144267 0.2013861889 0.2061638825 0.625579021 0.213772046 0.5269638134 0.5270348632 0.1036032786 0.1507054319 0.04162731486 0.09983019672 0.2597642108 0.4375485166 0.7658972186 0.4332876782 0.6073195568 0.3533066506 0.4130194248 0.4667840267 0.2329424257 0.6227021969 0.3465206503 0.2081229254 0.4765924502 0.2770327964 0.2489953747 0.4547500809 0.5425391148 0.1713593568 0.2798742366 0.2630529522 0.3664678416 0.1340468114 Hexanoylcarnitine 0.002754739783 0.009334932562 0.005004401131 0.008700625418 0.008793542755 0.001920691711 0.005599967296 0.003775523228 0.002237346558 0.004547641913 0.002509501416 0.002116244755 0.004920955147 0.003087750891 0.006676537781 0.003865154234 0.003022505527 0.006525626535 0.002551869228 0.008983509318 0.002972764865 0.004756527227 0.004698556979 0.002140569807 0.001781676952 0.002139715854 0.006352981177 0.002311758983 0.002460787269 0.006675557857 0.003552460224 0.01350482714 0.005939227307 0.00493086043 0.002616108957 0.004874149853 0.00296812834 0.009435171088 0.006855789917 0.003395734851 0.007640253762 0.01041960931 0.003198582676 0.002936450013 0.003038671443 0.005561738774 0.005871128651 0.01918052478 0.00605611342 0.005929368472 Hippuric acid 0.004530473965 0.006198144184 0.01533392292 0.003193765253 0.01752064881 0.01393136162 0.003740909159 0.00875899231 0.01029215098 0.00519964005 0.004607848887 0.02620781164 0.01506365176 0.01714324111 0.005445762459 0.003356777801 0.008991642839 0.009626427679 0.005865321126 0.004643199246 0.02100326881 0.02048935751 0.006559043855 0.04065658659 0.005830765513 0.001176850654 0.02319852106 0.01432478016 0.007697199908 0.005745202625 0.001595159688 0.005038321718 0.0007519428934 0.002047917124 0.000984472695 0.08823363964 0.009974679288 0.01273806226 0.006721377666 0.008903187943 0.02393438681 0.0002020385644 0.004788135884 0.001383644677 0.001000889791 0.01058066369 0.004376987005 0.006235579982 0.03727056621 0.03063858777 Hypoglycin A 0.001258022312 0.0006721052324 0.0001105315692 0.0002753223088 0.0007231734121 0.0004671964159 0.0002190199495 0.0009119694702 0.0007303815649 0.0003246621822 0.0004014685657 0.0005513248418 0.0006782874333 0.0002777482786 0.0002929524369 0.0009241431589 0.0007631607009 0.0001211092464 0.0001168128416 0.0005171535533 0.003628450887 0.002613031572 0.003995253244 0.005863458124 0.002243769093 0.0005634822755 0.000984634465 0.001047221872 0.001189696383 0.002251120328 0.006485511705 0.005089635394 0.001960798517 0.002239744565 0.00220308244 0.004981187205 0.004247562698 0.003902064766 0.005657382741 0.009758572457 0.007487793289 0.002391567048 0.002119203363 0.003966889057 0.002239837197 0.002424950022 0.0007114878674 0.001633807799 0.007869638394 0.003891142492 Hypoxanthine 0.09133977084 0.2096842721 0.1518674443 0.100985238 0.138658988 0.149051777 0.2672761648 0.210315267 0.07295666045 0.2952894286 0.3565206409 0.1708928547 0.2572345996 0.1720257933 0.1249173605 0.2135723366 0.2220245748 0.2023366368 0.1166442921 0.1084151352 0.2174332297 0.1565724401 0.164462646 0.147086111 0.1425036324 0.2152670328 0.1004356662 0.1525735329 0.140081833 0.1287773509 0.146568129 0.1710998692 0.1556113635 0.1944938102 0.2362577823 0.3466000901 0.3976548329 0.3713760825 0.3561661053 0.3003608209 0.4106917659 0.2217576534 0.0810664012 0.1997131098 0.1762975186 0.1760258028 0.1829634871 0.1932759986 0.4034526168 0.3641670329 Indole-3-acetic acid 0.001953898685 0.003522273159 0.003236874558 0.004034759111 0.006139988444 0.003902258371 0.003959398183 0.002993083866 0.007360782323 0.002116960265 0.001572191955 0.003253481297 0.005710902555 0.003370039637 0.002618134839 0.001719249163 0.002080814987 0.002162296209 0.002019764689 0.0016215666 0.007067637272 0.009522747106 0.002619069056 0.002853626889 0.001445934991 0.006145721503 0.001768397182 0.004936816967 0.006737123779 0.00989576673 0.00190369012 0.02709461506 0.002252202181 0.001173272315 0.002229093113 0.003603505393 0.001579664637 0.002135748992 0.001734966823 0.001301740953 0.007329199402 0.000875991101 0.00491135027 0.002643490852 0.001931976722 0.001766294232 0.001133844987 0.002847389103 0.001710258595 0.007770755215 Inosine 0.01621856694 0.02960729924 0.02830043352 0.009835406457 0.005656053756 0.01650860826 0.01637547008 0.009694071469 0.009433803401 0.02952559072 0.01480727876 0.003666941158 0.01064447964 0.008370229259 0.002673215243 0.004281499996 0.0099813307 0.004121944128 0.005800594247 0.006133311161 0.008936576056 0.005582886384 0.009944481388 0.0005480233921 0.02426425273 0.02995332174 0.0106434603 0.01076696245 0.006949536775 0.002642954985 0.002862516665 0.009154484599 0.01557238637 0.01963071152 0.02523687602 0.02865759775 0.01800452191 0.05948641871 0.03917031863 0.06494193548 0.03128168336 0.001190520929 0.006108424749 0.01918390445 0.02384024168 0.05170342595 0.01381905752 0.02556521787 0.05421461379 0.03157899793 L(-)-Carnitine 0.3580842453 0.7958650507 0.4873300621 0.6243749843 0.8040412046 0.02643425873 0.6141493034 0.6426263127 0.3710586691 0.2693994276 0.02783704999 0.02069167097 0.394702599 0.6842798494 0.02911578412 0.01526311842 0.02313850345 0.01020967293 0.556888744 0.8419404459 0.5974631362 0.8092056532 0.6626513575 0.6473061087 0.619017836 0.5261895504 0.4607542138 0.3121296013 0.5327777204 0.7161156301 0.4096660086 0.01600395792 0.3220043127 0.02113982226 0.509182687 0.02428236503 0.03365343076 0.6759507085 0.3682763439 0.2369316355 0.4582109718 0.01985720886 0.01981206682 0.02203642312 0.01140596513 0.4856024436 0.4640878211 0.4596405658 0.3376347915 0.565952828 L-(-)-Methionine 0.2823402414 0.2687646413 0.4362285229 0.3459890694 0.2149168544 0.3415070667 0.3168028723 0.313220542 0.4668098613 0.208405658 0.4058030961 0.3151493583 0.3571006654 0.3254692295 0.274336841 0.206721998 0.2171309133 0.3458150239 0.2554853507 0.2843316709 0.3466770042 0.1847736904 0.2544112117 0.2439067756 0.394410898 0.2562415783 0.3024267589 0.1796287482 0.1228658309 0.2183280301 0.2105088199 0.1908968613 0.1654763412 0.2232902228 0.2264393242 0.2639470168 0.1472333469 0.2307594499 0.2770513538 0.1201329292 0.3662591746 0.2149249395 0.254627756 0.2320096968 0.2723629722 0.159352885 0.2050671585 0.2193365385 0.1555798493 0.1848472998 L(+)-Ornithine 0.01482558648 0.01226276224 0.01231212356 0.01932189163 0.01481896964 0.007274746832 0.009396935028 0.006496395392 0.01536900409 0.009142550885 0.009482458245 0.01403239182 0.006959740273 0.01736270105 0.008749422611 0.01009317752 0.01056725433 0.01904478541 0.01104288035 0.005560490636 0.01397075902 0.0212956561 0.01414591826 0.02295189251 0.0162975949 0.01575321155 0.02744507086 0.006423779554 0.01291631636 0.03446749849 0.01825655772 0.02508844218 0.01128487186 0.01631496011 0.008771453743 0.01051176166 0.00959728308 0.01083795947 0.02079087744 0.008680430249 0.008994404349 0.03757347281 0.01190471382 0.01736580664 0.004635474028 0.0112417073 0.01340405708 0.032384216 0.02796704837 0.01426437769 Leucylproline 0.0482785334 0.1366956124 0.09646630554 0.1160769406 0.05871038346 0.07864625558 0.07689314928 0.07044766715 0.07366070126 0.0723363814 0.07683905326 0.0885099434 0.04563748044 0.08520461353 0.07135745265 0.04138315542 0.04284015626 0.06808693508 0.05508549744 0.09109562101 0.06421573481 0.0904793077 0.06045492319 0.05421330558 0.08394234787 0.0647371995 0.06005220827 0.05116874575 0.05690153458 0.06354339353 0.05717429376 0.0450489472 0.06494239465 0.04837246925 0.0833947886 0.07430223439 0.0400291612 0.07187108376 0.06176317254 0.0419216894 0.070257154 0.044193702 0.03995586901 0.06508440766 0.07983563517 0.09922086752 0.0591938143 0.07991918403 0.1087303605 0.1358696488 L-Histidine 0.01382370354 0.01263948035 0.01228923076 0.01678530243 0.009652532808 0.01249334813 0.02243515996 0.0333668629 0.006191372821 0.02342028204 0.05311721467 0.02784319471 0.01907047352 0.0180749579 0.02585684571 0.01626736834 0.02459251026 0.009978824923 0.01141969705 0.0153409648 0.01197442686 0.01792275534 0.0127725783 0.02045084802 0.02159457935 0.08826133209 0.01142668336 0.02262014515 0.03097112791 0.07620280661 0.03549651226 0.1937590516 0.008882089433 0.02602250348 0.08663231628 0.01162902969 0.01115387976 0.02442742307 0.03363462957 0.0136315204 0.05130131404 0.03450087029 0.08700690541 0.01490876914 0.01608821069 0.01785807739 0.02169884335 0.15691935 0.01020179854 0.02221048629 L-Isoleucine 0.9813203735 1.406436378 2.774473758 2.34256841 1.162279931 1.345864807 1.556984533 1.050751198 1.279661458 1.052056099 2.054889554 1.472463192 1.635981471 1.290478691 1.148634332 0.9492379231 0.7645200332 1.043098421 1.107438277 1.593723914 2.147045955 1.672020155 1.038941481 1.136536259 1.684816092 1.319233098 2.514662666 0.8017384108 0.7293397555 2.086290821 1.802044826 0.9998190421 0.7969535936 0.8885046129 1.14163164 1.868317989 0.8826254894 1.274244802 1.634617084 0.7680456822 1.080019675 0.8143977064 1.526810991 1.266231342 0.9204526433 0.8641916641 1.113535033 1.297451077 1.267275255 1.024817082 L-Kynurenine 0.02219649789 0.02614005215 0.05106844503 0.03528801235 0.03810585543 0.02897214348 0.03266570667 0.02745155229 0.02742208099 0.02378941864 0.03822273735 0.03361635512 0.0256793292 0.03492610553 0.01948437579 0.02133282048 0.02043668736 0.02056642664 0.02336611763 0.02440569407 0.03480845163 0.04869444501 0.02447808105 0.02138991964 0.03148146383 0.05419839954 0.02709444104 0.02213833054 0.02796942033 0.0247938157 0.02550886392 0.02728286011 0.02587128602 0.02286461801 0.0291640956 0.03902916915 0.02881608114 0.02401006533 0.02747546133 0.03572225683 0.02357407066 0.02168789672 0.04001191971 0.02205491408 0.03179858053 0.05717234892 0.01545517714 0.01641685964 0.04480405383 0.06400967718 L-Norleucine 2.303964027 3.051977028 5.70021685 4.437600565 2.342899617 3.082825626 3.624541585 2.595006259 2.660649659 2.792733106 4.512489166 3.239304146 4.55301467 2.887011603 2.511512381 2.47147711 1.974766452 2.806428197 2.36296315 3.524660578 4.054698394 3.573019698 2.625616808 2.706944349 3.503686386 3.256695396 5.374289158 1.905753399 1.914665231 3.39296941 3.90604066 2.046207406 2.281806344 1.969924329 2.547813852 4.093244494 1.943179564 2.749304495 3.262734483 1.979704385 2.460325514 2.335345191 3.040587751 3.02653363 2.229836759 2.353417081 2.63091482 3.205359999 2.439663745 2.220048595 L-Phenylalanine 1.62260681 1.551163337 2.675329521 1.769357045 1.707747107 2.739114982 2.447053931 2.021348404 2.432747727 1.734258864 3.009671432 2.402150213 2.387470869 2.084004048 1.365717122 1.647773592 1.66876416 1.736136069 1.809585385 1.707020243 2.249981697 2.423823582 1.570277825 1.959561775 1.99923047 1.769628074 2.286464295 1.089048318 1.310156561 1.501374848 2.053170209 1.124961485 1.859978882 1.456241177 1.389805237 2.278462553 1.375961757 1.847763473 1.709774678 1.368581662 1.283642381 1.603508726 1.996098676 1.814977387 1.768630047 1.259873442 1.385980753 1.23437708 1.820960042 1.422415253 L-Threonine 0.0776136825 0.04309740105 0.04112603596 0.04855111166 0.04296153013 0.04737531293 0.1125886906 0.06003406362 0.08369688531 0.03090042388 0.05550570996 0.04322785305 0.07197573056 0.06075131464 0.03712023902 0.04564300659 0.02674783562 0.02814767722 0.05495725992 0.05786529396 0.07479280584 0.0518603646 0.05912805991 0.1050334403 0.05819705631 0.06032914961 0.1056549968 0.07012202923 0.0568497814 0.08074523728 0.0993032739 0.1364895985 0.08727725984 0.07727108271 0.06458200184 0.07437159676 0.08128743792 0.04557356718 0.09316190717 0.05313863122 0.0628221685 0.07692354792 0.06500017914 0.09093738312 0.08605880373 0.07037937637 0.08279962655 0.06189491086 0.06331752992 0.06017236454 L-Tyrosine 0.7557529397 0.724466798 1.497893291 0.9337436488 0.7391712881 0.9297871098 1.081100233 0.8610925136 0.8672427377 0.6682572686 1.411094624 0.9072724316 0.9031314414 0.7466982497 0.5486289319 0.4860105859 0.4967445461 1.034478579 0.80395449 0.5377604043 1.254400473 0.8054485714 0.4916215868 0.8556755434 0.9851422671 0.8122478177 1.134972265 0.4111771527 0.5430859007 0.7669654188 1.056129232 0.5118108985 0.6065608009 0.7185016162 0.6924131215 0.892559797 0.6275145505 0.6835152434 0.8721696509 0.4362629431 0.4738175095 0.5545924688 0.751392609 0.9455237658 0.6910159725 0.4330748151 0.7169004464 0.5085965325 0.7310204402 0.5025155014 L-Tyrosine methyl ester 0.004750830729 0.0008982862395 0.01382007928 0.001786672661 0.001685832542 0.002958938858 0.005065906565 0.002531942684 0.002569009671 0.001525606163 0.002257934309 0.001660380201 0.002012722242 0.002171812239 0.001016484311 0.00006838840629 0.00006763181 0.00005125243474 0.001654707086 0.001741257086 0.006942892239 0.002145745239 0.0009086871494 0.01399440675 0.001991733713 0.007694064405 0.00535956568 0.003834584736 0.003385709282 0.004278997463 0.009239236626 0.004240917799 0.004562840302 0.002169170304 0.006370412188 0.00843411872 0.005807358384 0.002964460512 0.003768138334 0.002096721533 0.004692345645 0.003814688746 0.005932422834 0.00605774513 0.005324325039 0.003381851692 0.005416332496 0.008093946982 0.006009910763 0.007046276381 N8-Acetylspermidine 0.003357715882 0.005087663468 0.01330324128 0.004673782966 0.004155464361 0.004463914738 0.003721160038 0.002417874165 0.004308769218 0.003126523404 0.007656063016 0.004337320261 0.003279583876 0.004484899942 0.004244789263 0.001819498519 0.00325223402 0.004265740865 0.004559670987 0.00280893949 0.003851017409 0.008779317786 0.006034417151 0.006181561431 0.01322725899 0.0148428427 0.007501128086 0.0210604939 0.00668979542 0.007072768539 0.008234969604 0.008297184885 0.01873290232 0.01569390574 0.00751912912 0.01631123541 0.003170030541 0.006935316781 0.02561107164 0.009923815699 0.01399702276 0.006137184576 0.01872095557 0.007536963887 0.02096064632 0.01370781722 0.006943105582 0.0265109864 0.02805184057 0.00813314821 N-Acetyldopamine 0.01515269021 0.004048627748 0.01382007928 0.007003237456 0.007352336279 0.01078536218 0.01657032651 0.009582945379 0.009836996241 0.004798301434 0.007760979859 0.008415087168 0.007062862529 0.007951208817 0.003878707491 0.0004417401407 0.00008002441124 0.00005262328263 0.006765262413 0.005121497232 0.02104135364 0.005555759696 0.00338908574 0.01399440675 0.007837138344 0.0201813626 0.0134869224 0.01102230065 0.009824023243 0.01099182851 0.02420174313 0.01243822397 0.01356958927 0.007819660244 0.01647938132 0.02233162434 0.01599657542 0.008814050586 0.01110733105 0.004589846072 0.01203521505 0.008952767844 0.01385346726 0.01999829525 0.01694256284 0.01052069207 0.01517229494 0.01780192826 0.0149833958 0.01345870728 N-Acetyl-L-leucine 0.01770971311 0.01388148883 0.002045552219 0.003443195384 0.008752631131 0.003360608076 0.006170726731 0.009512660665 0.006469558507 0.004991638245 0.009103436104 0.00623785246 0.008911709057 0.009543559136 0.005053718421 0.01121888579 0.007274004894 0.003611282665 0.002531372658 0.007909838177 0.0665973378 0.04374165719 0.04638689946 0.09316411745 0.03166120823 0.01413459556 0.01825217942 0.02223704349 0.01878829193 0.03035478737 0.08588570092 0.06746292964 0.02736911388 0.03182422349 0.02255464609 0.06484178361 0.0578875427 0.0553331878 0.07579483719 0.1353870075 0.09714981977 0.03791225442 0.02625055708 0.05211300905 0.02983591503 0.03076997894 0.01264108019 0.02493379308 0.1069208424 0.05813491911 N-Acetylornithine 0.01754004538 0.009840046158 0.03047601276 0.003290662671 0.003747655053 0.003277587258 0.01947281726 0.005058322437 0.004713018812 0.001652946542 0.0003356592457 0.01453831392 0.004005995427 0.005945796858 0.002532910071 0.007968005496 0.01042804612 0.006235270744 0.00434785695 0.005929941298 0.01588103924 0.0009742203228 0.01074938604 0.02096986009 0.00317729958 0.03233680081 0.01383885842 0.03864735442 0.0192666451 0.008994332922 0.02831236684 0.04241670754 0.03845369561 0.00428724343 0.03110639598 0.0281228859 0.02185418842 0.01055853218 0.01035475732 0.004282535859 0.02145626323 0.03221855331 0.02020293192 0.02521106626 0.03119730311 0.02857146156 0.05415739417 0.05188590233 0.01484078861 0.03151592786 N-Acetylserotonin 0.009690350737 0.002077039201 0.005782702717 0.003975764773 0.003535256476 0.006628829859 0.01201282139 0.005429804267 0.005606787758 0.003718974336 0.003441288382 0.003443359636 0.005378348432 0.006139534172 0.002668103861 0.0002233380179 0.00008217330292 0.00006904789177 0.00296845894 0.004574993955 0.0157414574 0.004106764028 0.003451132235 0.007056878834 0.003963862008 0.01227052796 0.007207886799 0.006614873596 0.006304012545 0.005563255552 0.01231492088 0.008661259178 0.004355917876 0.003238788713 0.008307642517 0.01523199219 0.009037852412 0.006959598862 0.007312968431 0.003682454113 0.009524860737 0.00573420292 0.006181650334 0.004907202887 0.01199126599 0.008887735869 0.007453042596 0.01455600526 0.008837613453 0.01451668353 Nicotinic acid 0.0003229456692 0.0002319602755 0.0002494800136 0.0002574595487 0.000192852 0.0002757697326 0.0002651806633 0.0004549263447 0.0003040134774 0.0002943046167 0.0002286219947 0.0002011871016 0.0004014266881 0.0002347941525 0.0004914631529 0.0003976638226 0.0001900449711 0.0001887277996 0.0002206408103 0.0002568903153 0.0002865957472 0.0002698422775 0.0002217651065 0.0003169015856 0.01285332401 0.03745731187 0.003838872864 0.07666473767 0.06478368584 0.0003240947838 0.01525512589 0.08571679517 0.006358969019 0.002884238572 0.08678474154 0.003192812205 0.08880029062 0.001154866686 0.009125778404 0.006621011712 0.06343195177 0.006697141524 0.04994956116 0.1425765168 0.1173323207 0.2905032198 0.00688774132 0.04890337648 0.03295104605 0.06832513153 Nicotinuric acid 0.06767439331 0.07102785906 0.06904184561 0.07103860325 0.07593416042 0.0774004865 0.09164546458 0.07795883933 0.07259817236 0.07392603127 0.07665381884 0.07738997803 0.07385284752 0.08162779924 0.07247706627 0.07606098789 0.07455734572 0.08186049315 0.07070423337 0.06945055411 0.07213176477 0.06895116776 0.07169658515 0.06822139448 0.07811909921 0.06925784861 0.07463746885 0.07719853767 0.0677101199 0.07005805649 0.04705158813 0.07380485116 0.07419463523 0.07631114099 0.07153525289 0.07846718087 0.07301361832 0.07445625715 0.0770169212 0.08170796037 0.07570652382 0.07761796252 0.0639450145 0.07199750632 0.07036026506 0.07190976175 0.07226224215 0.07074648609 0.07067091452 0.0746169442 N-Phenylacetylglutamine 0.006514895331 0.01395669842 0.02812197312 0.009502216116 0.04813851919 0.02438447307 0.02100642449 0.05010052229 0.05306756291 0.01446093402 0.01211042602 0.04997020894 0.03601669251 0.05582895613 0.0222932434 0.02746808414 0.02907378999 0.01552671966 0.02667434617 0.01661253152 0.02972578066 0.0762026799 0.006984385794 0.05004242217 0.01379837195 0.005181853075 0.03059910562 0.04645155412 0.03488735451 0.0143151766 0.003166740832 0.0218365013 0.01145571004 0.01805824267 0.02093157594 0.009443232822 0.03742023581 0.01257401326 0.003608020187 0.009488038716 0.02888772736 0.01095228444 0.02340125946 0.009853625779 0.01193938636 0.01069145625 0.02785506893 0.04057077052 0.09530438799 0.3180328182 Oleamide 2.36552155 2.925960705 2.756306438 2.667310761 2.431193211 0.8450399863 1.658376858 1.310798617 1.90821862 1.272168124 2.536058544 0.9317087601 4.107011171 2.434257617 1.944084428 3.680977268 3.017350135 3.673745554 1.774570285 2.081303112 3.538031054 2.623226762 3.692273842 5.469197085 0.9556136607 1.139974754 1.682664791 0.9557166847 2.39955485 3.756850407 8.271147392 4.985602729 4.381625933 3.234786471 4.325798342 3.156147268 1.60947682 3.083780069 4.121109182 1.228379623 3.421311837 2.502490343 2.691015901 3.10855917 6.768281762 1.280976 2.572362745 2.746047614 2.190785628 1.128160831 Palmitoylcarnitine 0.01343233922 0.03853896474 0.0214808358 0.03659234187 0.05323090794 0.005421109148 0.01287622689 0.004293666234 0.01553697628 0.01119716556 0.009192718363 0.005330601315 0.02266457426 0.009785088802 0.0262367846 0.01902966286 0.01943463776 0.0286928721 0.01946360355 0.02316605201 0.02004685651 0.0159524914 0.0200813348 0.01438267977 0.006094314709 0.01363307752 0.02701055482 0.006310767968 0.01126858839 0.03241559169 0.02367517007 0.02245146189 0.02072931263 0.03979285474 0.0233772301 0.02375275942 0.01057604364 0.03051411097 0.03010099526 0.008290140563 0.03489884621 0.03518435241 0.0251967005 0.01990490518 0.02739005426 0.01811070207 0.01833716265 0.02485092415 0.01712208524 0.01163353287 Piperine 0.001759726262 0.001827985854 0.007328835501 0.003152502638 0.001524326928 0.001831350553 0.001000569745 0.00324768818 0.007493919861 0.0001929638125 0.004713606619 0.0001368510925 0.001576092387 0.005584963926 0.0231084511 0.0077492758 0.005048440919 0.005267072657 0.0001532205853 0.005036297054 0.003277593696 0.000180827146 0.0001700852124 0.003523370198 0.0001259026021 0.0001834017448 0.0001748376182 0.0001375664859 0.000176130567 0.002200579651 0.0004575313353 0.0006686145251 0.00170311528 0.001246109628 0.001129959498 0.0001344188182 0.002190211887 0.002356143516 0.004233533957 0.002441182903 0.0001502199196 0.000193528928 0.04070658016 0.005257917107 0.0001824502736 0.002345225976 0.005000733535 0.0001421542093 0.0001965193391 0.0001306177605 Pyridoxine 0.003175752477 0.004292983284 0.004514312532 0.00477870834 0.002897342784 0.003893667742 0.003626004274 0.005213873608 0.004380292473 0.005308335831 0.003010003136 0.004026142615 0.002269754674 0.004990968337 0.002913596316 0.003197992587 0.004819450016 0.001945717327 0.002099473209 0.001972582158 0.003329632787 0.004923755277 0.003761755997 0.00152536157 0.004654756517 0.001419420798 0.00120698769 0.001893308908 0.001656308263 0.004456169733 0.003556401326 0.001937652643 0.001490498973 0.004026888056 0.004106026912 0.002693824454 0.002480211751 0.00313006346 0.003647856968 0.002480486503 0.002830477404 0.001480304128 0.002100185934 0.002691154755 0.003219545057 0.003060890129 0.002118076948 0.001483892726 0.001501066534 0.001834828006 trans-3-Indoleacrylic acid 0.4436457393 0.4729380408 0.7524628069 0.5873409906 0.4455254052 0.6893900478 0.8121371567 0.5935916466 0.5412861673 0.528546575 0.6928011045 0.5545501208 0.6850234505 0.6379240112 0.4419963654 0.5153510567 0.488376508 0.553251211 0.4429533419 0.4743028352 0.7971451326 0.5393628265 0.5283551916 0.4627198158 0.6462597329 0.4015047545 0.507634295 0.2731214492 0.3258583315 0.3330621713 0.4712971081 0.3470437442 0.1877542232 0.3130425617 0.334967727 0.5544322317 0.3535427954 0.5057386978 0.5190209759 0.358075344 0.3665352931 0.2868709925 0.2762160656 0.3665555021 0.4857695045 0.3654407291 0.3200449599 0.3551461026 0.3946911582 0.3540833356 Trigonelline 0.1858992358 0.4619438114 0.01568549211 0.07146217538 0.1193263071 0.01192922638 0.005399295076 0.1038118134 0.2098043093 0.09439476043 0.04723205983 0.008257946875 0.07389691976 0.01938613042 0.008957058028 0.01786833674 0.09948723307 0.09804431299 0.05122310284 0.0374093729 0.02159522681 0.03610738705 0.07124687734 0.1303519599 0.01908694845 0.04318414729 0.01160666318 0.06288894948 0.1222404376 0.009703003155 0.02944666902 0.0333384507 0.002351925922 0.001809462679 0.06219128632 0.02674364993 0.09394354808 0.03374945992 0.01759903238 0.002146428388 0.007214237134 0.01329844859 0.01784590452 0.009514423116 0.01025315143 0.1049099185 0.0165820039 0.0596674276 0.009116764032 0.1035760287 Uric acid 0.009464133134 0.07887595653 0.01947892388 0.07750882864 0.01399148206 0.01875583273 0.01604347579 0.01556493474 0.01831360619 0.1641858298 0.04761220367 0.0501768748 0.02076306561 0.04399290219 0.1355083318 0.2477077824 0.3615591273 0.2986537146 0.0112480735 0.04626943128 0.02063672375 0.02268563877 0.01758083884 0.003921827173 0.2820300394 0.03002399907 0.01679083939 0.04544566268 0.03137008166 0.08958021247 0.02613493799 0.03799135065 0.04964386266 0.1560468817 0.03614998024 0.0538711522 0.01772512831 0.05885315476 0.1529126102 0.05141552796 0.05007401811 0.2261632549 0.02945725575 0.03484625043 0.07560823458 0.03143327822 0.04187529652 0.02649255646 0.007366409693 0.0295945602 Urocanic acid 0.003978519617 0.002677719899 0.004895440699 0.0009795803531 0.01003662774 0.004307957276 0.008135072474 0.005315961466 0.008492679368 0.003340176519 0.004158618362 0.00476357124 0.003945557435 0.003145266424 0.002659662067 0.004135833303 0.003644767658 0.002914123554 0.006738842855 0.02884551432 0.005210916445 0.005067009974 0.003993551808 0.006731504547 0.008140779518 0.004780363294 0.004390737319 0.007419950025 0.006310137825 0.004697987417 0.003333659873 0.004204174723 0.004768913314 0.008982510151 0.006070956811 0.006692095521 0.01072940114 0.01377502366 0.01867499105 0.0274479947 0.001292189953 0.009090063119 0.002955488758 0.002401577346 0.01310096242 0.009866238692 0.02741959297 0.003585264584 0.00576922391 0.004217053596 Valine 0.08384863497 0.1148354814 0.1053064958 0.1104260591 0.10500649 0.1248834523 0.08741382341 0.07101106298 0.0366559125 0.1515865891 0.1187302062 0.09889700751 0.08581416344 0.1802376634 0.07604511252 0.1007783045 0.1537473486 0.1613570738 0.06458724293 0.1100363221 0.05250230442 0.1467689942 0.1459399814 0.06244497161 0.1660673114 0.08416425429 0.1662834177 0.06629761204 0.09348186039 0.07210104879 0.1231238635 0.06178377276 0.03640789327 0.06087544672 0.1100648923 0.0918982155 0.1021961505 0.1185230917 0.1153977327 0.06056979876 0.2063571968 0.1095895713 0.09399232347 0.1680298481 0.05999650485 0.1595538153 0.1573528407 0.05785602823 0.1045085404 0.06588923539 α-Aspartylphenylalanine 0.0026663656 0.003929412044 0.001032562848 0.005778390061 0.002552509241 0.003748115845 0.01931475151 0.01204730216 0.009132762941 0.01179902403 0.01620893757 0.04646463847 0.0248571887 0.01387711288 0.004010739868 0.02259276021 0.03119143652 0.02400481705 0.01178365007 0.006282301481 0.01693158129 0.04321839195 0.02873226306 0.02084662041 0.005376012685 0.002648488987 0.002756743756 0.00548874911 0.01762854245 0.04551116808 0.02137695999 0.01117100729 0.03309355198 0.006079450245 0.02007000413 0.01473630508 0.01455989775 0.02384369426 0.009205076453 0.01580195046 0.03187385237 0.04433190841 0.00487870194 0.01652949061 0.006749231635 0.01079811617 0.01551794737 0.007929918591 0.02084063716 0.009822883023 β-Alanine 0.07669140195 0.07247202514 0.08871872791 0.1077548711 0.08902698319 0.10355941 0.07960410989 0.07320370044 0.0859355028 0.06383502032 0.08013787721 0.1344604254 0.05925615507 0.05535719968 0.05426395574 0.05307677977 0.05313292794 0.0624503714 0.07726094957 0.05430268399 0.07685649879 0.08303378461 0.07928674623 0.1018689818 0.09110637668 0.05397161395 0.07402351831 0.0637099719 0.04498005084 0.1292790994 0.0752356105 0.09035683256 0.06900523229 0.04887155752 0.105110752 0.05148544016 0.0556338351 0.05171582248 0.09434895247 0.04857686464 0.04569905879 0.07339578741 0.07491747339 0.06395389285 0.05005483642 0.05637704744 0.05814900541 0.0431892308 0.07136513048 0.05539590096 metabolite_name Molecular Weight RT [min] PubChem KEGG 1-Methylhistidine 169.08497 0.883 92105 C01152 2-Hydroxycinnamic acid 164.04726 1.949 637540 C01772 2-Oxindole 133.05281 6.695 321710 C12312 3-Phenylpropionitrile 131.07346 5.927 12581 NA 4-Acetamidobutanoic acid 145.07383 1.673 18189 C02946 4-Guanidinobutyric acid 145.08503 1.189 500 C01035 4-Hydroxybenzaldehyde 122.03668 1.95 126 C00633 4-Pyridoxic acid 183.05329 3.068 6723 C00847 5-Aminovaleric acid 117.07882 1.173 138 C00431 8-Hydroxyquinoline 145.05271 5.886 124490106 C19434 9-Methyluric acid 182.04401 1.877 108714 NA Acetylcholine 145.11019 0.954 6060 C01996 Acetyl-L-carnitine 203.11572 1.241 7045767 C02571 Bilirubin 584.26258 16.827 5280352 C00486 Choline 103.09956 0.887 305 C00114 Cortisol 362.20895 8.457 657311 C00735 Creatine 131.06935 0.959 586 C00300 Creatinine 113.05881 0.96 588 C00791 D-(+)-Pipecolinic acid 129.07887 1.19 736316 NA D-(+)-Proline 115.0632 0.969 4025 C00763 D-(+)-Pyroglutamic Acid 129.04251 1.591 7405 C01879 Decanoylcarnitine 315.2409 9.713 10245190 C03299 D-Erythro-sphingosine 1-phosphate 379.24839 11.603 5283560 C06124 DL-Arginine 174.11151 0.882 6322 C00062 DL-Carnitine 161.10501 0.906 10917 C00318 DL-Glutamine 146.06903 0.977 5961 C00064 DL-Lysine 146.10545 0.794 5962 C00047 DL-Stachydrine 143.09453 0.989 12358 C10172 DL-Tryptophan 204.08985 5.885 9060 C00525 DL-α-Aminocaprylic acid 159.12584 4.202 69522 NA D-Sphingosine 299.2824 11.53 3613 C00319 Hexadecanamide 255.25612 15.329 69421 NA Hexanoylcarnitine 259.17839 7.282 6426853 NA Hippuric acid 179.05812 6.479 464 C01586 Hypoglycin A 141.079 5.503 9081 C08287 Hypoxanthine 136.03845 1.288 790 C00262 Indole-3-acetic acid 175.06326 8.089 802 C00954 Inosine 268.08062 3.303 6021 C00294 L(-)-Carnitine 161.10504 1.019 3612 C00318 L-(-)-Methionine 149.051 1.327 6137 C00073 L(+)-Ornithine 132.0898 0.794 3377 C00077 Leucylproline 228.14729 1.394 80817 NA L-Histidine 155.06939 0.868 6274 C00135 L-Isoleucine 131.09452 2.087 6306 C00407 L-Kynurenine 208.08477 4.561 161166 C00328 L-Norleucine 131.09451 2.313 21236 C01933 L-Phenylalanine 165.07888 4.801 6140 C00079 L-Threonine 119.05811 0.896 6288 C00188 L-Tyrosine 181.0738 1.949 6057 C00082 L-Tyrosine methyl ester 195.08962 5.477 70652 C03404 N8-Acetylspermidine 187.16837 0.876 123689 C01029 N-Acetyldopamine 195.08949 5.679 100526 NA N-Acetyl-L-leucine 173.10515 6.22 70912 C02710 N-Acetylornithine 174.10032 0.965 439232 C00437 N-Acetylserotonin 218.10555 6.774 903 C00978 Nicotinic acid 123.03192 1.026 938 C00253 Nicotinuric acid 180.05332 5.332 68499 C05380 N-Phenylacetylglutamine 264.11097 6.513 306137 C04148 Oleamide 281.27187 15.451 5283387 C19670 Palmitoylcarnitine 399.33446 12.6 11953816 C02990 Piperine 285.13645 11.094 638024 C03882 Pyridoxine 169.07381 5.428 1054 C00314 trans-3-Indoleacrylic acid 187.06321 5.885 5375048 C21283 Trigonelline 137.04759 0.956 5570 C01004 Uric acid 168.0282 1.209 1175 C00366 Urocanic acid 138.04282 1.552 736715 C00785 Valine 117.07878 1.283 6287 C00183 α-Aspartylphenylalanine 280.10585 5.961 93078 NA β-Alanine 89.04759 0.891 239 C00099