Metabolite_name RefMet_name NYSM-00454 NYSM-00455 NYSM-00456 NYSM-00457 NYSM-00458 NYSM-00459 NYSM-00460 NYSM-00461 NYSM-00462 NYSM-00463 NYSM-00469 NYSM-00470 NYSM-00471 NYSM-00472 NYSM-00475 NYSM-00476 NYSM-00477 NYSM-00478 NYSM-00479 NYSM-00480 NYSM-00481 NYSM-00482 NYSM-00483 NYSM-00484 NYSM-00492 NYSM-00493 NYSM-00494 NYSM-00495 NYSM-00496 NYSM-00497 NYSM-00498 NYSM-00464 NYSM-00465 NYSM-00466 NYSM-00467 NYSM-00468 NYSM-00473 NYSM-00474 NYSM-00485 NYSM-00486 NYSM-00487 NYSM-00488 NYSM-00489 NYSM-00490 NYSM-00491 NYSM-00499 NYSM-00500 NYSM-00501 NYSM-00502 NYSM-00503 NYSM-00504 NYSM-00505 Factors - Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:naive Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained Treatment:trained 4-cholesten-3-one Cholestenone 3211708 4456898 3269682 4300605 3472629 2849761 3701102 3209076 2897754 3487989 2621689 4015664 5969067 4072389 4257295 4852517 4604875 5265593 5064049 4380703 3827748 4409735 4272740 3692248 3446047 2907661 2577000 2489970 2605710 3044434 2653662 5943314 6490700 5048726 5940596 4818718 4217837 2778908 3235085 3794311 4793992 3702733 5450625 5365046 5019428 2891134 2151612 2975966 2070260 3078841 2767764 2719361 7-hydroxycholesterol (alpha or beta) 7beta-Hydroxycholesterol 4498821 4649351 4500949 4878527 4074568 5070361 5758236 5490840 3886398 5287622 1995749 8980217 8769053 9981293 7321893 9082896 8765602 5900842 4943578 5201210 6177129 5958550 5403047 4482943 5091186 3921746 4934017 4751172 4256565 4518300 4566114 11201901 11276565 9873481 8752412 10488086 8447888 4729518 5057583 5442931 5873915 5619437 5141908 5727002 5127440 4901299 4585085 4531196 4507544 4046400 3725728 4215398 adrenoylcarnitine (C22:4) CAR 22:4 128763 147445 86408 218367 242546 154125 79856 176662 283412 207868 252561 217621 211140 154686 169228 353377 396700 272970 221755 316520 269833 166377 320987 255343 229035 371301 188420 285673 143897 143000 205734 110354 204133 168933 265884 185398 295152 801204 355810 276673 293318 260875 196113 248150 198312 442773 455950 310843 330481 343394 alpha-tocopherol alpha-Tocopherol 315831 1163088 731524 1635772 1318770 4625744 4427907 3139147 3978524 4741501 20144144 4884903 6116152 4008669 7314577 6088243 3703369 34148408 26171952 42700964 31784340 39002408 32223810 27061298 66522040 70232408 61950408 59553240 54678440 68875024 68681728 3109462 2551352 487748 3707643 1219952 7763009 15694491 36584892 43248608 44560476 32206370 31668050 34068288 34398664 63561008 57687776 76397008 72983648 71211024 62512940 78640992 arachidonoylcarnitine (C20:4) CAR 20:4 218565 199329 127836 334700 179850 854189 1129426 756946 865454 772260 6465661 4352386 4554693 3804259 3392803 2794230 3257394 6344807 5781177 6008865 5681309 6146673 4923415 4645101 4450257 2915999 3478869 3524390 3294029 3286166 3274799 2234566 3769018 1976836 3186983 3142444 5058757 3693590 5988787 8602508 7192269 5481993 5045311 5628511 5058992 2791753 3361183 4955125 5060747 3848452 4474066 4813654 arachidonoyl ethanolamide Arachidonoyl-EA 61566 263122 248252 264316 236182 249578 199697 206739 271398 215093 222219 179545 190243 199717 251550 53584 65338 186292 242555 263172 210033 196810 226401 251145 179841 206042 228968 234505 247413 188856 250589 arachidoylcarnitine (C20) CAR 20:0 59867 81291 134014 96668 59176 96968 286261 346366 390921 228822 297432 336385 298969 691377 619909 747334 669062 721871 476320 358232 601845 472501 423216 392106 325246 432831 436761 332122 315802 201463 280311 239905 317529 366962 491671 704534 725885 684767 528581 632791 771045 501868 458663 688070 775524 500897 503760 735042 behenoylcarnitine (C22) CAR 22:0 62144 95056 101541 77402 66333 109891 107272 135334 196077 158644 158706 106408 95945 96365 62621 74842 72723 56963 63145 70198 61611 50986 77778 114587 128539 147500 133085 110020 146707 196785 57143 50791 83522 82054 88159 beta-sitosterol Sitosterol 184067 193929 141786 100429 64476 324361 309866 190888 184500 175431 342665 166894 90877 122828 99049 98940 95497 249516 526380 494404 458152 343450 394000 campesterol Campesterol 63444 76688 142424 350480 282558 295688 322468 326069 160579 93836 741837 694586 388914 369150 501589 633286 316837 146186 228504 84971 335517 497028 1110741 919889 819576 482011 878902 cholesterol Cholesterol 204420096 276607936 195594688 299098144 195074464 344882624 344528416 272699584 262449920 322223808 823515392 928355712 946070720 820419776 997578752 1037254912 1012869696 1749764736 1723818880 1846899968 1938672000 2019728640 1640624128 1439289856 1831814144 1619842304 1640586624 1526636544 1405345280 1599429888 1946335744 909319424 970230592 647818752 791079808 720971584 895151232 948333312 1484849024 1695802880 1738312064 1751257856 1911876480 2003759104 1978695296 1765950336 1741633280 1808657920 1915934208 1746036864 1619056640 2076751104 desmosterol Desmosterol 60757680 80546248 55958120 87442312 57466984 129784776 132782032 99391248 97040296 116239360 51877424 56543580 57040088 61364112 67089544 71458584 57222420 35259652 34697624 38056208 38801920 43939984 31984952 26659210 29491542 23698354 19034260 18427720 17868856 27116288 29273472 55284120 66167548 54170032 61198024 45257948 59396252 68641472 29281092 31124166 28397348 33828376 35739736 43377996 38544616 21777400 22724026 26324122 28415266 27563076 26416584 27950624 dihomo-linolenoylcarnitine (20:3n3 or 6) CAR 20:3 98755 254574 320560 234289 207266 170269 385160 317259 317041 273608 273523 273389 222651 345099 326495 289788 321365 356534 360720 237333 179371 159667 166172 143580 106850 120226 54175 216530 258798 178773 228895 261024 384897 295932 314691 517388 424590 334423 286859 252929 275922 185192 133522 224133 244664 168011 151504 155278 dihomo-linoleoylcarnitine (C20:2) CAR 20:2 78210 64063 172257 253782 111277 90427 153192 328082 234941 453270 248656 285824 395108 288374 431625 337297 313656 287124 338131 277735 237495 311633 230630 313813 214788 247711 249652 282681 257368 304281 196383 319654 209821 317738 347232 298941 531705 380959 292438 272002 267019 277019 308294 243176 401572 489181 309960 345334 349425 docosahexaenoylcarnitine (C22:6) CAR 22:6 139887 195660 106553 135200 124864 230794 149581 233927 152698 221822 200432 238326 243191 266830 378034 277918 344155 242258 238396 97846 79563 102440 79759 65357 99346 110311 199843 268536 129901 214700 169467 183870 210627 230213 298739 363703 255085 265104 306098 386973 87515 147461 108302 102202 104619 170702 eicosanoylsphingosine (d20:1) C20 Sphingosine 180370 311115 167189 291260 173305 284369 344942 280055 184267 297385 2453218 2697158 2664558 2370815 2735111 2569048 2589260 4680889 5292946 5125403 5592203 5369547 4613125 4402378 6092228 4985568 5245805 5162696 4688709 4753409 5545046 2490008 2781734 1891757 2081970 1935151 2374798 2423995 5181887 4891353 5083467 4880786 4827973 5621177 4893987 4200342 3825551 6351500 5539752 5571302 4843467 5272626 eicosenoylcarnitine (C20:1) CAR 20:1 135187 142390 86599 157756 82838 221067 258423 133654 145177 176142 466985 363552 482005 332805 352427 399919 311770 1061814 942716 953837 915587 1181784 795953 704722 1154749 935796 875962 968385 904159 949142 870262 317822 473281 289865 373471 316874 396017 347801 931912 1635110 1004838 949431 828889 806154 1013289 1376699 1005847 1553858 1528876 1102152 993803 1327097 gamma-tocopherol/beta-tocopherol beta-tocopherol 162461 68863 223873 141279 84351 89547 89039 558661 238576 188721 79145 250647 268828 145924 848542 679147 922652 690436 841081 772305 788790 320293 405533 326797 242950 344464 382507 549312 133305 145283 218983 539161 757172 826729 864285 654502 863816 829128 771398 422354 518884 243163 364711 460719 445956 409492 heme Heme 125638 402968 260300 729574 158535 1044469 148164 685884 1228659 3139038 1571488 1892757 1439734 1375013 2056183 3192604 1359145 2398143 1922019 2119884 2617324 100932 265356 1718537 1428787 1507214 777452 2104184 2071911 797344 1206961 2548625 2615684 1775746 2108746 1584731 1883221 laurylcarnitine (C12) CAR 12:0 492034 909668 888353 897803 955584 949589 890563 786836 696746 1126554 773321 720275 855898 508626 604080 575255 616583 620441 467842 483562 712595 1107340 992609 1030533 969548 824749 731122 871527 715209 1125482 746500 806092 570579 791695 567937 692953 661763 878394 916466 675307 537213 1066075 lignoceroylcarnitine (C24) CAR 24:0 80459 84592 79680 200815 189567 180754 194300 190573 152261 191071 202820 222175 235285 271903 265789 258300 151111 124046 83510 124577 88969 106872 86031 107463 215038 206728 146781 131409 134489 167604 208551 281585 296574 295001 205433 245049 217157 81390 147981 141042 127688 127814 68230 165355 linoleoylcarnitine (C18:2) CAR 18:2 62406 91616 53283 505278 647217 416625 434218 481320 838491 845135 971751 854969 948223 1174928 812493 809212 647174 948632 739310 802935 768663 530408 555023 588662 674511 518310 669042 486003 583415 1025498 1124056 944197 1176961 766437 850617 985734 655506 1013044 969220 782967 829406 761401 693903 718785 651560 828100 979928 596281 673058 719062 myristoleoylcarnitine (C14:1) CAR 14:1 443650 603979 599991 615188 482059 625754 507202 1084556 1027234 1519696 1041808 1059566 1633446 481482 834893 793483 935257 939632 730503 659719 980557 817092 563054 745008 651268 583766 445614 457371 836407 1897351 1164179 1281051 773184 1118955 807845 1334859 1024771 1400010 1689546 951916 796276 1961301 myristoylcarnitine (C14) CAR 14:0 389854 528480 333496 544767 330529 1894256 2072435 1446854 1697018 1845969 6547786 8407923 9437148 7380290 7922543 9666259 7255843 10468633 10435148 14319574 9490670 11390568 9393650 6533419 7153115 6786629 7170801 7495250 6231683 5989759 7702065 9041811 9091595 7196747 8794303 9944496 7368137 7701323 9933443 11507041 10286186 10806685 9478564 9948650 10390676 8311762 7389608 10268674 10737062 9175250 7728509 11099856 oleoylcarnitine (C18:1) CAR 18:1 1168825 1456548 987817 1628103 1072746 3231868 3614525 2772650 2686444 3149748 8178712 7308551 9947136 7522918 6640469 7992119 6619888 18866990 19289420 21253278 17310024 21452050 17487258 13323297 18301572 17311104 17778572 16373313 17035476 15491222 18600856 8095963 9033628 6238960 9034384 7860132 7943297 7101913 15329245 22675612 20469024 18433714 18246212 16441954 17947952 24325670 17878700 23352200 25673508 19588174 19515544 23884572 oleoylcholine Oleoylcholine 59991 72364 69464 85163 84097 175950 217228 176152 107029 184931 122759 88303 72622 100058 113134 126472 89179 120013 177451 126982 133777 135429 155896 145901 71459 96631 135583 84473 96700 99775 palmitoleoylcarnitine (C16:1) CAR 16:1 143950 210448 146916 223370 136935 660224 723725 524620 515394 644586 2332123 2643264 2878431 2443142 2433344 2994795 2236346 5156438 5159445 7109398 4412540 5360894 5483650 2858091 4479457 4939727 5250789 5037723 4558802 4026926 5416584 3176638 2783628 2473954 2599371 3156982 2387644 2077023 4378121 6476435 4934941 5378563 4523693 4417610 4631680 6948691 5291678 7096378 7733119 5817755 5397950 7408024 palmitoleoyl ethanolamide Palmitoleoyl-EA 68688 76275 78078 148346 140418 161211 158511 162257 160500 200819 162520 154617 125592 120237 189890 170503 69476 48120 109264 82359 164710 95761 154276 152635 234726 216132 196468 181652 133942 181862 177664 180681 palmitoylcarnitine (C16) CAR 16:0 1619422 2178460 1692101 2324361 1750113 6415002 7028104 4591006 5232826 6169324 11116556 10722375 13541191 11817592 10955579 11726501 10744567 19587590 19925568 21168940 17465576 21982252 16593174 13696371 22856702 21895268 22828200 22055982 21356840 18243412 23721620 10916128 12859952 9645522 11626437 11030187 11265610 11419050 17661382 22046196 21831462 18099656 16536162 16205152 18693024 26442284 22030872 27535344 31019480 25558328 24581610 28589344 palmitoylcholine Palmitoylcholine 85379 104942 95885 131630 110792 158911 135650 133532 94392 127531 162404 197152 169169 257372 221019 215270 214195 243743 218354 203664 180097 121335 173066 111827 156234 120842 145552 174296 166386 149108 177410 128994 166836 129586 145033 319476 276369 196474 209568 216606 215588 160611 165825 200179 193951 186282 210806 149908 phytosphingosine Phytosphingosine 50830 57102 122548 137245 202928 139106 121650 208596 138752 435337 392082 280873 301936 470419 403845 221624 379603 320268 257019 220986 251398 335705 366882 186283 224494 163985 211008 130269 187443 194212 258487 344147 521344 350962 479037 375178 336308 278075 251837 315734 254324 356463 297286 356647 spermine Spermine 3432509 4820369 3196432 6861619 3293166 5795220 5843293 6600314 3945675 8759572 5864876 10403364 15798954 10158403 7947245 12223480 9162985 20050708 10885265 12844095 15395257 15333501 20524076 7424707 6081962 4490708 6918992 8264356 5512506 7887929 9904267 11058594 11751450 10412639 12528872 4271202 18578172 14618874 16652086 13072356 24164486 11962086 20854380 14300541 10623835 5169754 7054180 6799001 8988681 8398368 5963910 9371114 sphingadienine Sphingadienine 601394 934126 452218 858839 890867 2352432 2517433 1882021 1917805 1870976 7686679 7216007 6446104 5778941 5486886 6568094 6966426 9974286 10007809 10445089 11838272 11565234 9834260 9185222 10694912 9722688 8269115 8258014 8136424 9866032 9939914 6822925 7183465 4686300 6447284 4962330 5754505 5895946 8653656 10474173 9831206 10448223 11468848 12238511 11854484 8468741 8297483 11574938 9529885 9925611 10015092 9488773 sphinganine Sphinganine 1137319 1322003 893720 1108108 1066407 2025165 2322057 1807289 1781107 1794626 4769049 4883285 4774178 4544680 4718981 5302457 5020268 11072787 11205787 12247286 12368618 14909725 11106180 9956567 7695248 6618410 6491330 5784011 5422009 6811601 8349347 4258275 5484165 4093887 4317862 4524711 4656913 5257194 9999166 10333158 11991347 11674608 11569046 13152699 12750562 7403006 7054472 8495431 8590875 6310548 6648618 9073515 sphingosine Sphingosine 1707233 2748935 1873741 2702791 1883558 2884718 2900820 2348369 2445224 2794371 9741177 9893330 10350397 8384515 9470052 10331694 10756237 22974984 22057172 23693696 25069956 26855138 21911682 18704780 29878864 27300348 24711690 24413160 22226608 26124094 30051202 10071697 10817770 8196835 9593248 7786671 9672364 10017326 20490974 23002196 23501890 24210604 22283128 24432050 24635856 26746396 26295984 31446358 31309076 26359610 26258112 30543438 sphingosine 1-phosphate Sphingosine 1-phosphate 65478 76269 101498 84948 88218 108339 107347 103630 97480 127652 118920 298203 278268 302184 310552 303137 365298 362903 80933 117319 63236 72684 80397 73865 76505 155394 98602 87919 541316 397013 448389 490303 408942 357264 527800 stearoylcarnitine (C18) CAR 18:0 1738522 2294673 1616017 2304212 1713864 4843071 5723648 3573316 3812673 4175373 9871338 8270551 10359377 7734246 8389924 8998233 7393167 19076068 16008650 16543380 13953759 18695176 11824510 10552544 15088496 12042021 12044009 12380737 12241679 11223893 12594729 7178162 10037380 6169378 7434142 7622536 9096299 8338951 16016410 23487488 18874336 15172426 12710265 12468036 14016945 13734777 12767719 15342295 18785464 15572188 14560223 16091215 stearoyl ethanolamide Stearoyl-EA 190859 329467 240962 318264 298746 325870 275644 246419 242111 330600 387347 324334 422323 291661 429622 411730 374978 1423696 1293546 1427434 1257843 1516015 1111120 903997 1905552 1181113 1096674 982266 1013486 1150503 1402819 357854 395462 277378 382606 314102 406859 363823 1051676 1278642 1592279 1085787 1357412 1213903 1475137 1312420 1265727 1502837 1407337 1340667 1141831 1614854