Metabolite_name RefMet_name S00019331 S00019332 S00019333 S00019334 S00019335 S00019336 S00019337 S00019338 S00019339 S00019340 S00019341 S00019342 Factors - Timepoint:0hr Timepoint:0hr Timepoint:0hr Timepoint:0hr Timepoint:1hr Timepoint:1hr Timepoint:1hr Timepoint:1hr Timepoint:24hr Timepoint:24hr Timepoint:24hr Timepoint:24hr 18:0 LYSO-PE (M-H)- LPE 18:0 601806 74361 168181 349344 48286 380019 231574 204170 146635 145695 286622 143590 1-OLEOYL-RAC-GLYCEROL (M+HCOO)- MG 18:1 10796 2845 8839 8538 11690 6826 6167 4426 3176 2140 3028 2116 2-DEOXY-D-GLUCOSE (M+CL)- 2-Deoxy-glucose 170154 150944 54532 2-HYDROXY-3-METHYLBUTYRIC ACID (M-H)- 2-Hydroxy-3-methylbutyric acid 23601 20097 17288 20582 23177 27320 24462 24490 12898 31669 26144 30324 3-(4-HYDROXYPHENYL)LACTATE (M-H)- Hydroxyphenyllactic acid 175545 152000 197364 183735 219000 238707 240582 204896 185357 225484 253385 226167 3-HYDROXYBENZOATE (M-H)- 3-Hydroxybenzoic acid 1776 2103 2695 2762 3773 4945 3850 6957 3774 5571 3397 5327 4-HYDROXYBENZOATE (M-H)- 4-Hydroxybenzoic acid 5229 4553 2321 2784 2966 2085 7097 2276 3561 2181 4-METHYL-2-OXOPENTANOATE (M-H)- Ketoleucine 590412 585463 789377 659132 963186 1155630 1004670 1003829 710724 1298657 1100460 1323593 5-AMINOPENTANOATE (M-H)- 5-Aminopentanoic acid 27726 31064 12392 32744 15149 35316 18018 27657 33692 19275 31856 41826 ADENOSINE (M+HCOO)- Adenosine 14257 35558 11111 17364 7868 29896 ADPGLUCOSE (M-H)- ADP-glucose 92305 90529 86347 108606 65584 64163 66693 64800 101964 62450 73732 55545 ADP-RIBOSE (M-H)- ADP-ribose 61935 14214 8877 5480 33932 34467 43462 8202 5064 42732 47321 12727 ASPARTATE (M-H)- Aspartic acid 131645 125514 161515 91361 68184 74428 77853 75654 93936 60964 BEHENIC ACID (M-H)- Behenic acid 6491 3629 6812 4658 3788 3612 5114 6651 5943 6704 8138 CIS-VACCENIC ACID (M-H)- cis-Vaccenic acid 766664 421234 647139 213594 53272 193473 344376 113874 1087076 189222 420699 540237 CORTISOL (M+CL)- Cortisol 5836 4032 6247 4872 7285 9265 8694 8764 5302 8385 7766 8959 DEOXYURIDINE (M+HCOO)- Deoxyuridine 50270 26190 18749 20811 7873 16306 4773 19202 35022 35277 D-GLUCOSE 6-PHOSPHATE (M-H)- Glucose 6-phosphate 1405541 165234 532570 26852 90905 199172 12605 70329 7034789 111678 DOCOSAHEXAENOIC ACID (M-H)- Docosahexaenoic acid 145031 27518 44782 34049 57538 38038 63450 27755 47636 37256 118817 50097 EDTA (M-H)- Edetic acid 6101 1954 5273 7502 6075 8325 19037 9712 5527 22364 8950 25747 ERUCIC ACID (M-H)- cis-Erucic acid 33841 29964 14207 15599 19666 18809 9430 11369 6651 6269 20565 5334 FLAVIN ADENINE DINUCLEOTIDE (M-H)- FAD 132377 132039 93591 90688 68363 96261 69639 83987 127932 71137 124868 101860 FUMARATE (M-H)- Fumaric acid 174827 188071 230174 224775 163048 143398 134735 124798 240867 215686 169716 196569 GDPMANNOSE (M-H)- GDP-mannose 66496 60096 60120 74190 38652 42010 44706 43564 68069 36662 59443 45110 GIBBERELLIC ACID [ISTD] (M+CL)- Gibberellin A3 782000 785000 784000 786000 786000 854000 790000 815000 763000 803000 803000 815000 GIBBERELLIC ACID [ISTD] (M-H)- Gibberellin A3 5105730 5043743 5013039 5043920 4878106 4945200 4930695 5059290 4795212 4943929 5099782 4794984 GLUCOSE (M+CL)- Glucose 4487240 4631634 5360046 3849820 6178225 5577937 6894640 7767832 4800274 7933188 5405863 7496904 GLUCURONIC ACID (M-H)- Glucuronic acid 15371 10846 9643 11914 7379 7142 6636 7546 11576 3961 8250 5587 GLUTAMATE (M-H)- Glutamic acid 2450000 2450000 2150000 2650000 1940000 1550000 1610000 1740000 2760000 1420000 1940000 1100000 GLUTARATE (M-H)- Glutaric acid 15305 8686 9864 8597 12803 10900 12277 11966 10207 11327 11108 10687 GLUTATHIONE (OXIDIZED) (M-H)- Glutathione 2680000 2970000 2870000 3520000 6030000 6710000 6340000 6250000 2448654 6020000 6310000 5600000 GLYCEROL 2-PHOSPHATE (M-H)- sn-Glycero-2-phosphate 38997 19034 38412 37505 8327 4621 GLYCOCHOLATE (M-H)- Glycocholic acid 1194 1378 2067 1933 2488 2738 2809 4177 2889 GUANOSINE 5^-PHOSPHATE (M-H)- GMP 108252 91810 44202 77030 90629 65434 34482 22361 28479 78454 HEPTADECANOATE (M-H)- Margaric acid 141852 69512 75008 53118 36655 65481 40414 47734 32916 36982 105182 49690 HEXACOSANOIC ACID (M-H)- Cerotic acid 11136 4639 13795 8502 7626 9904 10118 12256 8605 10948 12173 8130 HYODEOXYCHOLATE (M-H)- Hyodeoxycholic acid 213512 223303 312248 245496 222069 261050 478415 144321 489108 338077 222957 515208 INOSINE 5^-PHOSPHATE (M-H)- IMP 327368 257566 407070 134773 441925 513720 165545 298393 182004 228057 448679 301245 INOSINE (M-H)- Inosine 1334455 251610 127816 49840 110265 24178 77305 216135 323043 ISOLEUCINE (M-H)- Isoleucine 717585 713572 694172 776886 477949 1227637 901997 479105 774675 579177 567006 805943 L-[15N]ANTHRANILIC ACID [ISTD] (M-H)- 2-Aminobenzoic acid 138810 133565 121585 129269 118537 117764 115579 127333 115048 119075 124355 104404 LAURIC ACID (M-H)- Lauric acid 5702 4650 4856 3146 3692 2648 3460 3011 2874 4244 4567 3161 LEUCINE (M-H)- Leucine 705752 597757 1398063 665742 1260733 1126587 1308625 686373 671722 1654990 394676 361182 LIGNOCERIC ACID (M-H)- Lignoceric acid 11514 7210 12075 8457 7425 8264 6484 10691 12475 10845 11067 12656 LINOLEATE (M-H)- Linoleic acid 10187601 54204 229872 1570110 41666 5693794 167847 975936 4423403 427397 L-TRYPTOPHAN-15N2 [ISTD] (M-H)- Tryptophan 249271 233422 223094 223959 212699 218872 220690 245036 219507 238434 239991 221933 LUMICHROME (M-H)- Lumichrome 2162 4006 3817 5471 8624 5767 2037 4080 3997 3893 LYSINE (M-H)- Lysine 5905 5587 5087 5249 5719 7462 8102 6552 4922 6033 5902 8445 MANNITOL (M-H)- Mannitol 119809 125019 81186 103115 46628 72361 82620 71539 86053 56715 109168 57932 N-ACETYL-D-GLUCOSAMINE (M+CL)- N-Acetylglucosamine 15822 11101 13720 9971 10814 17563 9807 9550 13296 8130 13303 13509 N-ACETYL-DL-METHIONINE (M-H)- N-Acetylmethionine 79669 64375 77407 55722 70587 78268 70509 65324 56028 66501 88187 64319 N-ACETYL-L-ALANINE (M-H)- N-Acetylalanine 167208 140913 191627 137535 182784 173218 171926 167582 145690 164756 173213 139524 N-ACETYL-L-PHENYLALANINE (M-H)- N-Acetylphenylalanine 11860 12583 6390 15614 9362 20813 15957 13875 12406 17082 15803 17138 N-ACETYLNEURAMINATE (M-H)- N-Acetylneuraminic acid 116054 157045 113430 213861 202803 116238 167878 130861 154688 256319 157523 136837 OROTATE (M-H)- Orotic acid 37035 24469 19148 22563 10176 11727 11425 10242 8830 7790 21082 20980 OXALOACETATE (M-H)-[-H2O] Oxaloacetic acid 103047 125939 93939 126771 135265 109546 138586 129288 88794 136131 77929 137465 PALMITATE (M-H)- Palmitic acid 438059 153360 408194 136143 959502 106839 385333 133588 153395 258566 98824 72084 PALMITOLEIC ACID (M-H)- Palmitoleic acid 140740 318016 431217 173095 234016 336250 271798 236740 267016 206137 364350 PHTHALATE (M-H)- Phthalic acid 13842 14009 7205 3724 3388 2584 2316 3466 2601 7676 1786 PIMELIC ACID (M-H)- Pimelic acid 14079 4551 6915 10962 5140 6725 4397 8192 4316 6535 4165 PROSTAGLANDIN E2 (M+CL)- PGE2 14721 11119 9305 9712 4857 7820 6249 8688 7945 5882 9422 8449 PROSTAGLANDIN E2 (M-H)-[-H2O] PGE2 6717 6135 5896 5589 1978 3056 2667 3911 4115 2619 5269 3861 PURINE (M-H)- Purine 22300 18362 21562 40040 49645 21429 5958 18811 13504 PYRUVATE (M-H)- Pyruvic acid 30236 32538 39495 29427 31136 33106 32162 30928 32485 34394 35554 22734 RETINOATE (M-H)- Retinoic acid 19940 17675 16295 13126 21041 16434 14491 12183 9461 10299 20343 13994 (S)-2-AMINO-3-(3-HYDOXY-4-OXO-4H-PYRIDIN-1-YL)PROPANOATE OR L-MIMOSINE (M-H)- Mimosine 975 14966 15884 19041 10724 8168 6362 10299 13156 6014 8521 5185 (S)-3-METHYL-2-OXOPENTANOATE (M-H)- 3-Methyl-2-oxovaleric acid 503394 521354 695525 569959 940389 1088098 1000138 917488 624009 1352130 989277 1403809 SALICYLATE (M-H)- Salicylic acid 31845 20512 23075 19879 29400 34400 33000 28700 23120 34500 30300 34000 (S)-DIHYDROOROTATE (M-H)- 4,5-Dihydroorotic acid 1988 1327 2762 5038 1053 6990 SEBACIC ACID (M-H)- Sebacic acid 18303 13149 13034 14356 18197 15898 13807 12881 13508 13357 15599 13347 SN-GLYCERO-3-PHOSPHOCHOLINE (M+HCOO)- sn-Glycero-3-phosphocholine 37065 32454 34525 45171 29144 38090 32287 32411 42180 24844 35434 11675 STEARATE (M-H)- Stearic acid 255371 296375 402530 337301 705635 331218 740523 285772 348512 557732 168831 320916 SUCCINATE (M-H)- Succinic acid 425387 377960 400110 228453 357708 348042 331692 259033 206398 360374 288656 409405 THYMIDINE 5^-MONOPHOSPHATE (M-H)- TMP 10540 2503 8275 7495 11769 13910 7412 2377 6839 THYMIDINE (M+CL)- Thymidine 23681 12385 8451 7461 11594 8346 6549 11045 17863 TRANS-ACONITATE (M-H)- trans-Aconitic acid 265182 427496 151059 287290 110154 420177 178077 200910 112795 200531 147930 322526 TRICARBALLYLIC ACID (M-H)-[-H2O] 1,2,3-Propanetricarboxylic acid 50329 51314 58369 52508 31411 35272 37065 61807 54708 21101 24472 86940 TYROSINE (M-H)- Tyrosine 538012 475307 609154 547608 610685 621731 654201 683164 575926 738381 635802 638079 UDP-N-ACETYL-D-GALACTOSAMINE (M-H)+[-H2O] UDP-N-acetylgalactosamine 83286 90813 82285 109571 61353 71838 62679 61589 89919 59928 67557 58867 URIDINE-5-MONOPHOSPHATE (M-H)- UMP 298196 252653 212914 95371 238360 343795 261177 137402 159216 115355 241800 URIDINE (M-H)- Uridine 170383 64382 46794 53166 13510 32891 23545 37808 27520 11500 58238 86207 VALINE (M-H)- Valine 27587 31137 12091 34083 14682 29261 17694 25413 27952 27497 31500 42042 XANTHINE (M-H)- Xanthine 135634 23970 47849 34379 2930 3645 2092 4281 1687 35842 49415 XANTHOSINE 5^-PHOSPHATE (M-H)- XMP 3292 2690 11635 2501 9150 9629 3463 10540 5342 4260 7848 6730