Data for (Study ST002016)

(Analysis AN003284)

Values for each metabolite have been scaled by dividing by the mean across all factors

Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

MetaboliteF1F2F3F4F5F6F7F8
10-Hydroxycarbazepine 0.2124 0.3548 0.3312 2.3269 0.4693 0.3680 0.3469 0.7973
11-Aminoundecanoic acid 0.0453 3.1778 2.3076 1.1818 0.4520 1.6882 0.2559 0.7592
11-Nitro-1-undecene 0.5869 0.9233 0.9305 1.0222 0.8937 1.2432 0.9180 0.9456
1-(1Z-hexadecenyl)-sn-glycero-3-phosphocholine 0.0846 0.8777 0.7961 1.3634 0.4396 0.6691 0.9441 0.9653
12-Aminododecanoic acid 0.4758 0.7296 0.7887 0.9426 0.6921 1.2568 1.0903 0.7773
12-Hydroxydihydrochelirubine 0.1589 0.2852 0.2641 1.5337 0.3678 1.5742 0.5365 0.7524
1,3,5-Heptatriene 0.4969 0.8271 0.1873 0.5722 0.1815 0.4149 1.7901 1.1877
1,3-Dicyclohexylurea 0.5438 1.4681 1.0992 0.6726 1.6311 0.7749 1.2909 1.0622
15-Crown-5 0.0030 0.4358 1.9871 1.4865 0.6807 1.0077 0.5925 1.0610
1,5-DAN 0.0033 0.9672 0.7824 1.0305 1.0034 0.8032 1.0969 1.0998
1,7-Dimethyluric acid 0.0797 1.4339 0.1344 1.3384 0.0951 0.1813 1.1853 1.0317
1-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine 0.0167 0.7026 1.2715 0.9210 0.7855 1.2248 1.0475 0.9684
1-Aminocyclopropane-1-carboxylate 0.0245 0.8156 0.8201 1.0753 1.1225 1.0460 0.9418 1.1155
1-arachidonoyl-sn-glycero-3-phosphocholine 0.0129 0.7857 0.8563 1.5875 0.5094 1.0205 0.6101 0.8383
1-(beta-D-Ribofuranosyl)-1_4-dihydronicotinamide 0.0091 1.0568 1.2891 0.8695 1.4926 1.3303 0.9710 0.8646
1-heptadecanoyl-sn-glycero-3-phosphocholine 0.0584 0.5953 0.7467 1.3684 0.5619 1.0043 0.7755 1.0910
1-Hexadecanoylpyrrolidine 1.5520 0.4166 0.3634 1.8222 0.7753 0.4417 0.6302 1.0098
1-Linoleoylglycerophosphocholine 0.0029 0.4404 0.8987 1.2439 0.5398 1.0678 0.8780 1.0731
1-Methyladenosine 0.0099 0.9973 0.9160 0.8175 1.0372 0.8588 1.2964 0.9376
1-Methylhistidine 0.0097 0.5970 0.8762 0.9960 1.3243 1.0055 1.0712 1.0233
1-Methylpyrrolinium 0.0087 0.5776 0.2315 1.2990 0.7049 1.8549 0.5776 0.6955
1-Methyluric acid 0.0460 0.5125 0.2512 1.4307 0.3383 0.3627 1.1182 1.0049
1-Methylxanthine 0.0190 1.3331 1.8437 1.5459 0.1319 0.0876 0.9274 1.0075
1-Oleoylglycerophosphocholine 0.0116 0.7096 1.1039 1.0311 0.7182 1.3915 0.8823 0.9705
1-Palmitoyl-2-hydroxy-sn-glycero-3-PE 0.0566 0.9112 0.7614 1.2280 0.9261 1.2305 0.7799 0.8998
1-palmitoylglycerol;MAG(16:0) 0.1123 0.6718 0.7295 1.8160 0.3976 0.7614 0.3714 1.4698
1-Palmitoylglycerophosphocholine 0.0033 0.8573 1.1911 1.1506 0.9790 1.0280 0.9000 0.9724
1-Pyrroline 0.0024 0.6339 0.7789 0.9933 1.1163 1.1742 0.9947 1.0810
1-Pyrroline-2-carboxylate 0.0116 0.5912 0.8912 0.9461 2.2041 0.5649 1.2049 1.2178
(1-Ribosylimidazole)-4-acetate 0.0224 1.2797 0.8725 0.8669 0.7128 0.9498 1.2183 0.8633
(1S,2R)-3-(4-Chlorophenyl)-3,5-cyclohexadiene-1,2-diol 0.0191 0.0354 0.0191 0.0212 1.2351 5.9271 0.0380 0.0348
1-Stearoylglycerol 0.0253 0.4012 0.4600 1.7690 0.1921 0.5124 0.2630 2.6757
1-stearoyl-sn-glycero-3-phosphoethanolamine 0.0255 0.8084 0.8265 1.2216 0.7935 1.0318 0.7888 1.2909
1-Tetradecylamine 0.0725 1.2185 0.6759 0.9152 0.9105 0.7028 1.2947 0.8771
(1Z,5Z)-1,5-Cyclooctadiene 0.7453 1.1128 1.1794 1.0286 1.2298 1.0727 0.9070 0.9817
2,2-Dichloro-1,1-ethanediol 0.4320 1.2224 1.0337 1.0679 1.4135 0.9138 0.9466 0.9642
2,2^-Iminodipropan-1-ol 0.0364 1.0612 0.4517 1.0689 0.7348 0.7051 1.3445 0.3936
2_2^-Iminodipropanoate 0.0390 1.2531 0.8117 1.0516 1.7799 0.2700 1.4306 0.4113
2_3_4_5-Tetrahydropyridine-2-carboxylate 0.0035 0.6157 0.9193 0.9549 2.1613 0.5785 1.1829 1.2367
2,3,4,9-Tetrahydro-1H-β-carboline-3-carboxylic acid 0.0059 0.9369 0.6193 1.1297 1.1996 0.7374 1.0499 1.0599
2,3-DIMETHYL-5-NITROINDOLE 0.1145 0.2066 0.1348 0.1577 0.1608 0.7975 2.1678 0.9271
2_3-Dimethylmaleate 0.0094 0.4496 0.5510 0.6316 0.6272 0.6416 1.6832 1.0161
2_4-Dinitrophenylhydrazine 0.1187 0.9241 0.3673 0.9875 0.4814 0.4588 1.3561 1.1676
2-(4-Hydroxyphenyl)ethanol(Tyrosol) 0.1047 0.4311 1.2482 1.6349 0.1412 0.8341 0.7228 0.7536
(24R_24^R)-Fucosterolepoxide 0.1521 0.1510 0.1083 2.3389 0.1379 0.1149 0.2529 1.7576
2_6-Dihydroxypseudooxynicotine 0.0269 0.3144 0.6078 0.3857 1.1902 1.9761 1.3227 0.7238
2-Acetolactate 0.0890 1.4706 0.5125 0.7047 0.7172 1.0000 1.2755 1.0971
2-Aminoacetophenone;O-Acetylaniline 0.1446 1.4327 0.9069 0.9187 0.8096 0.7033 1.2568 0.8521
2-Arachidonoyl glycerol 0.2064 1.3066 1.3384 1.6291 0.4902 1.2728 0.3320 0.8563
2-Butoxy-2-oxoethyl butyl phthalate 0.2723 0.1710 0.2809 0.1039 1.8022 4.3350 0.5622 0.2884
2-Chloro-4,4^-biphenyldiol 0.0133 0.0246 0.0180 0.0168 1.3454 5.9473 0.0262 0.0331
2-cyanobenzaldehyde 0.0065 0.7967 0.7773 1.0240 1.0556 0.7573 1.1353 1.1305
(2E)-hexadecenoylcarnitine 0.1146 1.0861 1.5761 0.9693 1.0519 1.1651 0.9832 0.7919
2-Ethyl-4,5-dimethylthiazole 0.0029 0.3008 0.0136 2.4293 0.0053 0.0158 0.6447 0.2858
2-Furoylglycine;Pyromucuricacid 0.0984 0.4155 0.3401 0.6914 0.3290 0.9396 1.5913 0.7863
2-Hydroxyhippuric acid 0.0618 0.5845 0.1631 0.7403 0.1342 0.7074 1.5896 1.0477
2-hydroxyphenylacetic acid 0.1151 0.9683 14.0292 0.5374 0.5504 0.3514 0.7865 1.0796
2-Hydroxypyridine 0.0885 0.4804 0.4025 0.8273 0.5416 0.5780 1.6215 0.7472
2-Hydroxyquinoline 0.0243 0.3331 0.2402 1.1054 0.2417 0.9613 1.1722 0.9764
2-Isopropylmaleate 0.0445 0.7439 3.3681 1.0008 0.9253 2.6621 0.2860 0.3378
2-linoleoyl-sn-glycero-3-phosphoethanolamine 0.0339 0.4323 1.1115 0.9186 0.7871 1.7829 0.8678 0.8347
2-Mercaptoethanol 0.0137 0.6073 1.6376 1.4408 0.7166 0.6883 0.7302 1.2646
2-Methylcholine 0.0373 1.2158 0.7387 0.8679 0.7379 0.4641 1.5793 0.4751
2-Methylnicotinamide 0.0622 0.3982 1.5853 0.7795 7.9123 1.4814 0.6193 0.6294
2-Methylpropanamine 1.2158 0.9748 1.1558 1.1768 0.6938 0.8469 0.9912 0.7431
2-Methylthiazolidine 0.0042 0.7798 0.6790 0.9683 1.2182 1.0733 1.0700 0.9993
2-Naphthylamine 0.0090 0.9786 0.7800 1.0151 1.1001 0.8122 1.1050 1.0749
2-Oxindole 0.2428 0.5754 0.6819 0.6765 0.4718 2.3440 0.8439 0.8612
2-Oxovaleric acid 0.0295 0.5386 0.5804 0.5407 1.6418 0.6228 1.6688 1.0655
2-PCB 0.0072 0.5124 1.3290 0.8405 0.7460 1.9088 0.8417 0.8845
2-Phenyl-4-pentenal 0.0643 1.0008 1.1246 1.1193 1.0877 1.0607 0.8801 1.0005
(2S)-2-Amino-8-hydroxyoctanoic acid 0.0270 0.4454 1.2278 0.7457 2.1870 1.9472 0.8846 0.6467
2S-Amino-tridecanoic acid 0.0440 0.3915 2.3424 1.4301 0.5242 0.9727 0.6536 1.0503
2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-ol 0.0591 0.1044 0.0979 0.1001 0.0849 0.1010 2.6073 0.8339
2-trans-Hexadecenal 0.5775 0.6818 0.7284 1.8184 0.3174 0.8098 0.3901 1.2719
(2Z)-4-(Octadecyloxy)-4-oxo-2-butenoic acid 0.2303 0.4709 0.3772 1.2859 0.2214 0.5082 0.4005 3.7067
3-(3,4,5-trimethoxyphenyl)propanoic acid 0.0971 0.2547 2.1982 1.3794 0.6326 0.8996 0.8209 0.8206
3_4-Dihydroxymandelate 0.0060 1.1028 1.2100 0.9007 1.7322 1.3537 0.8728 1.0026
3_4-Dihydroxyphenylethyleneglycol 0.1214 0.2750 0.5355 0.7642 0.5001 0.6469 1.5845 1.0292
3,4-DIHYDROXYPHENYLGLYCOL 0.0797 1.3391 0.6643 0.6589 2.0913 1.6147 1.0403 0.6902
3-(4-Hydroxy-1,3-benzothiazol-6-yl)alanine 0.0760 0.1476 0.1228 0.1554 0.1159 0.1677 2.5361 0.7551
3,5-ditert-butyl-4-hydroxybenzaldehyde 1.4660 1.0759 0.8572 1.1006 0.7638 1.0076 0.9195 0.9481
3,5-ditert-butyl-4-hydroxybenzonitrile 0.0052 0.0114 0.0089 1.1827 0.0132 0.0148 1.5563 1.2504
3, 5-Tetradecadiencarnitine 0.0710 0.9064 1.4086 0.8017 1.0830 1.4415 1.0495 0.7635
3,6-Diacetyl-9-isoamylcarbazole 0.1707 0.2078 0.1945 0.1946 0.1946 0.1787 2.5196 0.5880
3-Amino-2-methylpropanoate 0.0038 0.8129 0.9627 0.9158 1.2910 1.7283 0.7914 0.9312
3-Butyn-1-al 0.0129 1.1161 0.8267 0.9453 1.0089 0.6095 1.2626 1.0368
3-Chloro-4-nitro-1,2-oxazole 0.0661 0.9880 1.0963 0.9875 1.2002 0.9695 1.0442 0.9887
3-CYSTEINYLACETAMINOPHEN 0.0018 1.6955 0.8760 1.1552 0.6385 1.3527 0.7536 0.7076
3-Dehydrocarnitine 0.1104 0.4678 0.3045 0.7808 0.9356 0.6396 1.4846 1.1918
3-Dehydroxycarnitine 0.0077 0.8615 1.0808 1.0191 1.5089 0.9596 0.9825 1.1068
3-Hydroxy-2-methyl-4-pyrone 0.0196 1.0966 0.9402 1.0150 2.0023 1.0039 0.9624 0.9102
3-Hydroxy-3-[(3-methylbutanoyl)oxy]-4-(trimethylammonio)butanoate 0.0058 0.6150 1.1783 0.8105 0.9350 2.1420 0.7426 0.8775
3-Hydroxyanthranilic acid 0.1232 4.4119 0.3082 0.7471 1.9987 0.5859 1.0246 0.8568
3-Hydroxy-cis-5-tetradecenoylcarnitine 0.0676 0.8026 1.6871 0.7248 1.2339 1.7906 0.9477 0.7154
3-Hydroxycotinine 0.0331 0.0785 0.0703 0.0723 0.0778 0.0791 2.6046 0.9936
3-hydroxydodecanoylcarnitine 0.0936 3.5424 1.4044 0.4289 1.1388 1.2848 1.1260 0.7057
3-Hydroxy-N-(2-oxotetrahydro-3-furanyl)dodecanamide 0.0560 0.3732 0.5091 0.7308 1.1112 1.3676 1.2706 0.8303
3^-HYDROXYPENTOBARBITAL, (1^R,3^S)-(+/-)- 0.0260 0.7735 0.4245 0.3272 0.5805 0.5566 1.9659 1.0444
3-METHOXYTYROSINE 0.0047 0.3733 22.6842 0.3477 0.5187 0.2480 0.4236 1.1098
3-Methylcrotonylglycine 0.0921 1.3063 0.6202 0.7132 0.8634 1.0654 1.2657 1.0037
3-Methylsulfolene 0.0007 0.7697 0.6964 0.9751 1.2420 1.0545 1.0649 1.0210
3-NITRO-L-TYROSINE 0.0871 3.0372 0.3513 1.7801 2.1328 0.6475 0.2396 0.7692
3-Oxalomalate 0.0038 0.7090 0.7160 1.0699 0.9277 0.7294 1.1387 1.1101
3-Oxo-N-(2-oxotetrahydro-3-furanyl)decanamide 0.0501 0.6448 0.4230 1.0012 4.9934 0.1648 1.2279 0.9794
3-Oxotetradecanoic acid 0.8148 0.8632 0.8420 1.0058 0.9440 1.2410 0.9330 0.9577
3-Ureidoisobutyrate 0.0372 1.6705 0.4220 0.7687 0.3243 0.6369 1.4876 0.8048
4,4^-dimethoxy[1,1^-biphenyl]-2-carbonitrile 0.0132 0.6588 1.1262 1.0326 0.8969 1.3363 0.8992 0.9692
4,4^-Thiobis(butan-2-one) 0.0174 2.0827 1.1620 0.6127 1.5637 1.0914 1.1441 1.0198
4,6-Dimethyl-2(1H)-pyrimidinone 0.0210 0.9756 2.0669 1.1669 1.0992 0.8172 0.9120 0.9066
4-Acetamidoantipyrine 0.0187 0.0388 0.0299 2.6947 0.0244 0.0295 0.0326 1.6463
4-Acetamidobutanoic acid 0.0124 0.8255 0.5087 0.5906 0.4642 1.0292 1.4566 1.1653
4-Amino-3-hydroxybenzoic acid 0.0096 0.7186 1.2900 0.8056 1.4341 1.8772 0.8279 0.8271
4-Aminohippuricacid 0.0415 1.0623 0.6517 0.8196 0.5286 0.8559 1.4194 0.6809
4-Aminophenol 0.0144 1.1650 1.4975 1.4573 1.4580 0.7341 0.6341 1.0480
4-Aminopyridine 0.0614 1.8381 1.1306 0.6942 0.8128 1.3001 1.1000 0.8810
4-Coumarylalcohol 0.1237 0.9987 0.5375 0.8107 1.9502 1.1797 1.1371 0.8183
4-Coumarylalcohol(4-Hydroxycoumarin) 2.2569 1.0093 0.8661 1.2111 0.8272 1.0148 0.7614 1.0369
(4E)-1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one 0.0032 0.0496 0.3200 0.6128 0.2271 3.2761 0.5699 0.9006
(4E)-2-Oxohexenoic acid 0.1257 0.6076 0.7001 0.9640 0.3934 1.1394 1.1371 0.9492
4-Ethynylaniline 0.0045 0.9518 0.7884 1.0246 1.0342 0.8055 1.1021 1.0940
4-Formylaminoantipyrine 0.0271 0.2386 0.0474 2.7092 0.0356 0.0470 0.0808 1.3014
4-Guanidinobutanoate 0.0599 1.6790 0.6538 0.8826 0.9466 0.8496 1.3297 0.3986
4-HQN 0.1544 0.2852 0.2412 1.0228 0.2076 1.7641 0.9759 0.5968
4-Hydroxy-2-butynal 0.0274 1.2706 0.9904 0.9837 1.4163 0.9094 1.0287 0.9988
4-Hydroxybenzaldehyde 0.3913 0.7226 0.5378 1.1848 0.6897 1.2425 0.8368 0.9866
4-Hydroxycinnamoylmethane 0.3812 0.5035 0.1507 1.8204 3.9794 0.1640 0.5579 1.0468
4-Hydroxymandelicacid 0.0352 1.0371 0.7261 0.8126 2.2433 1.6425 0.8466 0.9135
4-Hydroxyphenylacetaldehyde 0.2074 0.2150 0.5746 1.0334 0.1500 3.0321 0.3689 0.5061
4-Hydroxyprolylleucine 0.0458 0.4001 1.0871 0.6215 1.0091 0.7633 1.5369 1.1262
4-Imidazolone-5-propanoate 0.0425 1.0091 1.0013 0.8700 1.8715 1.1807 1.0194 0.9383
4-Imino-1-(beta-D-ribofuranosyl)-1,4-dihydro-3-pyridinecarboxylic acid 0.0258 0.9776 1.1112 0.7306 1.1485 1.1599 1.2284 0.8750
4-Indolecarbaldehyde 0.0266 0.8056 0.4675 1.1072 0.7368 1.1008 1.0230 0.8422
4-Methyl-2-phenyl-1,3-thiazole 0.0246 1.8188 0.7035 0.6498 2.6349 1.9279 0.7848 0.7111
4-Methylaminoantipyrine 0.0037 0.5225 0.8124 1.3894 0.8811 0.5618 1.0026 0.9126
4-METHYLCATECHOL 0.3158 0.5453 0.3002 1.7872 4.0663 0.2530 0.6088 0.7542
4-Methylene-2-oxoglutarate 0.0612 0.3254 0.4520 0.3253 0.3687 0.3302 2.2846 0.5768
4-Methylene-L-glutamine 0.0082 0.5598 0.7268 1.0298 0.8077 0.9861 1.0871 1.0875
4-Pyridoxic acid 0.0329 0.7121 0.2899 1.3152 0.2710 1.4436 0.7062 0.9176
4-Quinolinecarboxylic acid 0.1172 1.6378 0.4580 1.3708 0.4269 0.6965 0.9106 0.7466
(4S)-4-[(2E)-2-Octenoyloxy]-4-(trimethylammonio)butanoate 0.0012 0.6697 1.2672 1.0354 1.3078 1.1170 0.9875 0.8690
4-Sulfanyldihydro-3(2H)-furanone 0.0956 1.8934 1.3560 0.6559 1.6672 1.0190 1.1405 1.0132
5_10-Methenyltetrahydrofolate 0.1582 0.2450 0.2227 0.1920 0.1524 0.1880 2.5067 0.6136
5-Acetylamino-6-amino-3-methyluracil 0.0920 0.6539 4.0914 1.3322 0.2276 0.2362 0.9242 1.1370
(5alpha,6beta)-3-Hydroxy-17-methyl-4,5-epoxymorphinan-6-yl beta-L-glucopyranosiduronic acid 0.0385 0.1548 0.0881 0.1476 5.0949 4.4692 0.2653 0.1667
5-Amino-4-imidazolecarboxylate 0.0112 0.0246 0.0160 0.8737 0.0223 0.0218 1.6569 1.8676
5-Aminolevulinate 0.0163 0.4108 0.6451 0.7606 1.5063 1.2387 1.2352 0.9184
5-Aminopentanal 0.0158 0.2927 0.2698 0.3256 3.6213 3.0087 0.7253 0.7198
5-Fluoro-3,5-AB-PFUPPYCA 0.0052 0.0673 0.2930 1.0271 0.3114 2.4434 0.5382 1.0484
5-Hydroxyindole-3-acetic acid 0.0009 1.2659 1.4510 1.0377 1.5398 1.3611 0.7606 0.8523
5-Hydroxyisourate 0.0022 1.1578 1.0109 0.9007 1.0040 0.7123 1.2391 1.0240
5-Hydroxy-L-tryptophan 0.0051 1.0466 1.6136 1.0071 1.5672 1.5023 0.7405 0.8357
5-Methylthio-D-ribose 0.0280 0.9853 1.1526 0.9201 1.2446 1.2192 1.0388 0.7865
5-(N,N-Dimethylcarbamimidamido)-2-oxopentanoic acid 0.0033 0.8084 0.7224 0.9231 0.9037 1.0605 1.1270 1.0268
5-Valerolactone 0.2022 1.4419 0.5972 0.9728 1.3034 0.7137 1.1838 0.8538
6-Hydroxypseudooxynicotine 0.1525 0.3286 0.3404 0.6512 1.8367 0.4561 1.8347 0.5081
6-Methylindole 0.0078 0.9630 0.7893 1.0098 1.0198 0.8063 1.1175 1.0849
7,8-dihydro-8-oxoguanine 0.0780 0.1623 0.2533 0.9427 0.2915 2.6874 0.5741 0.7496
7_8-Dihydroneopterin 0.0710 0.8448 1.0186 1.1247 0.9679 0.7915 1.0596 0.9416
7-methyl-3-nitroimidazo[1,2-a]pyridine 0.0126 0.7704 0.7804 1.0019 1.0995 0.9508 1.0967 1.0114
7-Methylxanthosine 0.0566 0.0957 0.0753 0.7216 0.0704 0.5162 1.8042 0.9518
7-Oxobenz[de]anthracene 0.0167 0.1179 0.4844 0.5633 0.4238 2.9313 0.7368 0.9249
8-Amino-7-oxononanoate 0.0071 0.4310 1.3543 0.6297 0.9467 2.4766 0.8508 0.5590
8-hydroxy-7-methylguanine 0.0298 1.0068 1.2017 0.9325 2.2903 1.3957 0.8353 0.8560
8^-Hydroxyabscisate 0.2029 1.6038 2.5235 1.1680 0.3297 2.3347 0.2938 0.2828
8-Hydroxyhexadecanedioic acid 0.2350 0.2537 0.1901 1.5096 0.1537 0.2271 0.3508 3.7998
8-Hydroxyquinoline 0.0222 1.2965 1.4325 1.0308 1.6495 1.3513 0.7589 0.8551
8-Oxocoformycin 0.0305 1.5652 1.0771 0.8169 1.2702 1.2046 1.0203 0.9472
9,12-Hexadecadienoylcarnitine 0.1189 0.9018 1.4275 0.7872 0.8263 1.3168 1.1431 0.7528
9-Decenoylcarnitine 0.0059 0.5787 1.0381 0.6478 1.1573 2.0361 1.0004 0.6757
Aceclidine 0.0221 0.0673 0.0333 0.0688 0.0307 0.0368 2.6038 1.1073
Acetoacetate 0.0247 0.9788 1.3842 0.7190 1.5677 1.7147 0.9053 0.9225
Acetochlor ESA 0.1487 13.0854 0.2476 0.2498 0.1916 0.2358 0.5725 1.0463
Acetonecyanohydrin 0.0476 0.8655 0.5652 0.6143 0.7112 1.2217 1.3070 1.1829
Acetylcholine 0.0007 0.8012 1.2451 0.8600 1.2598 1.2551 1.0602 0.9055
Acetyl-L-carnitine 0.0003 0.8760 1.3861 0.9261 1.2629 1.3167 0.9296 0.9709
Acetyl-β-methylcholine 0.0061 1.0909 0.9463 0.7781 0.7436 0.9204 1.1934 1.3450
Acycloguanosine 0.0366 0.0511 0.3289 1.4304 0.0446 0.0573 1.3624 0.9424
Adaprolol 0.1669 0.4508 0.2263 0.7495 2.9110 0.6401 1.4439 0.9266
Adenosine 5^-monophosphate 0.0025 0.8161 1.0429 1.1803 0.6955 0.8482 0.9951 0.9818
alanyl-poly(glycerolphosphate) 0.0483 1.3593 1.8690 1.0776 0.4295 2.5017 0.3485 0.3869
Ala-Pro 0.0153 2.0312 0.0304 2.2211 0.0336 0.0287 0.6147 0.2134
Ala-Tyr 0.0699 1.2369 0.1912 0.7936 0.3777 0.9227 1.3425 0.9971
allyl bromide 0.0085 1.1170 1.1045 0.9398 1.2703 1.2672 0.8940 1.0923
allylcysteine 0.0410 0.8662 0.6145 0.9359 0.7302 0.6180 1.3287 1.0675
alpha-Ribazole 0.0728 0.3610 1.1211 0.5457 1.2052 0.7263 1.6282 1.0674
Alprenolol 0.0961 3.0785 0.1166 0.1281 0.1057 0.3695 2.0310 0.8914
Amides, C12-18, N-(hydroxyethyl) 0.0217 3.2351 2.4116 0.7064 0.0126 0.6093 1.0654 1.3381
Anhydroecgonine 0.0187 0.0177 0.0261 0.0291 0.0234 0.0236 2.7348 0.8295
Aniline 0.0476 1.2501 1.4504 1.0299 1.4488 1.3801 0.7650 0.8562
Anisole 0.2439 0.4214 0.2337 0.9868 0.6945 1.0716 1.2147 0.8353
Ankorine 0.0409 0.1726 1.0887 0.6976 0.6842 0.6927 1.6266 0.8824
Anthranilate 0.2176 0.5100 0.2923 1.6963 0.3869 0.3369 1.0198 0.4937
apronalide 0.0020 1.1422 1.7801 0.9996 1.3477 1.3166 0.8091 0.9014
ARECOLINE 0.1325 0.5400 1.3137 1.5669 0.1586 0.8363 0.7605 0.7603
arg-leu 0.1184 1.3746 3.5158 0.6975 0.4839 3.0112 0.2891 0.4900
Aripiprazole 0.1461 0.2245 0.2190 2.3624 2.7694 0.2631 0.3480 0.3409
asp-leu 0.0679 0.3569 0.5279 0.7122 0.9253 2.3232 0.8719 0.7300
Atagabalin 0.1106 0.6301 1.1168 0.9435 1.6899 1.9381 0.6865 0.7800
Atenolol acid 0.0005 1.2895 0.7701 1.2836 1.5371 0.0460 1.0181 1.5357
Baclofen 0.0488 0.0952 3.8961 1.5501 0.0642 0.0657 1.1295 0.3741
Benzaldehyde 0.1299 1.3378 0.8943 1.0388 1.2900 1.1211 0.8870 0.9747
Benzene 0.0001 1.3498 0.8946 1.0366 1.2503 1.1535 0.8770 0.9849
Benzyl2-methyl-3-oxobutanoate 0.2488 0.3649 0.3662 0.3896 0.3950 3.9796 0.5258 0.3583
Benzyl butyl phthalate 2.7063 0.8716 0.7387 1.3068 0.8246 0.7569 0.6957 1.4271
Benzyl methacrylate 0.0407 0.8206 0.8525 0.9945 1.6391 0.9384 1.0426 1.0531
Beta-Alanine 0.0066 0.7941 1.0185 0.9041 0.7278 1.3463 1.0022 1.0183
beta-Leucine 0.0050 0.3035 0.7573 1.0036 0.4097 0.5670 1.3643 1.1273
BIM-1 0.1555 1.7681 2.1099 1.2288 0.3221 2.1572 0.3117 0.3645
BiochaninA 0.0305 0.2890 0.2190 0.1490 3.5043 4.1884 0.4828 0.2039
Biotin 0.0483 0.4936 0.9659 0.8412 0.6497 2.4061 0.6615 0.8036
Bis(2-ethylhexyl) amine 0.1723 1.5214 0.7377 0.9476 1.2133 0.7576 1.1719 0.8558
Brassylic acid 0.8818 3.0315 1.6231 0.7925 0.4056 1.2174 0.8795 0.7795
Buflomedil 0.0642 0.1437 0.1210 1.5400 0.1635 0.1160 1.2458 0.8748
Buphedrine 0.0199 0.7972 0.9410 1.1537 2.0393 0.8791 0.9094 0.9874
Butabarbital 0.0105 0.3379 0.5331 0.7743 3.2672 0.7862 1.2298 1.2426
Butoxytriglycol 0.7464 0.8586 1.0303 1.1511 0.7409 1.0157 0.9112 0.9587
Butyryl-L-carnitine 0.0011 0.7166 0.8939 0.8844 0.8533 2.5616 0.5828 0.5463
Cafestol 1.6566 0.9105 1.0422 1.2528 0.6854 1.1118 0.7084 1.0424
Caffeine 0.0028 0.3569 0.0266 1.5229 0.0533 0.5611 0.9510 1.1732
Caprolactam 0.0153 0.1643 0.1670 1.4062 0.1341 0.1551 1.2073 1.3640
Capryloylglycine 0.0645 1.7341 0.3717 1.0673 0.5110 1.2260 0.8734 0.9270
Carbamazepine 0.0409 0.0051 0.0051 3.1477 0.0059 0.0085 0.0069 0.3452
Carbamazepine 10,11-epoxide 0.1252 0.2358 0.2190 2.4610 0.2026 0.1954 0.2367 1.2062
(Carbamoylamino)(4-hydroxyphenyl)acetic acid 0.0378 5.6659 0.0743 0.8037 0.0820 0.1168 1.1738 0.9399
Carbaryl 0.0860 0.5253 0.5984 1.0133 0.4175 1.0197 1.2649 0.6119
Carnidazole 0.0038 0.4192 0.7040 0.2895 1.6049 3.3612 0.7935 0.3757
Carvedilol 0.0380 0.0625 0.0634 1.3305 2.7465 0.1235 1.3448 0.5577
CephalosporinC 0.0119 0.0188 0.0210 0.0164 4.1308 5.4637 0.0246 0.1054
Cerulenin 0.0459 0.7482 0.2662 1.8479 1.1226 0.3598 0.6194 1.0809
Cetirizine 0.1940 0.0810 0.0579 0.9731 17.9190 0.0669 0.4293 0.8956
chavicol 0.1155 1.5655 1.3875 1.1826 0.3966 2.0396 0.4604 0.4654
Cholic acid 0.0557 1.0398 0.5184 1.2179 1.7627 0.9372 0.8233 1.0522
Choline 0.0010 0.9355 0.9003 0.9842 0.9703 1.2882 0.9535 0.9293
Cinnamaldehyde 0.2854 1.5665 2.1874 1.1998 0.4188 2.1812 0.3497 0.3157
cis-5-Tetradecenoylcarnitine 0.0295 0.9833 1.6258 0.7929 0.9609 1.4284 1.0474 0.7652
cis-dihomoaconitic acid 0.0005 1.1673 1.1967 0.9317 1.5673 1.2376 0.9085 0.9913
cis-Tramadol 0.0178 9.7319 0.0257 0.0662 0.0207 0.2145 1.1876 1.2239
Clindamycin 0.0009 0.0015 0.0013 0.0014 0.0012 0.0013 2.5932 1.4686
clomazone 0.0062 0.0094 0.0053 0.0068 2.4011 5.7691 0.0294 0.0809
Clopidol 0.2081 0.3681 1.3402 1.5943 0.2442 0.3798 1.0054 0.6247
Coniferylalcohol 0.1554 0.2591 2.1672 1.3520 0.7285 0.8890 0.8253 0.8836
Coniferylaldehyde 0.1462 0.3436 0.2960 0.4589 0.2152 0.2681 2.0594 1.0958
Coumarin 0.0048 0.9678 0.8905 0.9781 1.0914 1.0133 1.0487 1.0314
Coumarone 0.0005 0.9455 0.8849 0.9843 1.1108 1.0171 1.0444 1.0278
Crotonic acid 0.0099 1.5565 0.7377 0.9306 0.7912 1.2581 0.8953 1.1527
Cuminaldehyde 0.0094 1.7192 2.1921 1.0629 0.3058 2.3452 0.3757 0.3848
cyclandelate 0.8351 1.3669 1.1212 1.1525 0.7322 1.3112 0.7336 0.8067
Cycloheptene 0.2382 0.4504 3.3806 0.4649 0.3467 1.9314 1.1488 0.5414
Cyclohexanethiol 0.0025 0.5713 0.7628 0.9683 1.1477 1.2489 0.9907 1.0759
Cyclohexylamine 0.0972 1.0564 0.8937 1.0143 1.0914 0.8934 1.1414 0.7395
Cytidine 0.0370 0.8264 1.2716 1.0149 0.8209 2.0095 0.6903 0.5282
Cytosine 0.0294 1.0942 1.0588 0.9897 1.9206 1.4337 0.7968 0.8387
D-2-Amino-hexano-6-lactam 0.0083 0.7404 1.0987 1.0188 0.8202 1.1945 0.9878 0.9327
dADP 0.0610 0.1150 0.0801 1.4911 0.2992 1.3279 0.8935 0.2216
D-Ala-D-Ala 0.0182 0.9726 1.5013 1.1140 0.9308 0.9460 0.9180 1.0380
Dambonitol 0.0223 0.1302 0.4724 0.5854 0.4354 2.8418 0.7659 0.8959
D-Apiitol 0.0723 1.7737 0.5166 1.0517 0.7360 0.8593 1.2381 0.2056
D-Carnitine 0.0001 0.7500 1.3682 0.9747 1.3173 1.5444 0.8233 0.8533
Deacetylcefotaxime 0.0303 1.2621 0.2006 0.9650 0.1137 0.5818 1.5055 0.5133
Decanoylcarnitine 0.0068 1.1720 1.4114 0.7303 1.1246 0.9470 1.2721 0.9174
Deoxyguanidinoproclavaminic acid 0.0406 0.5867 0.4227 0.8822 0.6013 1.9501 0.8447 0.9130
Dethiobiotin 0.0287 0.7290 0.9593 0.9828 2.1940 0.9193 1.0639 0.9168
Dextromethorphan 0.0487 1.8022 0.0742 1.9396 0.0654 1.3720 0.1021 0.7346
Diaveridine 0.0414 0.6059 0.7661 1.1690 1.1708 1.1860 0.8007 1.1689
Dibenzoylmethane 0.0455 1.0804 0.9790 1.2722 0.6859 0.8705 0.8458 1.0588
Dibenzylamine 0.0687 0.7786 1.2305 1.1761 0.6147 1.0670 0.8940 0.9609
DICHLORODIFLUOROMETHANE 2.3678 0.8192 0.7435 1.1601 0.9254 0.5982 1.0821 0.8628
Dichloromethane 0.0041 0.9734 1.0985 0.9812 1.1412 0.9851 1.0486 0.9977
Dicyclohexylamine 0.0217 1.2485 0.6955 1.0196 1.3393 0.6805 1.1029 1.1183
Didecyldimethylammonium 0.0338 0.0892 0.1488 0.9293 0.0507 0.0854 2.0658 0.0899
Diethyl dibutylmalonate 0.7765 1.0945 1.6348 1.1324 1.3067 0.9787 0.8084 1.0106
dihomomethionine 0.0223 0.9005 1.0098 0.8456 0.9209 1.2508 1.1050 0.9074
Dihydroclavaminic acid 0.1196 0.7128 0.4909 0.9877 1.6451 1.0911 1.0657 0.8746
Dihydrothymine 0.0070 0.7359 1.1670 0.9135 1.0004 0.8789 1.1933 1.0194
DIHYDROURACIL 0.0087 0.8849 0.9551 0.9791 1.2649 1.2299 0.9758 0.8947
Dihydrouridine 0.0207 0.5429 0.9446 1.0339 1.3276 1.6484 0.8457 0.6173
Dihydroxycarbamazepine 0.0337 0.0573 0.0533 2.7217 0.0474 0.0495 0.0596 1.4099
Diisobutylphthalate 1.9089 1.0494 1.0272 1.1136 0.8081 1.0425 0.8266 1.0662
Diisopropylphosphate 0.0260 0.0969 0.2887 1.4222 0.3543 1.5781 0.5648 1.1075
Dinitrosopentamethylenetetramine 0.0482 0.7764 0.5013 1.1406 0.8489 0.6222 1.1115 1.1977
Dioxohongdenafil 0.0140 0.0349 0.1140 0.3699 0.1241 4.1911 0.5196 0.4149
Diphenhydramine 0.0467 0.1150 0.0803 0.5893 0.0633 0.1749 2.0576 1.0581
DL-Atenolol 0.1392 0.2852 0.9738 1.8967 2.1751 0.9472 0.3650 0.5617
DL-Stachydrine 0.0004 1.6340 0.3537 1.3969 1.5697 0.5014 0.7303 1.3537
DL-α-Aminocaprylic acid 0.0245 0.4618 1.3901 0.8203 0.6194 0.4101 1.5105 1.1673
Dopamine 0.0022 0.5148 0.0036 0.8375 0.0038 0.0061 1.7346 1.5208
Dopamine3-O-sulfate 0.1189 0.3747 3.2781 1.1874 3.3056 0.4961 0.8575 0.9212
Doxylamine 0.0573 3.4652 0.0772 2.1194 0.0747 0.1746 0.3655 0.4612
Dubinidine 0.1607 0.3167 0.2633 0.2467 0.1811 0.2861 2.4352 0.4705
(E)-3,4,5-Trimethoxycinnamic acid 0.0296 0.4862 1.6978 1.5193 1.3895 0.6951 0.7340 0.8478
Ecgonine 0.0017 0.7991 1.4706 0.8371 1.0152 1.7725 0.8327 0.9112
Ecgonine methyl ester 0.0385 0.6415 1.1799 0.8542 1.8261 1.6391 0.8742 0.8649
Ectoine 0.0494 0.4886 0.7811 0.8485 0.6736 0.7170 1.3691 1.1876
Elaeokanine C 0.5664 1.4133 1.2477 0.7505 0.9436 1.5244 1.0094 0.7057
Eperisone 0.1207 0.1804 0.1623 0.7189 0.1692 0.1459 2.0363 0.6751
Erucamide 1.2993 0.4715 0.5602 1.4906 1.4548 0.5590 0.7566 1.2116
Escitalopram 0.0642 0.1059 0.0953 2.8366 0.0857 0.0880 0.1118 0.7491
ETHANOLAMINE PHOSPHATE 0.0058 1.0806 1.1642 0.9637 0.9334 0.8622 1.0973 1.0776
Ethyl3-oxohexanoate 0.3386 0.3197 0.2850 0.3896 0.2918 2.7898 1.1040 0.3950
Ethyl ?-bromopropionate 0.0167 1.1282 1.1330 0.9575 1.2950 1.2497 0.8819 1.0865
Ethyl palmitoleate 2.0469 1.0519 0.9277 1.0690 1.1297 0.9497 0.9192 0.9642
Etodolac 0.1319 0.3447 0.1528 0.2058 2.3995 1.7975 1.5183 0.6901
fenamidone 0.1471 0.2491 0.3216 0.4054 0.2204 1.7868 1.5074 0.6855
Ferulate 0.0082 0.3704 22.8252 0.3440 0.5132 0.2421 0.4195 1.1108
Fluconazole 0.0040 0.0072 0.0078 0.0067 0.0051 4.3331 0.7758 0.5269
Fluorene 0.2926 0.3815 0.6996 1.8906 0.2014 0.3491 0.6355 1.1744
Flurandrenolide 0.0056 0.0610 0.2278 0.9884 0.3120 2.5815 0.5521 0.9142
Fomepizole 0.0130 1.0257 2.1779 0.9384 1.6100 1.3720 0.8166 0.8557
Furfural 0.0145 1.3215 0.7969 0.9632 1.8462 0.8885 1.0385 0.9802
Gabapentin 0.0013 0.7287 0.0050 0.4274 0.0015 0.2561 1.9546 1.5542
gamma-Glu-gln 0.0136 0.7504 0.4369 1.0979 1.7053 0.7197 1.0522 1.1832
gamma-Glutamyl-gamma-aminobutyraldehyde 0.1371 0.9767 0.7972 0.9541 0.7029 0.8733 1.2649 0.6990
gamma-Glutamyl-gamma-aminobutyraye 0.0571 0.5738 0.6909 0.7322 1.2204 2.0904 0.8881 0.7758
GLUCONOLACTONE 0.1424 1.4594 0.5793 0.5488 0.7873 1.1334 1.4503 0.7293
Glu-Gly 0.0324 0.9403 0.7518 0.9490 2.0289 0.4393 1.2551 1.1622
glutaraldehyde 0.1856 0.4393 0.2741 0.7454 0.7684 1.0950 1.4033 0.8839
GLUTARYLCARNITINE 0.0403 0.4838 1.0038 0.9368 1.5980 1.3163 0.9937 0.9051
glutathione disulfide 0.0307 0.1378 0.3908 1.1205 0.2844 0.2922 1.4875 0.9889
Glycochenodeoxycholic acid 0.0341 1.0557 0.4091 1.1370 2.1510 0.7714 0.9298 1.1394
Glycocholic acid 0.0379 0.5566 0.2590 0.6930 3.5101 0.7998 1.3419 0.9944
Gly-Lys 0.0059 1.0257 0.2881 0.8601 0.5690 1.3967 1.1310 0.7579
Gly-Pro(Glycylproline) 0.0057 0.7538 1.2444 1.0724 1.3699 1.1039 0.8926 1.0511
guaietolin 0.0365 1.3770 0.5215 1.2821 1.8167 0.8552 0.8357 0.7703
Guanine 0.0703 0.1050 0.3635 1.3718 0.0851 0.1451 1.3573 0.9518
Guvacoline 0.0899 1.0515 0.7046 1.5333 0.8430 0.5562 0.8488 0.7753
Haplopine 0.0826 0.7091 0.7922 1.1268 0.6242 0.3802 1.5173 0.2477
Hexanoylcarnitine 0.0028 0.8060 1.3722 0.7771 1.7709 1.4773 0.9866 0.8829
Hexanoylglycine 0.1636 1.0211 0.2196 0.3752 0.6728 0.3187 2.0613 0.8530
hexobarbital 0.0995 0.5001 0.3246 0.8792 0.4876 1.0034 1.2977 1.0189
Hexylamine 0.0008 0.6930 1.8595 1.3222 0.6282 1.0577 0.6944 1.0787
Hexylresorcinol 0.0518 0.0945 0.0858 0.1081 0.3874 4.8448 0.4961 0.1491
Hippuric acid 0.0049 0.3040 0.1461 0.9433 0.6326 1.3749 1.1260 0.9028
Homoarginine 0.0107 0.8080 0.8050 1.1570 0.6670 0.7400 1.0441 1.1402
Homogentisic acid 0.0251 2.7280 0.7098 0.8123 0.6233 1.3639 0.9066 0.8192
homomethionine 0.0146 2.0043 1.3762 0.6531 1.6063 0.9527 1.1628 1.0255
Hordenine 0.0383 0.0777 0.0460 2.2947 0.5992 0.1639 0.5028 0.8941
hydralazine 0.0637 0.1220 0.1116 2.0590 0.1041 1.1045 0.4502 0.3533
HYDROQUINONE 0.4106 1.6473 0.5759 0.7293 3.2442 1.5634 0.8023 0.9037
Hydroxy bupropion 0.0256 0.0970 0.0807 0.0765 0.0486 0.1259 2.5620 1.0473
Hydroxyhexanoycarnitine 0.0418 0.7421 1.9918 0.7559 2.4832 1.7314 0.8004 0.8421
hypaphorine 0.0052 0.4052 1.5508 0.8694 0.3128 0.9356 1.2564 1.0830
Hypoxanthine 0.0019 0.3984 0.7502 1.2716 0.3859 0.3689 1.1312 1.3723
Imafen 0.0725 0.8964 0.5439 1.4966 0.9277 0.6388 0.7996 1.0205
Imagabalin 0.0156 1.6924 0.5308 1.0376 0.7043 0.4807 1.4914 0.0536
Imidazol-5-yl-pyruvate 0.1164 1.0154 0.9676 0.5730 3.0877 1.8554 0.9067 0.8264
Indane 0.0700 1.7487 2.2537 1.0185 0.3104 2.2028 0.4591 0.4353
Indole-3-acetaldoxime 0.0302 1.0173 1.5147 1.0836 1.2364 1.7181 0.6110 0.8052
Indole-3-acetamide 0.0494 0.0635 0.0577 0.0456 1.1051 2.8960 1.3495 0.4694
Indole-3-acetic acid 0.0173 0.7571 0.4427 1.0485 0.3935 1.1218 1.0744 0.9384
Indole-3-lactic acid 0.0409 0.8603 0.9456 0.7645 1.4052 1.3175 1.1460 0.8178
Indole-5_6-quinone 0.1074 1.1756 0.7784 1.0680 0.4552 1.7773 0.6451 0.9588
INDOLEACETALDEHYDE 0.0087 0.2886 0.2663 0.6778 0.0624 0.1564 1.9595 1.0207
Indoline 0.0000 1.3666 0.9056 1.0493 1.2654 1.0908 0.8877 0.9969
Indolylmethylthiohydroximate 0.0333 1.9798 0.9246 1.1632 1.0482 1.4562 0.6487 0.6141
Inosine 0.0120 0.3740 0.6798 1.3055 0.3164 0.3239 1.1666 1.2633
intercept 0.1457 1.5615 2.3345 1.2454 0.4047 1.9848 0.3826 0.3683
Iohexol 0.0541 0.1116 1.3195 0.2934 0.0769 0.7949 1.4734 2.6633
Isoamyl cyanide 0.1771 0.6140 0.3490 2.0533 0.2665 0.3210 0.7204 0.3894
Isococculidine 0.1159 0.5841 0.1914 1.7589 0.8257 0.3905 0.8064 0.8325
Isoniazid pyruvate 0.1013 0.8524 0.1522 0.1650 0.1393 0.3580 2.3587 0.6762
Kanosamine 0.0500 1.3957 1.0087 0.7893 1.2888 1.3292 1.0435 0.8376
Ketamine 0.0024 0.0036 0.0037 0.0049 1.1361 6.0326 0.0144 0.0406
Lactamide 0.0221 0.9873 1.4241 0.9077 1.3983 1.5136 0.8386 0.9159
L-alpha-lysophosphatidylcholine 0.0179 0.8156 0.6937 1.0784 0.5489 0.9215 1.0746 1.0404
Lamotrigine 0.0053 0.0109 0.0088 1.1429 0.0083 3.6831 0.0111 0.6220
L-Arginine 0.0164 0.5960 1.0038 0.9799 0.5732 1.2045 1.0494 0.9847
L-Ascorbate 6-phosphate 0.0843 1.5524 0.5247 0.4818 0.5099 0.9717 1.5577 0.8936
Laudanosine 0.0049 0.0086 0.0079 0.0072 0.0058 5.9651 0.0118 0.4526
Lauramide 0.7484 2.2676 1.4072 1.0978 0.5313 1.5096 0.5961 0.6961
LAUROYLCARNITINE 0.0249 0.9789 1.4492 0.7194 0.8466 0.9821 1.3307 0.8423
L-Carnitinamide 0.0101 0.8804 0.7438 0.9748 0.8003 0.9364 1.1461 0.9895
L-Citrulline 0.0078 0.5411 0.7193 1.0253 0.8160 1.0027 1.0859 1.0869
L-Cystine 0.0237 1.2194 0.7302 0.7990 1.1301 1.1310 1.2378 0.6657
Leu-Val 0.0848 0.4823 0.5017 0.7768 0.4024 0.7485 1.5701 0.8127
Levetiracetam 0.0022 0.7559 0.0067 0.7668 0.0037 0.0116 1.5544 2.2494
L-Formylkynurenine 0.0128 0.5264 0.3836 1.1177 0.5223 0.9946 0.9265 1.5318
L-gamma-Glutamyl-L-leucine 0.0036 0.8879 0.8814 1.0344 1.8607 1.1259 0.9037 1.0011
L-Glutamic acid 0.0044 0.8355 0.7757 1.0808 1.3216 1.1253 0.9169 1.0042
L-Glutamine 0.0051 0.8790 1.2942 1.0484 1.0311 1.0280 0.9766 0.9819
L-Histidine 0.0222 1.7786 0.6284 1.2359 0.3246 1.0676 0.8190 0.8062
L-Homocitrulline 0.0272 0.5838 1.3263 0.8840 1.3689 1.9277 0.7541 0.8161
L-Homocysteic acid 0.0064 1.2031 0.7346 1.0145 1.3041 0.7260 1.1079 1.0635
L-Homocystine 0.0097 1.9958 0.9112 1.1462 0.7200 1.4616 0.6698 0.6732
L-Hypoglycin 0.0066 0.7661 0.7644 0.6662 1.4188 1.8889 0.9726 0.8743
Lidocaine 0.0049 0.2200 10.0409 0.9823 0.1664 0.3491 0.8563 0.9478
Limonene-1_2-diol 0.2369 0.4959 1.9266 1.4951 0.6335 0.9642 0.6244 0.9653
L-Indospicine 0.0311 1.3765 0.3329 0.6800 1.7374 1.3414 1.1099 1.0087
Linezolid 0.0937 0.1649 0.1437 0.1663 30.0488 0.1330 0.1665 0.9949
Linoleyl carnitine 0.0216 0.9794 1.4370 1.3058 0.7108 1.0636 0.7082 1.0277
L-Isoleucine 0.0006 0.8758 0.8408 0.8235 1.0233 0.4117 1.5309 0.9324
L-Lysine 0.0157 0.7279 0.9009 1.0176 1.0026 1.1281 1.0073 0.9888
L-Methionine 0.0005 0.7705 0.7031 0.9783 1.2338 1.0518 1.0624 1.0238
L-MethionineS-oxide 0.0212 1.0837 0.8865 1.0586 0.8746 1.1429 0.9426 0.9282
L-Octanoylcarnitine 0.0016 1.0739 1.3346 0.7316 1.5254 0.9914 1.2305 0.9434
Lotaustralin 0.0070 0.8053 0.9291 0.9386 2.5821 1.5089 0.7636 0.9881
L-Phenylalanine 0.0310 0.6784 1.0800 1.0173 0.9758 1.3055 0.9584 0.8442
L-Proline 0.0078 0.4336 0.6170 0.7610 0.8208 1.2373 1.2872 0.9202
L-Pyroglutamic acid 0.0085 0.7882 0.7728 1.0855 1.0999 0.8316 1.0573 1.0738
L-Rhamnose 0.0418 1.3330 1.7631 1.0390 0.6234 2.2140 0.4907 0.4868
L-Threonine 0.0099 0.7006 0.5393 0.8197 0.9163 2.0108 0.8787 0.7298
L-Tryptophan 0.0002 0.9775 0.7788 1.0006 1.1227 0.7976 1.1211 1.0854
L-Tyrosine 0.0000 0.9596 0.8944 0.9921 1.1472 1.0141 1.0314 1.0337
L-Tyrosine methyl ester 0.0058 1.1484 0.9069 0.9978 1.3769 1.0034 0.9910 1.0202
Maltitol 0.2669 0.2334 0.7595 1.5003 2.8402 0.1774 1.1237 0.3700
Mannitol 0.0795 0.6086 0.6681 0.8169 1.7604 1.1615 1.2228 0.7355
Maraniol 1.7419 0.9940 0.8597 1.2267 0.8393 1.0195 0.7482 1.0990
(-)-Medicarpin 0.0238 1.9780 1.3848 0.7622 1.2142 1.7609 0.7948 0.7181
Melatonin 0.0106 0.6199 1.0271 0.9636 1.0818 0.4870 1.3130 1.1666
meso-Tartaric acid 0.0600 0.8610 1.2803 1.1340 0.3974 0.7464 1.0686 1.0322
Metalaxyl 0.0070 0.7420 0.9451 0.7187 0.2238 1.4953 1.1481 1.0358
Metamiton 0.0364 0.0477 0.0451 1.1700 0.0537 3.1356 0.2957 0.4180
Metazachlor OXA 0.1288 1.3375 0.2513 0.6174 2.0114 0.6757 1.5534 0.7350
Metformin 0.0055 4.1858 0.2293 0.6124 0.0136 0.0979 1.4029 1.4616
Methadone 0.1260 0.2075 0.1964 0.1906 27.6929 0.2131 0.3286 0.8115
metharbital 0.0393 1.0250 0.7200 1.1621 1.0256 1.3332 0.8230 0.7239
Methohexital 0.0203 0.6468 0.8417 1.0783 0.7685 1.3749 0.8885 0.9105
methyl 3,4,5-trihydroxycyclohex-1-ene-1-carboxylate 0.0126 0.3683 0.5077 0.9299 0.3111 1.3321 1.1678 0.8305
Methyl 6-isopropyl-2-oxooctahydro-2H-cyclohepta[b]furan-3-carboxylate 1.8757 0.8695 0.8741 1.0374 0.9397 1.1774 0.9372 0.7962
Methyl alpha-aspartylphenylalaninate 0.0081 1.5046 0.8809 1.0494 1.8376 0.9958 0.8796 0.9717
Methylimidazoleacetic acid 0.0197 0.0928 0.1829 0.8850 0.4881 0.3638 1.5819 1.3198
Methyl isonicotinate 0.0035 0.8145 0.4829 1.3301 0.2600 0.1421 1.1969 1.2455
Methyl N-acetylglycylglycylglycinate 0.0135 0.5378 0.8854 1.0463 2.0780 1.8126 0.6640 0.7526
Methyl N-(tert-butoxycarbonyl)-L-leucinate 0.0020 0.7416 0.8531 0.8864 1.4959 1.9728 0.7520 0.7625
Metoprolol 0.0095 1.1940 0.4342 0.9261 0.1575 0.0226 1.6028 1.1929
Metronidazole 0.0006 0.0035 0.0021 0.8356 0.0034 0.0014 1.6330 2.1262
Metronidazole-OH 0.0015 0.1824 0.0038 0.4945 0.1091 0.0450 2.0797 1.4843
met-thr 0.0216 0.3322 0.1947 0.9722 0.5159 0.7371 1.3193 1.2063
Mirtazapine 0.0332 0.0496 8.3813 0.1762 17.1981 0.2642 0.4889 0.9188
Monoolein 0.2229 1.2922 1.3472 1.6522 0.4868 1.2540 0.3295 0.8257
Morphine 0.1026 0.4246 1.2682 0.6973 1.7630 1.2303 1.2932 0.6814
Morphine-3-glucuronide 0.0172 0.0265 0.0253 0.0244 8.2088 4.0049 0.3414 0.3201
Moxisylyte 0.1620 0.3866 0.1888 0.3616 0.2172 0.2275 2.2538 0.8067
Myristamide 1.5716 3.1093 1.1689 1.0342 0.8104 1.1293 0.6487 0.8377
N1-Acetylspermidine 0.0139 1.2419 1.6582 0.8671 1.4176 1.2298 0.9637 0.8999
N1-Methyl-2-pyridone-5-carboxamide 0.0013 0.7113 1.1594 0.8053 1.4733 1.8368 0.8435 0.8703
N2-Acetyl-L-aminoadipate 0.0620 1.0352 0.0542 2.6625 0.0637 0.0604 0.3539 0.0962
N2-Acetyl-L-lysine 0.0118 1.0781 0.9612 0.8682 2.3755 0.9153 1.0945 0.9741
N2-(D-1-Carboxyethyl)-L-lysine 0.0042 0.6358 1.0085 0.9660 1.0954 0.6866 1.2308 1.1063
N2-Dimethylguanosine 0.0114 1.4424 0.9624 0.8230 1.3210 1.3051 1.0176 0.8468
N-(2-Hydroxyethyl)heptadecanamide 0.0355 3.7971 2.1325 0.8115 0.0294 0.7243 0.8712 1.2895
N-[(2S)-2-Hydroxypropanoyl]methionine 0.0063 1.4243 1.7340 1.0012 1.5935 1.1080 0.8620 0.8750
N3,N4-Dimethyl-L-arginine 0.0036 0.8818 1.1680 0.9405 1.2672 1.2755 0.9609 0.9389
N4-Acetylcytidine 0.0191 0.8112 1.1842 0.7753 2.1002 1.5570 0.9335 0.8976
N4-Acetylsulfamethoxazole 0.0038 0.0074 0.0066 0.8088 0.0063 2.0134 1.0069 1.0250
N5-(L-1-Carboxyethyl)-L-ornithine 0.0029 0.8521 0.9811 1.0681 1.1529 0.6583 1.1029 1.1609
N6-Acetyl-L-lysine 0.0133 0.7886 0.9407 0.9665 1.1777 1.4999 0.8912 0.8496
N6-Acetyl-N6-hydroxy-L-lysine 0.0830 0.0549 0.0639 1.1949 0.0558 0.2225 1.5934 0.6798
N-(6-Aminohexanoyl)-6-aminohexanoate 0.0375 0.5852 7.6969 0.8415 0.8146 1.8135 0.3847 0.8699
N6,N6,N6-Trimethyl-L-lysine 0.0056 0.7049 0.9544 0.7555 1.1327 1.8658 0.9185 0.8690
N-ACETYLASPARAGINE 0.0256 0.3487 0.4987 0.9576 1.4362 2.0739 0.7360 0.7120
N-Acetyl-L-citrulline 0.0998 0.7980 0.2759 1.0720 0.6135 1.1987 1.0503 0.7745
N-Acetylleucylleucine 0.0010 1.9503 0.3631 1.5745 2.5447 0.2455 0.6467 1.0915
N-Acetyl-L-glutamate5-semialdehyde 0.0030 0.5119 0.7677 0.9882 1.7223 0.6423 1.1688 1.2791
N-Acetyl-L-glutamicacid 0.0915 0.1317 0.1859 0.8689 0.1583 2.7904 0.6426 0.6424
N-Acetyl-L-histidine 0.1011 0.5911 1.2157 1.1148 0.8987 1.2915 0.9095 0.7406
N-Acetylornithine 0.0090 1.1177 1.0221 1.0663 0.8375 0.8803 1.0377 0.9711
N-Acetylserotonin 0.0207 1.1529 0.8397 1.0169 1.4740 0.6906 1.0844 1.1445
N-ACETYL ZONISAMIDE 0.2013 0.3456 0.4609 0.3032 0.2354 0.3362 2.3362 0.4635
N-alpha-Acetylarginine 0.0037 0.7981 0.9243 0.9558 2.5571 1.4564 0.7813 0.9710
N(alpha)-Benzyloxycarbonyl-L-leucine 0.0452 0.6245 0.5526 0.7559 0.8327 1.5987 1.1098 0.8691
N-Benzylformamide 0.0153 1.3345 1.4775 1.0349 1.5396 1.3507 0.7637 0.8270
N-Butyryl-L-homoserinelactone 0.0720 1.1253 1.2101 0.7145 4.9395 1.1466 0.8890 1.0131
NDA 0.0267 0.7914 1.1311 0.9009 0.6988 1.6386 0.9355 0.7489
N-Desmethylvenlafaxine 0.0701 0.1197 0.1055 0.2237 0.0939 0.0970 2.3654 1.2708
N-D-Glucosylarylamine 0.0547 0.5809 0.7542 0.7848 0.9250 2.2205 0.8258 0.6654
n-Hexanamide 0.0576 0.4184 1.0167 0.8486 0.8626 1.1136 1.2664 0.8009
Nicotianamine 0.0386 0.4137 0.4595 0.6058 1.3198 2.7872 0.7379 0.6520
Nicotinuric acid 0.0251 0.4439 0.7379 0.7045 1.1346 1.4705 1.2353 0.7692
N-(indol-3-ylacetyl)glutamine 0.1541 0.4549 0.2453 0.7227 0.1854 0.5844 1.8252 0.5047
Nisoxetine 0.2232 0.3466 0.3310 0.6838 0.4430 0.5397 1.8496 0.5690
Nithiazide 0.0306 1.2202 1.0072 0.8930 1.4792 1.1450 0.9921 1.0249
Nitrosoheptamethyleneimine 0.0231 2.1011 0.7315 0.8275 0.7175 0.5840 1.2677 1.0806
N-Methyl-2-pyrrolidone 0.0014 1.1825 0.7451 0.9968 1.1580 0.7645 1.0931 1.1537
N-Methylanhalonine 0.0506 2.7434 0.3175 0.8383 0.7085 1.2395 0.9543 0.8492
N,N-Diisopropylethylamine (DIPEA) 0.0099 0.8938 1.2487 1.1077 1.1406 0.9283 0.9700 0.9568
N,N^-Diphenylguanidine 0.0022 0.6874 0.5546 1.4748 0.5416 1.1686 0.7066 0.7369
N-Nitrosoguvacoline 0.0169 0.3132 1.3717 0.7262 0.9370 1.7216 1.0715 0.7951
Noradrenaline 0.0269 1.5567 0.0465 2.4146 0.0594 0.0503 0.4890 0.2027
Norketamine 0.0131 0.0235 0.0224 0.0203 1.4406 5.7980 0.0771 0.0685
N-palmitoylserinol 0.2525 3.3396 1.7286 0.8095 0.1386 0.6644 1.0526 1.0297
N-Propyldodecanamide 1.7298 2.6927 1.2488 1.0124 0.7867 1.2795 0.6628 0.7669
n-Ribosylhistidine 0.0321 0.4935 0.6136 0.5793 1.7023 2.6406 0.7888 0.6251
N-Undecanoylglycine 0.3826 0.9957 0.9101 0.9000 1.0257 1.3734 0.9725 0.8947
O-3-methylglutarylcarnitine 0.0059 1.3702 1.1608 0.8084 2.6173 2.0714 0.5943 0.7193
O-(4,8-dimethylnonanoyl)carnitine 0.1313 0.7776 1.1477 0.8345 1.0383 0.9166 1.2770 0.8783
Octadecanoic acid 1.2595 0.4816 0.3621 1.8197 0.4558 0.4366 0.3726 2.0135
Oleamide 0.9860 1.0552 1.0939 1.6534 0.8661 1.4144 0.3300 0.5279
OLEOYL-GLYCEROL 1.1763 1.0817 1.4323 1.3920 0.6203 1.3238 0.5275 0.7685
Olomoucine 0.3261 1.4459 1.2427 1.2893 0.5259 1.4186 0.6035 0.6949
Omeprazole sulphone 0.0945 2.7046 0.1342 1.7690 0.1382 0.1212 0.6947 0.8481
Ondansetron 0.0222 0.8366 1.0684 0.7536 10.4221 0.6986 0.6871 1.0514
OPHTHALMATE 0.0195 0.2003 0.2110 0.3952 1.4102 2.9430 0.9179 0.5864
ornithinoalanine 0.0061 0.7977 0.7103 0.9191 0.8837 1.0814 1.1263 1.0204
Orthophosphate 0.0003 0.8341 0.9742 1.0303 1.0519 1.3132 0.8758 1.0155
Oxepanone 0.7037 1.2579 0.6401 0.6737 5.4157 1.1963 0.9146 0.8508
Oxido(dioxo)vanadium 0.1337 1.0150 1.1581 1.1177 0.8710 1.1960 0.8295 0.9885
Oxohongdenafil 0.0092 0.0672 0.2186 0.9356 0.3108 2.8233 0.5302 0.7555
Oxycodone 0.0433 0.1219 2.9864 0.3166 0.1976 0.8923 1.7697 0.9195
Palmitoleic Acid 0.0404 1.6348 0.6491 0.8935 1.1599 0.9163 1.0662 1.1337
Palmitoylcarnitine 0.0473 0.7846 1.0903 1.3191 0.9220 0.9264 0.8283 0.9209
Pantothenicacid(VitaminB5) 0.0126 0.8215 1.4693 0.7977 0.9289 1.5285 0.9987 0.8796
Paracetamol 0.0007 1.1153 1.5375 1.4816 1.4885 0.7009 0.6198 1.0813
p-dimethylinamyl benzoate 0.1952 9.2489 0.2589 0.2486 0.2149 0.2977 1.1549 0.7027
PEG-4 0.1344 0.7529 0.9948 1.1626 0.8818 1.0217 0.8596 1.1936
PEG n5 0.0427 0.6248 0.7592 1.2188 1.2624 1.1213 0.7816 1.1517
PEG n6 0.0170 0.2919 0.4365 1.3100 0.6421 1.3447 0.6929 1.2054
PEG n7 0.0075 0.1074 0.3358 1.2483 0.3742 1.8472 0.5683 1.1830
PEG n8 0.0072 0.0642 0.2851 1.2051 0.2946 2.1827 0.5199 0.9849
Phenazone 0.2104 0.3765 0.3235 2.1734 0.2381 0.2987 0.3475 1.4561
Phenol 0.0008 0.9462 0.8844 0.9842 1.1085 1.0171 1.0443 1.0289
Phenylacetaldehyde 0.5071 0.9346 0.8509 0.9503 1.0696 0.9780 1.0743 1.0556
Phenylglyoxylic acid 0.0836 0.1780 0.3361 1.1450 0.1143 1.7032 0.8972 0.6391
Phenylisocyanate 0.0314 1.0678 0.6438 0.8201 0.5545 0.8948 1.3972 0.6856
Phenylpyruvate 0.0002 0.9545 0.8885 0.9860 1.1348 1.0091 1.0431 1.0287
Phthalic anhydride 1.8752 0.9501 1.0196 1.1611 0.8667 1.0191 0.8242 0.9990
Phylloquinone 0.4489 0.9643 0.3925 0.7482 0.7093 0.7420 1.5220 0.7556
Pimilprost 0.2417 1.4094 1.6653 1.1891 0.6322 1.7456 0.5315 0.6071
Pipecolinic acid 0.0008 0.8214 0.9136 1.0801 0.7252 0.8878 1.0176 1.1827
Piperideine 0.0033 0.6554 0.7269 0.8050 1.7427 1.5953 0.9617 0.9332
Piperidine 0.0170 0.4148 0.4398 0.5338 8.4230 1.6603 0.7926 0.6844
Piperine 0.4788 0.3066 0.2674 1.9924 0.2800 0.3750 0.5376 1.2495
Pitavastatin 0.0099 0.0222 0.1841 0.2730 0.0213 5.1238 0.1157 0.5860
Porphobilinogen 0.0600 0.7844 0.7274 0.7021 0.7491 1.5681 1.1769 0.7586
Porphyrin 0.0146 0.9950 0.8339 1.0128 1.2977 0.9026 1.0434 1.0698
Precocene II 0.1542 1.4091 1.2654 1.4077 0.3499 1.9299 0.3264 0.5049
Prolylleucine 0.0005 0.8751 1.0619 0.8256 1.7091 1.9436 0.7635 0.7914
Promethazine sulfoxide 0.0639 0.1272 1.3541 0.0960 0.0866 0.4640 2.3818 0.6771
pronetalol 0.0067 0.7257 1.0269 0.8489 1.6522 2.1708 0.6769 0.7319
Propionylcarnitine 0.0005 0.8064 1.4960 0.8710 1.0203 1.8039 0.7851 0.9038
Pulcherriminic acid 0.0446 1.8574 0.4382 0.4860 0.8975 0.5152 1.6919 0.9583
Pyridoxamine 0.0165 0.3706 0.9700 0.8709 0.9561 1.2881 1.1358 0.9067
Pyroglutamic Acid 0.0090 1.6448 0.3768 0.7634 0.2813 0.6468 1.4043 1.1335
Pyrrolidine 0.0006 0.8943 0.9370 0.9813 1.2724 1.2642 0.9341 0.9748
Pyrrolidine, 1-oleoyl- 1.6495 0.6617 0.6385 1.5798 0.7366 0.8340 0.6215 0.9714
Quinic acid 0.0180 0.9769 1.2446 0.8323 1.1643 1.3172 1.0381 0.9085
quinidinone 0.2379 0.1405 0.1371 2.5811 0.1412 0.1394 0.1281 1.3591
Quinoline 0.0077 0.9297 0.8474 1.0303 1.1144 0.9058 1.0583 1.0332
(R)-3-hydroxybutyrylcarnitine 0.0056 0.8939 2.2260 0.6718 2.2617 1.6042 0.9161 0.8526
(R)-Coclaurine 0.0570 0.1239 0.0815 0.0894 8.0235 3.8569 0.3174 0.4252
Retinol 0.0988 0.2874 1.2476 0.7238 0.3327 0.4322 1.5108 1.6242
Ropivacaine 0.0285 0.0461 0.0418 0.0369 0.0293 0.0370 2.6602 1.0206
(S)-4-Amino-5-oxopentanoate 0.0291 0.5501 0.6794 0.6160 1.1373 1.0917 1.3994 1.0795
S-(5-histidyl)cysteine sulfoxide 0.0533 0.1153 0.3263 1.0174 0.4174 2.4845 0.5822 0.7927
S-ADENOSYLHOMOCYSTEINE 0.0292 0.9412 1.2896 0.8354 1.1374 1.3466 1.0287 0.8923
Salsolinol 0.0026 1.6844 0.9349 1.0272 1.5322 0.9713 0.8881 1.0379
SEROTONIN 0.0170 0.0456 0.0446 0.0484 0.0543 0.0463 2.6567 0.9749
Shikimate 0.0205 0.8369 0.8685 0.8016 1.6294 1.4894 0.9857 0.9427
Sinapylalcohol 0.2743 0.7935 0.9002 1.1269 0.7961 1.0378 0.9225 1.0736
S-Methyl-1-thio-D-glycerate 0.2774 0.6011 0.9021 0.6407 0.3762 0.7647 1.5770 1.0166
sn-glycero-3-Phosphocholine 0.0069 1.7610 0.6379 1.1752 0.4623 0.9289 0.8981 0.9286
Spermine 0.0106 0.5881 0.4343 1.5802 0.4280 1.0998 0.6840 0.6998
S-Phenyl-D-cysteine 0.1045 1.4172 0.2877 0.2876 0.1360 0.1539 2.2053 0.8566
Sphingosine 0.0363 3.0241 2.3398 0.8878 0.5093 0.9777 0.7780 1.1232
Spiroxamine 0.2231 0.8180 2.5213 0.8481 0.6161 2.3569 0.5621 0.6278
Succinic anhydride 0.0317 0.7558 0.6893 1.0486 0.7750 1.5674 0.8468 0.8160
Sulfafurazole 0.1925 6.2928 0.2304 1.1619 0.4315 0.2800 0.7405 0.5761
Sulfamethoxazole 0.0010 0.0022 0.0019 0.7846 0.0013 2.1574 0.8812 1.3033
Sulfonylbismethane 0.0048 0.7705 2.3740 0.7616 0.6942 0.4727 1.4021 1.2028
Sulforaphane 0.0549 0.5733 1.2983 1.3930 0.7467 0.8691 0.7628 1.0959
Talampanel 0.0963 0.1841 0.1580 0.1383 30.7541 0.1813 0.1679 0.7977
Talampicillin 0.0447 0.0968 0.0615 0.0846 7.1063 4.0918 0.3523 0.1924
Taurohyocholate 0.0727 0.7913 1.2525 0.6820 1.0751 1.3298 1.1973 0.9175
Tazobactam 0.0764 0.2243 0.2255 2.3117 0.2089 0.4483 0.4115 0.6648
Tetraacetylethylenediamine 0.0036 0.3050 0.9312 0.5325 1.8308 1.7687 1.2001 0.7754
Tetralin 0.3225 0.6244 0.4489 0.4636 0.4239 0.4788 1.9973 0.6940
Theobromine 0.0024 0.6158 1.0729 1.4882 0.0572 0.1505 1.0817 1.1146
Theophylline 0.0018 0.2463 0.0556 1.2858 0.0532 0.3097 1.2681 1.2956
THTA 0.0057 1.8761 1.4050 0.6574 1.6120 0.9636 1.1517 1.0836
Tolperisone 0.0600 0.0989 0.0978 1.1611 0.0838 0.0841 1.6772 0.6941
tranexamic acid 0.1993 0.5621 0.5164 0.7075 0.3340 0.9852 1.5527 0.6621
trans-2-Dodecenoylcarnitine 0.0256 0.9015 1.7112 0.7943 1.3666 1.2179 1.1229 0.7576
trans-3-Indoleacrylic acid 0.0001 0.9779 0.7788 1.0018 1.1233 0.7974 1.1200 1.0854
(-)-trans-Carveol 0.1446 0.8398 0.8580 1.4916 0.4146 0.3381 1.0122 0.8706
Trans-Cinnamicacid 0.0001 1.3511 0.8964 1.0375 1.2772 1.1433 0.8770 0.9906
Triethylene glycol 0.0588 0.7173 1.0409 1.1272 0.8225 0.9649 0.9151 1.2396
Triisopropanolamine 0.0004 1.0017 0.8319 1.1900 0.6701 1.1922 0.9227 0.6052
Trilostane 0.1678 0.3275 0.5606 0.7633 0.2519 0.6159 1.7020 0.7055
trimethadione 0.0420 0.7320 1.4019 0.8351 3.7454 2.2486 0.5176 0.5323
Trimethoprim 0.0009 0.0038 0.0015 1.0564 0.0019 2.2029 0.6691 1.0923
TrimethylamineN-oxide 0.0017 0.8050 0.6148 0.9470 0.8951 0.5658 1.2743 1.2971
Trimethylsilyl N,O-bis(trimethylsilyl)serinate 0.1677 0.1047 0.0950 2.5871 0.1188 0.1034 0.0964 1.5532
Triphenylphosphine oxide 1.2066 0.9300 0.8584 1.0884 0.9876 0.9208 0.9929 0.9201
Tris(hydroxymethyl)aminomethane 0.0067 0.8270 1.0449 0.9063 0.9551 1.3913 0.9767 0.9418
Trp-Phe 0.0835 0.1539 0.8871 0.5734 1.0819 0.5552 1.7172 1.1454
tyramine sulfate 0.1033 0.7346 0.2612 0.3392 0.2305 3.4402 0.7642 0.5106
Uracil 0.0026 0.8351 0.9081 1.0072 0.7982 0.9241 1.0953 1.0614
Uramil 0.1418 0.3696 0.2746 0.5281 0.3565 0.3030 1.9947 0.9970
Uric acid 0.0003 0.9542 1.1852 0.8715 1.1729 0.7556 1.2527 1.0017
Uridine 0.0108 0.7191 0.9184 0.9910 0.6354 0.9237 1.1462 1.0309
Valclavam 0.1139 0.5315 0.6554 0.5007 1.0587 0.7522 1.7130 0.9520
Valine 0.0066 0.8978 0.9637 0.9786 1.3119 1.2950 0.9271 0.9362
Valylvaline 0.0467 0.6173 0.4551 0.9108 0.6871 1.2841 1.1522 0.8188
Venlafaxine 0.0114 0.0210 0.0181 0.8376 0.0171 0.0174 1.9355 1.0271
Veronal 0.0403 0.5763 0.6654 0.8070 0.6424 1.3441 1.1575 1.0086
Vestitol 0.2168 0.4843 0.4351 0.6655 0.4810 0.5926 1.7693 0.7164
Xanthine 0.0014 0.8405 1.0149 1.2407 1.9283 1.3227 0.6150 0.9827
Xanthohumol 0.0194 0.0440 0.2385 0.3322 0.0442 5.0397 0.1094 0.5264
Zalcitabine 0.0150 0.5920 1.5458 1.1413 0.4938 1.0926 0.9647 0.8271
Zearalenone 0.1657 0.1890 0.3164 0.1029 1.8979 4.3877 0.5309 0.2836
(Z)-Thiamethoxam 0.1324 0.2556 0.1492 0.1922 8.0786 2.2872 0.8539 0.7485
α-Aspartylphenylalanine 0.0614 0.7354 0.9568 0.7108 1.4070 1.8671 0.9571 0.7807
γ-Linolenic acid ethyl ester 0.1393 0.5101 0.5421 2.1428 0.2753 0.6073 0.3020 1.0760
Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

Factors:

F1group:-
F2group:COVID_before_ventilator
F3group:COVID_ICU-no vent
F4group:COVID_non-acute
F5group:COVID_undecided
F6group:COVID_ventilator
F7group:Healthy
F8group:QC
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