Data for Peroxide antimalarial extended treatment timecourse on trophozoite-stage P. falciparum parasites (Study ST001204)

(Analysis AN002004)

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

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MetaboliteF1F2F3F4F5F6F7F8F9F10F11F12F13F14F15F16F17F18F19F20F21F22F23F24F25F26F27F28F29F30F31F32
1-(11Z-octadecenyl)-sn-glycero-3-phosphocholine 0.8541 0.9020 0.9243 0.9020 0.9066 0.9199 0.9578 0.9794 0.8964 0.9115 0.9679 0.9836 0.9622 0.9230 0.7952 0.9906 0.9333 1.1401 1.3636 1.0907 1.0340 1.2576 1.3066 1.1434 1.1159 0.9815 0.7606 0.9785 0.8783 1.1260 1.0222 1.0909
1-(14-methyl-pentadecanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerol 1.1918 1.4969 1.3423 1.4282 1.0809 1.5503 1.9889 3.4141 1.3461 1.3550 1.7154 1.6028 1.4669 1.2867 1.6338 1.5902 0.3933 0.3639 0.3757 0.5038 0.4385 0.3920 0.4466 0.4294 0.2996 0.4443 0.4444 0.4393 0.3096 0.3616 0.4212 0.4465
1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one 0.3065 0.4368 0.6546 0.7854 0.2304 1.4322 2.5962 3.4642 0.3000 0.6975 0.7669 0.7702 0.3080 0.8300 1.0522 1.1354 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
13-14-DihydroPGF-1a 0.6064 1.6102 0.2179 0.1363 2.9188 2.6497 0.7753 0.9129 0.2525 0.8036 0.3381 0.1021 1.1972 0.8483 0.3024 0.2962 1.1317 0.6505 1.8266 0.7926 1.0975 1.0426 1.1564 0.4779 1.7658 3.3279 0.7643 1.5764 0.5787 0.9638 0.4646 0.6905
1,3-alpha-D-Mannosyl-(1,2-N-acetyl-alpha-D-glucosaminyl)-1,2-alpha- D-mannosyl-1,2-alpha-D-mannosyl-D-mannose 0.8358 0.8312 0.8436 0.8460 0.7767 0.7699 0.8978 0.9274 0.7991 0.8206 1.0581 0.8595 0.7306 0.8296 0.7891 0.8906 0.9713 1.1973 1.1193 1.3322 1.0592 1.2330 1.0142 1.5242 1.1701 1.0668 0.9687 1.3203 1.0286 1.0395 1.2103 1.2396
1-4-beta-D-Glucan 1.1797 0.6030 0.7895 1.4161 0.4811 0.4817 0.5557 0.9044 0.9225 0.6473 1.3070 2.1116 0.8831 0.9875 0.3578 0.4552 1.1749 1.1997 0.5251 0.4525 0.5128 0.8570 0.9381 1.1174 6.7880 0.4469 0.4632 0.4771 0.7189 0.6433 0.9945 0.6077
1-(O-alpha-D-glucopyranosyl)-3-keto-(25R,27R)-octacosanediol 0.9952 0.9247 1.1412 0.8889 0.8432 0.8498 1.1457 1.0528 1.1166 0.9088 1.0471 1.0800 0.8760 1.1315 1.2116 1.0221 0.9289 0.9952 0.9941 1.0673 0.9665 1.0025 0.7977 1.0172 0.8585 0.9314 0.9767 1.0492 0.8563 1.1424 0.9026 1.2786
(1R,4S)-fenchan-2-one 0.8301 1.1532 0.8692 1.2173 0.8538 0.9079 0.9048 0.9419 1.3460 0.8605 0.6759 0.8241 1.0153 0.9577 1.0703 1.0434 0.7629 1.3250 0.9212 0.7360 1.2744 0.9833 1.3939 1.2511 1.5208 0.9124 0.9532 1.1067 0.6959 0.9233 1.1028 0.6657
2,3-Dimethylmaleate 0.2142 0.2877 0.2803 0.2688 0.3939 0.3473 0.2277 0.3474 0.2147 0.3490 0.2619 0.2372 0.1837 0.3396 0.2827 0.2154 0.9611 1.4841 2.0470 2.1026 1.0453 1.5900 1.9592 2.2772 1.2307 1.5661 1.7644 2.1274 1.2249 1.8342 2.1536 2.1809
2,4-diamino-6-methyl-5,3^-(2-trifluoromethylphenoxy)prop-1^-yloxypyrimidine 0.8287 0.8925 0.8691 0.8070 0.7736 0.7834 0.8657 0.9015 0.7789 0.8246 0.9046 0.8399 0.8873 0.8119 0.8355 0.8418 1.0373 1.1574 1.4148 1.0815 1.0118 1.2605 1.0908 1.2774 1.3870 1.1446 1.0832 1.1371 1.0813 1.1873 1.0596 1.1425
(24R,24^R)-Fucosterol epoxide 0.7362 0.6736 0.8496 0.5936 0.8565 0.7830 0.6422 0.7023 0.6408 0.6931 0.6827 0.6407 0.6967 0.8000 0.8126 0.7576 1.1525 1.4484 1.3940 0.8940 1.3777 1.4322 1.2294 1.1755 1.4564 1.3034 1.4117 1.0785 1.1131 1.3686 1.3523 1.2513
2-(acetylamino)-1-5-anhydro-2-deoxy-3-O-b-D-galactopyranosyl-D-arabino-Hex-1-enitol 0.7578 0.8365 0.9384 0.8725 0.7737 0.8360 0.8166 0.8123 0.7894 0.9778 0.8979 0.8980 0.8346 0.7361 0.7848 0.8429 1.0881 1.1078 1.1769 1.0308 1.1134 1.0813 1.0972 1.3269 1.2080 1.2167 1.3564 1.0905 1.0542 1.1297 1.2528 1.2640
2(alpha-D-Mannosyl)-D-glycerate 0.7891 0.9324 1.2116 1.0114 0.9828 1.0079 0.8305 1.1197 0.8581 0.8324 0.9322 0.9973 0.9450 0.9752 0.9181 0.9052 1.0047 1.1827 0.9503 1.0197 1.0924 1.0665 1.1513 1.1272 0.9830 0.9036 0.9855 1.0606 1.1264 1.1291 0.9931 0.9750
2-Amino-2-deoxy-D-gluconate 0.6004 0.5539 0.7366 0.7901 0.5564 0.5686 0.8333 0.5158 0.4603 0.7988 0.4898 0.6900 0.6042 0.7143 0.6325 0.6676 1.4306 1.5395 1.2436 1.3326 1.5531 1.3471 1.3913 1.1208 1.7129 1.3205 1.3477 1.0118 1.1917 1.2732 1.5937 1.3775
2-amino-2-deoxyglucitol-6-phosphate 0.5193 0.5149 0.7738 0.7848 0.5203 0.7135 0.8221 0.8322 0.6841 0.6606 0.6460 0.6838 0.5642 0.7163 0.6138 0.7247 1.3675 1.3069 1.2071 1.1857 1.6493 1.2683 1.3165 1.3537 2.0696 0.9319 1.1383 1.0746 1.4865 1.5648 1.0465 1.2582
2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate 0.7243 0.9831 0.8003 0.8687 0.7286 0.8280 0.7212 0.9658 0.8934 0.7458 0.7850 0.8817 0.7274 0.9784 0.8727 0.8824 0.8706 0.9941 1.2027 1.4037 0.9237 1.0357 1.0682 1.6281 0.9815 1.1378 1.1160 1.4099 0.9220 1.1499 1.3407 1.4287
2-Amino-9,10-epoxy-8-oxodecanoic acid 0.8115 0.8429 0.7793 0.8961 0.6924 0.9230 0.9506 0.9902 0.9262 0.8555 1.0156 0.8718 0.8914 1.1164 0.8639 0.9281 1.1290 1.1649 1.1158 0.9202 0.9429 1.0749 1.2600 1.2511 1.2594 1.0137 1.0351 1.0467 1.1234 1.0337 1.1626 1.1116
2-Aminoacrylate 0.9080 1.0563 0.8671 0.8496 0.7376 0.6798 0.7581 0.8045 0.7244 0.7473 0.8344 0.7336 0.8099 0.9969 1.0099 0.8240 0.6398 0.8349 2.1510 0.9309 1.8110 0.6699 0.7740 0.8731 0.7804 2.0367 2.4635 0.9230 1.2525 0.9588 0.7370 0.8219
2-Aminophenol 0.8893 0.8510 1.0459 1.0619 1.1702 1.1073 0.9941 1.0649 1.0321 0.8662 1.2126 1.0125 1.1834 1.0737 1.0179 0.8485 0.9867 1.0183 1.0248 0.8036 1.0346 1.1486 0.9661 1.0704 0.7824 1.0243 0.9640 0.9913 1.0324 0.8276 1.0492 0.9726
2-chloro-3-methyl-maleylacetate 0.0572 0.0599 0.0480 0.0263 0.0448 0.0547 0.0459 0.0310 0.0325 0.0544 0.0463 0.0438 0.0609 0.0528 0.0507 0.0799 1.0439 1.4464 2.8364 1.9503 1.1256 2.0187 1.9802 2.8438 1.4267 1.4734 1.9086 1.9309 1.2037 1.6809 1.9030 2.2361
2-Ethylhexyl phthalate 1.0080 1.0607 1.0902 0.9809 0.9941 0.9852 0.9319 0.8964 0.9860 0.9861 0.9317 0.8694 0.9447 1.1000 1.0812 1.0064 0.9368 1.0754 1.0332 1.0019 1.0530 1.0400 1.0624 1.0230 0.9175 0.8437 0.9183 0.9343 0.9093 1.1195 1.2485 1.0302
2-Methylbutyroylcarnitine 0.6870 0.7188 0.7671 0.7145 0.7242 0.6951 0.6793 0.7094 0.7019 0.6862 0.6740 0.7131 0.6563 0.7526 0.6991 0.6635 1.3947 1.2972 1.2974 1.1656 1.2743 1.2434 1.2785 1.2135 1.5581 1.2605 1.2481 1.2256 1.4076 1.4087 1.2446 1.2402
2-S-Glutathionyl acetate 0.4930 0.7268 0.5948 0.4850 0.4851 0.5799 0.6414 0.6238 0.5274 0.6131 0.6856 0.6905 0.5563 0.6724 0.7335 0.6864 1.0735 1.3452 1.6687 1.4404 1.0994 1.3134 1.5837 1.6504 1.2012 1.1643 1.3932 1.4695 1.1524 1.3746 1.5861 1.6888
2-trans,4-cis-Decadienoylcarnitine 0.9777 1.1320 1.0294 1.1081 1.0666 0.8663 0.9162 1.0129 0.7856 0.9479 1.0320 0.9863 0.9777 0.9924 1.0603 1.0440 1.0931 1.1148 0.9784 0.9729 1.0256 1.0571 1.0308 0.9651 1.0310 0.9905 0.8555 0.8919 0.9870 1.0272 1.0058 1.0378
3,3^,4^,5,7-Pentahydroxy-8-methoxyflavone 1.0196 0.7249 0.7599 0.7688 0.7944 1.2031 1.2593 1.0144 0.7763 0.8460 0.9488 0.8004 0.8166 0.9134 0.7308 0.9632 0.8710 0.9677 1.3009 1.4236 0.7278 1.0059 1.2005 1.1565 0.8586 1.0313 1.2364 1.4337 0.9348 0.8613 1.1654 1.4850
3,4-Dihydroxy-L-phenylalanine 0.5475 1.3716 1.4809 1.1738 0.9371 1.0718 0.1780 0.9827 0.8544 1.2299 1.1905 0.5852 1.5895 0.7506 1.0231 1.3009 1.5597 1.0670 0.4862 0.5759 1.0181 1.0688 1.4051 0.8318 0.4672 0.9857 0.2170 0.9019 1.3923 1.5752 1.5278 0.6527
3-(4-Hydroxyphenyl)lactate 0.9362 1.0318 1.0170 1.1074 1.1145 0.9802 0.9193 1.0326 0.8511 0.9572 1.0564 0.8987 0.9976 0.9809 1.0099 1.0573 1.0089 1.0594 0.9690 1.1076 1.0691 0.9404 0.9088 0.9687 1.0384 0.9822 0.9294 1.0247 0.8917 1.0810 0.9746 1.0977
3,5,7-Trimethyl-2E,4E,6E,8E-undecatetraene 0.7543 1.2725 0.6668 0.7975 1.1605 1.0397 1.1757 1.0427 0.8161 0.7324 0.3913 0.5654 1.0494 0.9583 0.6989 0.9607 0.7959 1.4068 1.2955 0.9669 1.1508 1.2223 1.3004 1.2058 1.5819 1.3280 1.1703 1.2837 0.1353 1.2706 0.9629 0.8406
3,7,11,15-Tetramethyl-6,10,14-hexadecatrien-1-ol 0.8410 1.1340 0.9623 0.8453 1.2687 0.9911 1.0930 0.8603 0.9803 0.9576 0.9596 0.9118 0.8441 1.6762 0.7984 1.0323 0.6283 1.0334 0.5875 0.7721 1.4411 2.1487 1.5314 0.4636 0.4926 1.0691 1.1046 0.4615 0.8854 0.9787 1.1669 1.0790
3-beta-D-Galactosyl-sn-glycerol 0.8205 1.0562 1.0846 0.9298 0.8796 0.8149 0.9631 0.9337 0.9048 0.8507 0.9206 0.8946 0.7501 0.8895 0.8988 1.1665 1.0896 1.0705 1.1228 1.1518 0.9511 1.2599 1.1086 1.0326 1.2860 0.2563 1.1737 1.0144 1.0664 1.2257 1.4381 0.9946
3-Butylidene-7-hydroxyphthalide 0.7762 1.0148 1.0490 0.9487 1.1223 1.0047 0.7390 0.8664 1.0913 0.9508 0.9879 1.0457 0.8184 0.9711 1.1264 1.2242 0.9127 1.1198 0.9286 0.9805 1.2399 1.0072 1.0650 1.1155 0.8114 0.8330 0.8894 1.1927 1.0628 1.0105 1.0560 1.0382
3-Deoxy-D-manno-octulosonate 8-phosphate 0.4215 0.4183 0.3932 0.4389 0.4307 0.4060 0.3843 0.4067 0.3879 0.3135 0.4012 0.3232 0.3896 0.4506 0.4046 0.4297 1.1846 1.5485 1.4449 1.9072 1.3981 1.2891 1.6174 1.7248 1.4581 1.4919 1.6857 1.8052 1.3776 1.8719 1.7212 2.0738
3-Methyl-2-oxobutanoic acid 0.6078 0.7437 0.8082 0.6854 0.6589 0.6044 0.6777 0.6794 0.6216 0.6421 0.7029 0.6350 0.6839 0.8071 0.6860 0.8257 1.2270 1.2727 1.7012 1.2228 1.4762 1.2249 1.4367 1.1300 1.5395 1.0994 1.4420 1.0716 1.0518 1.2349 1.3940 1.4056
3-Methyleneoxindole 0.8624 0.8638 0.9945 1.0200 0.8854 0.9289 1.0814 1.1840 0.8644 0.7897 0.8494 0.8626 0.9152 0.8933 0.8219 0.8844 1.0631 1.1248 1.0527 1.1491 1.2251 1.2019 1.0926 1.0339 1.3817 1.0024 0.9674 1.0041 0.8829 0.9537 1.0842 1.0790
4-Amino-5-hydroxymethyl-2-methylpyrimidine 0.9968 1.0808 1.0892 1.4377 0.6949 1.0404 0.8824 1.0777 0.9274 0.9374 1.0235 0.9511 1.0925 0.3533 1.1049 1.1415 1.1401 1.0362 0.7657 0.9542 1.1465 1.0707 1.2414 1.0503 0.7537 0.9171 0.9167 1.0875 0.9188 1.0725 0.8085 1.2887
4-Aminobutanal 1.0444 1.2670 1.5553 1.2063 1.1700 1.1908 1.2103 1.3737 1.1031 1.2671 0.9852 1.2286 1.6681 1.2904 1.2889 1.4169 0.8689 0.7388 0.7596 0.7319 0.6663 0.6785 0.6593 0.7164 0.9288 0.7796 0.6928 0.5851 0.7630 0.6821 0.7592 0.7234
4-Aminobutanoate 0.9012 1.2064 0.9624 0.9609 0.8976 0.8957 0.9128 0.8879 0.9612 1.2263 0.8438 0.9614 0.9404 1.0464 1.1221 1.1468 1.1904 1.0116 1.3291 0.9122 1.0827 0.9867 1.0896 0.8446 0.8728 0.8252 0.8813 0.9536 0.8790 1.3405 0.9852 0.9422
4-Heptyloxyphenol 0.8971 0.4447 1.1149 1.3703 0.8979 1.3803 0.7470 0.8814 0.8220 0.9374 1.2675 1.2017 0.7971 0.5728 0.6929 0.9495 1.3171 0.9070 1.3371 0.4745 1.1189 0.6262 1.1887 0.8959 0.6852 1.9074 1.0128 1.6436 0.8872 0.8215 1.0449 1.1576
4-Hydroxy-4-methylglutamate 1.0224 0.8404 0.7787 0.5249 0.7327 0.7896 0.9698 1.0450 0.7716 0.7611 0.7242 0.7548 0.8891 0.8928 0.7676 1.0009 1.1007 1.2382 1.6814 1.0755 1.1096 1.1631 1.0800 0.9595 1.9331 0.9051 0.9212 0.9069 1.0952 1.0410 1.4068 1.1169
4-Oxocyclohexanecarboxylate 0.8910 1.1633 0.9823 0.9290 0.9109 1.1389 1.0850 0.9781 1.0081 1.0223 0.9277 1.0607 0.9692 0.7894 1.0237 0.8691 0.9892 1.2331 1.0725 1.0943 0.9634 1.1002 0.9710 1.0356 0.9086 0.8836 0.8510 1.0248 0.9705 1.2060 0.9832 0.9643
5,3^,4^-Trihydroxy-3-methoxy-6,7-methylenedioxyflavone 4^-glucuronide 1.1653 1.2163 1.1686 1.0168 1.1046 0.9530 1.5029 1.1735 1.0925 0.9598 0.8937 1.1500 1.1346 0.9723 1.1441 0.9362 1.0075 0.9870 0.8609 0.9199 0.8174 0.8287 1.0458 0.8471 1.0779 0.7817 0.7129 0.8613 0.9141 0.8998 0.9740 0.8799
5-Acetamidopentanoate 1.0587 0.4532 1.7315 0.5623 0.4915 0.4397 1.2021 1.1134 1.2657 1.1219 0.6064 1.1667 0.8658 0.5378 0.5157 0.5460 1.7903 1.4396 1.6021 1.6594 0.5919 0.6529 0.7214 1.6928 0.6367 0.5707 0.6046 1.2732 1.3244 1.4722 0.6642 1.6253
5-Guanidino-2-oxopentanoate 0.9701 0.7771 0.8744 0.8882 0.7026 0.7041 1.0327 0.9845 0.8488 0.7874 0.9174 0.9309 1.2132 1.1638 0.7529 0.9980 0.9779 0.9213 1.1565 0.8720 0.7753 1.3572 0.9953 1.1523 1.0911 1.3475 0.9615 0.8464 0.9850 1.5548 1.1113 1.3482
5-Hydroxy-L-tryptophan 0.8338 0.8921 0.9140 0.9456 0.7996 0.9838 0.9973 1.1708 0.8791 0.8817 0.9919 0.9953 0.8726 1.0264 1.1545 1.1017 0.8842 1.0648 1.2210 1.0218 0.9654 0.9896 1.1273 1.1328 0.9343 1.0680 1.0207 1.0684 0.7627 1.0884 1.1480 1.0626
5-Nitro-2-(3-phenylpropylamino)benzoic acid 1.0436 1.0556 1.0759 0.8928 1.0293 0.8142 0.7621 0.7718 0.9900 0.7808 0.9898 0.9315 0.8984 0.8421 1.0688 0.9708 1.1124 1.0727 1.1825 0.9434 1.1183 1.0376 1.1159 1.0560 1.2786 1.0991 0.9270 0.9749 0.9448 1.1438 1.1327 0.9428
(+/-)-5-[(tert-Butylamino)-2^-hydroxypropoxy]-1,2,3,4-tetrahydro-1- naphthol 0.9257 0.9766 1.0446 1.0542 1.0061 1.1364 0.9478 0.9165 1.2385 0.8728 0.7915 0.8191 1.0869 1.0414 1.1543 0.9540 0.9183 1.0526 0.9968 0.9614 1.0533 1.0852 0.9141 1.1752 0.9724 0.8825 0.8311 0.8411 1.1398 0.9466 1.1789 1.0842
6,7-Dimethyl-8-(1-D-ribityl)lumazine 0.6226 0.9247 0.8810 0.7469 0.7037 0.9087 1.4454 1.9614 0.6016 0.8309 1.0072 1.0814 0.8193 0.9868 1.1683 1.3098 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
6-Acetyl-D-glucose 1.0420 0.9580 0.8569 0.8923 1.0242 0.9002 0.9072 1.0380 0.9888 0.8045 0.9236 0.8501 1.0051 0.9065 0.7446 0.8891 1.1371 0.9547 0.9512 0.9980 1.3723 1.2517 0.9267 1.1436 1.1764 1.2570 0.9924 0.8857 1.1950 0.9974 0.9233 1.1063
6-Hydroxyl-1,6-dihydropurine ribonucleoside 0.8842 0.7906 0.9259 0.8331 0.8374 0.8291 0.8538 0.9381 0.7946 0.7364 0.7967 0.8589 0.7226 0.8340 0.7059 0.8043 1.0322 1.1071 1.2809 0.9921 0.9607 1.2799 1.1729 1.5092 1.2722 1.2232 1.0934 1.2005 1.2324 1.2443 1.3589 0.8944
6-Imino-5-oxocyclohexa-1,3-dienecarboxylate 0.8352 0.9467 0.8569 1.0179 0.9390 0.6597 0.7819 0.8386 0.8297 0.8106 0.6737 0.5565 1.1335 1.0083 0.8394 0.9148 0.8902 1.4115 1.3294 1.2550 1.1633 0.7884 0.9956 1.0178 1.4428 1.3542 1.2734 0.9899 1.3520 1.2497 0.9297 0.9148
6-methyltetrahydropterin 0.7542 0.7586 0.6128 0.7982 1.0773 0.6146 0.8301 0.7185 0.6902 0.7201 0.7906 1.1213 0.9086 0.8044 0.6902 1.0160 1.2662 1.0751 1.0323 1.4203 0.9740 1.1645 1.2803 1.5147 1.2260 1.1850 0.9791 1.0150 1.6071 1.3136 1.0984 0.9429
6Z,9Z-Eicosadien-11-ol 0.9917 1.4284 1.0762 1.1121 0.8534 0.9350 0.9030 1.2360 1.4274 0.8539 0.9874 0.9735 0.8149 1.1889 0.8403 1.0671 0.9403 0.8720 0.8550 1.0006 0.9337 0.9725 1.1548 0.8809 1.0154 0.8137 1.0560 0.6897 1.0857 1.0157 1.1390 0.8858
6Z-Tetradecene 0.7634 1.2192 0.8641 1.0889 1.1571 1.1665 1.4963 1.3816 1.5261 1.3178 1.4382 0.8884 1.0086 1.2321 1.2227 1.2632 0.7967 0.9514 0.5355 0.4473 0.6125 0.6902 1.2238 1.2005 1.0079 0.5738 0.4107 0.7058 1.1865 0.6761 1.0257 0.9240
9-oxo-11R,15S-dihydroxy-16,16-dimethyl-13E-prostaenoic acid 1.0836 0.8003 1.5626 1.7115 1.0958 0.7492 1.3271 1.1545 1.2950 0.6396 0.8603 1.7152 1.0158 0.9954 1.4985 0.9511 0.6677 0.6881 0.7258 1.7275 1.1060 0.7555 0.9414 0.9655 0.6837 0.6627 1.1789 1.1236 1.0785 0.7656 0.8316 1.1063
Adenine 1.1539 0.9431 1.2781 1.0310 0.8753 0.7855 1.0887 0.7449 1.0985 0.8510 0.9587 0.8594 1.1606 0.8984 1.0841 0.8830 1.1558 1.0701 0.9418 0.8756 0.8681 1.0157 0.8650 1.0444 1.5910 0.9203 0.9195 0.8513 1.0716 1.0485 0.8399 1.2270
Adenosine 0.5604 0.5650 0.6583 0.7855 0.6231 0.5415 0.6802 0.8199 0.6725 0.4606 0.6551 0.7002 0.6934 0.5441 1.0171 0.7052 1.3167 1.1010 1.4623 1.4982 1.3301 1.3178 1.3116 1.4018 1.6262 1.0462 1.3152 1.1723 1.2009 1.4955 1.4197 1.3022
Ala-Ala-Ala-Ser 0.8620 0.9772 0.9017 0.8602 0.7756 0.9171 0.8230 0.8952 0.8242 0.7406 0.8459 0.9011 0.8758 0.9260 0.8202 0.8362 1.0385 1.1267 1.1941 1.1969 1.0038 1.2046 1.2470 1.1227 1.3246 1.0812 1.1434 1.0866 1.0121 1.0451 1.2143 1.1764
Ala-Ala-Gln-Ser 0.9957 0.9843 1.0681 0.9652 0.8676 0.9168 1.0160 1.5560 0.9112 0.6912 0.9208 1.1508 0.8703 0.6102 1.4641 1.0277 1.0482 1.1161 1.0347 0.7031 1.1571 0.7683 0.8191 1.0681 0.7213 1.4730 1.3651 0.9794 0.8786 0.8939 1.0926 0.8653
Ala-Asp 0.7350 0.7025 0.5797 0.6426 0.7182 0.9466 0.9231 1.1385 0.8059 0.7090 0.6067 0.5778 0.7616 0.7239 0.7178 0.7094 1.7248 1.2718 0.8597 1.1499 1.3977 1.4086 1.1258 1.4143 1.8468 1.1040 1.2526 1.2235 1.2414 0.8889 1.2778 0.8141
Ala-Asp-Cys-Ser 1.1783 1.4953 1.6358 1.4720 1.2845 1.1570 1.2472 1.4326 1.1055 1.3062 1.4446 1.6140 1.1701 1.4082 1.3250 1.4937 0.4190 0.5160 0.6241 0.8222 0.4277 0.5631 0.6197 0.8779 0.6003 0.5908 0.8152 1.0244 0.3904 0.4708 0.6294 0.8389
Ala-Asp-Ser 1.2629 1.1003 1.0673 1.1197 0.9691 1.0796 1.2002 1.1401 1.2316 1.1361 1.1821 1.1932 1.0351 1.3276 1.1898 1.1205 0.6039 0.8321 0.9235 0.9188 0.6836 0.7266 0.8469 1.0283 0.7798 0.9143 0.9344 0.9715 0.6965 0.8271 0.8418 1.1158
Ala-Glu-Glu-His 1.3760 NA NA NA 1.2231 1.4937 1.7743 1.6313 1.2996 0.2630 0.1725 0.1964 1.7741 0.7041 0.2894 0.3022 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Ala-His 0.8684 1.0248 0.9509 0.9616 0.9113 0.9151 1.0842 0.9931 1.0338 0.9266 0.9686 0.9099 0.9776 0.9438 0.7362 0.9771 1.1259 0.9063 0.9666 1.2107 1.0717 1.0218 1.0374 1.0789 0.9841 1.0293 0.8451 1.0367 1.1741 1.0653 1.3492 0.9137
Ala-Leu-Asn-Ser 0.9936 1.0364 1.0128 0.9680 1.0126 0.9721 0.9428 1.0699 0.9283 1.0254 1.0276 1.0245 0.9935 1.0428 1.0719 1.0204 0.9629 0.9866 1.0235 0.9287 1.0066 0.9659 1.0408 0.9805 1.0280 0.9351 0.9198 0.9692 0.9618 1.0513 1.0647 1.0322
Ala-Leu-Gln-Ser 1.0188 1.0803 0.9837 0.9993 1.0003 0.9477 1.0231 1.0824 0.9935 1.0262 1.0310 0.9832 1.0163 1.0028 1.0113 1.0113 0.9507 1.0306 0.9882 0.9664 1.0374 0.9563 1.0051 0.9250 1.0203 0.9667 0.9542 0.9487 0.9520 1.0363 1.0313 1.0198
Ala-Leu-Trp-Ser 0.9473 NA NA NA 0.8817 0.9564 0.9241 1.4387 1.2377 NA NA NA 1.1101 0.8724 0.3026 0.3373 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Ala-Lys-Ala-Arg 0.7616 0.9640 1.4069 0.8056 0.9300 0.4728 0.8207 0.8577 1.0497 0.8267 1.0476 1.0500 1.0054 1.0023 1.1068 0.9297 1.0890 1.0677 1.4148 0.8182 1.1086 0.8933 1.2022 1.1345 0.9425 1.3692 0.6872 1.1236 0.7861 1.0268 0.9570 1.3419
Ala-Lys-Asp-Gly 0.9738 1.0230 1.0027 0.9972 1.0238 0.9276 0.9891 1.0825 0.9720 0.9782 0.9977 1.0180 0.9649 1.0465 1.0186 1.0042 0.9617 1.0398 1.0131 1.0236 1.0870 0.9669 1.0789 0.9521 1.0124 0.9685 0.9623 0.9289 0.9447 1.0133 1.0437 0.9833
Ala-Lys-Asp-Pro 0.8336 NA NA NA 0.8361 1.2352 1.3183 2.0227 0.8682 0.7090 0.6572 0.5587 0.9774 0.5381 0.7707 0.4156 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Ala-Lys-Lys-Asp 0.8048 NA NA NA 0.8558 1.0026 1.7966 1.9582 0.9955 0.5010 0.4231 0.4604 1.0070 0.6269 0.4954 0.4825 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Ala-Phe-Arg-His 0.7918 0.8779 0.7431 0.7684 0.8316 1.0335 1.1924 2.1709 0.8447 0.8703 1.1743 0.8202 0.7153 1.0669 1.0500 1.0488 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Ala-Pro 2.8927 0.1121 0.0967 0.0716 2.4626 3.3311 4.0906 6.3559 3.1505 0.7565 0.8184 0.7089 2.4031 1.2840 1.0769 0.9876 0.0781 0.0796 0.0893 0.0810 0.0803 0.0825 0.0847 0.0992 0.0840 0.0784 0.0947 0.0891 0.1030 0.1009 0.0756 0.1003
Ammodendrine 1.0073 0.9649 1.0357 0.9026 1.0140 1.1558 0.9139 1.0847 1.0608 1.0528 1.0458 0.9094 0.9831 1.0263 0.9486 1.1827 0.9142 1.0407 0.9370 1.0246 1.1483 0.9855 1.0660 0.9652 0.7437 0.9397 0.9187 1.0082 0.8289 1.1044 1.0861 1.0005
Antheridiogen-An 0.4085 0.3839 0.5635 0.9631 0.9684 0.5486 0.4963 0.4774 0.5095 0.5367 0.5519 0.3953 0.5657 0.8378 0.4742 0.6510 1.4938 1.1389 1.2821 1.4126 0.8693 1.0585 0.8237 1.0624 2.7989 1.0415 1.7522 1.1100 1.0312 1.1009 1.0115 1.0250
Apigenin 7-(6^^-malonylglucoside) 0.2332 0.8095 1.6979 2.9345 0.1770 0.4496 0.4322 0.3889 0.2159 0.6300 1.2857 2.2909 0.1947 0.8044 1.1121 2.0822 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Arg-Asp-Asp-Gly 0.7652 0.8346 0.7825 0.6957 0.7094 0.6796 0.7283 0.7695 0.7956 0.7119 0.7922 0.7981 0.7365 0.8267 0.7652 0.7715 1.0902 1.1099 1.3622 1.2695 1.2096 1.4001 1.1765 1.3685 1.4400 1.3090 1.1436 1.2350 1.1194 1.2362 1.2329 1.1350
Arg-Glu-Ile-Val 0.8288 1.0452 1.0384 1.1386 0.7965 0.9444 0.7263 1.1544 1.1927 1.0992 0.8349 1.2421 0.8659 1.0946 1.2630 0.8361 1.0616 1.0205 1.3837 0.9226 0.9355 0.7302 1.1520 1.0490 0.9674 0.7952 0.7737 0.8729 0.7239 1.1482 1.1129 1.2494
Arg-Lys-Val-Ser 0.9693 0.9316 1.7812 1.0543 0.9320 1.2939 1.0014 0.9814 0.9290 0.6668 0.7691 1.3144 1.0707 0.9968 0.9262 0.9267 0.9377 0.7551 1.0139 1.0688 0.7287 0.7398 1.0764 0.9605 0.8012 1.4798 0.7479 0.9090 0.7589 1.2352 1.4598 0.7823
Asn-Asp 1.3362 0.9028 0.9635 0.8888 1.1522 1.5024 1.5253 1.5652 1.2603 0.9318 1.0072 0.9375 1.0797 1.1227 1.0337 0.9922 0.7172 0.8810 0.8389 0.8202 0.8288 0.8295 0.8090 0.9080 1.0118 0.8258 0.8183 0.8633 0.8925 0.9068 0.8805 0.9670
Asn-Glu-Glu-Ser 1.8908 0.7244 0.8040 1.2304 0.3595 0.6361 0.6307 0.7330 1.2054 0.6706 1.3143 1.4650 0.7418 0.9334 0.8292 0.6278 1.9440 0.5832 NA 0.3950 0.7983 1.0287 0.4589 0.7355 2.2898 NA NA 1.0901 0.4342 0.3718 1.2336 0.7609
Asn-Gly-Tyr-Tyr 1.0932 1.0683 0.9783 0.9046 0.9642 1.1183 0.9439 0.8327 1.0309 1.3309 1.0414 0.9108 0.9772 1.0595 1.0759 1.0864 0.9066 1.0999 0.8060 0.9160 0.9626 1.0003 1.0539 1.0644 0.8673 0.9429 1.1184 0.8027 0.8633 1.2328 1.0505 0.8959
Asn-Leu-Gly-Ser 1.1215 0.8037 1.3888 0.8904 0.8569 0.5529 1.0348 0.6868 1.0195 0.9799 0.7312 1.1905 0.8336 0.9716 1.1596 0.7208 1.0389 1.4988 1.1216 0.8723 1.0683 0.7653 0.4825 1.4025 0.6709 1.3820 1.0131 1.0497 1.0079 1.0982 1.6357 0.9499
Asn-Leu-Pro-Pro 1.0421 NA NA NA 0.9314 1.2419 1.5988 2.5768 1.0715 0.1559 0.2971 0.2190 0.9136 0.3731 0.3388 0.2469 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Asn-Lys-Gly-Pro 1.7358 0.4087 0.3255 0.2971 1.8659 2.0985 2.3410 3.1935 2.0008 1.2188 0.7151 0.4779 1.9849 1.7600 1.1482 0.7020 0.4173 0.2936 0.2513 0.3873 0.3457 0.4133 0.3300 0.3315 0.2441 0.4464 0.4424 0.3626 0.2452 0.3212 0.3111 0.5192
Asn-Pro 0.8111 1.0009 1.0626 0.8839 0.8397 0.7682 0.9025 0.9505 0.8474 0.7772 0.8988 0.8586 0.8830 0.7502 0.8462 0.9373 1.1254 1.1408 1.2824 1.1032 1.0862 1.0883 1.0374 1.0237 1.2260 1.0648 1.0596 1.1020 0.9754 1.0784 1.5379 1.0501
Asn-Thr-Asn-Asn 0.7661 0.8440 0.7876 0.7667 0.6836 0.7715 0.6992 0.7242 0.7202 0.7773 0.7400 0.7821 0.8539 0.8207 0.7585 0.7834 1.0558 1.2086 1.5469 1.3543 1.0461 1.3181 1.1651 1.4625 1.4535 1.0690 1.1505 1.1663 1.0502 1.0525 1.2698 1.3517
Asn-Val-Gly-Ser 0.9847 1.0442 1.0954 1.0820 1.1260 0.9474 1.0151 1.0883 0.9217 0.9221 1.0189 1.0088 0.9856 1.0669 1.0362 1.0552 0.9765 0.9382 0.9649 0.9228 1.0469 0.9428 1.0497 0.9954 0.9795 0.9904 0.9349 0.9277 0.8883 0.9762 1.0278 1.0393
Asp-Arg 0.9190 0.8531 0.9223 0.8675 0.8793 0.9139 0.7369 0.8478 0.9454 0.9294 0.8886 0.9436 0.9247 0.7681 0.8567 0.8722 1.0409 1.1782 1.0488 1.1312 1.1060 1.2221 1.1359 1.1440 1.3001 1.0303 0.9845 0.9916 1.1342 1.1030 1.1766 1.2041
Aspartyl-L-proline 2.1959 0.0679 0.0556 0.0516 1.7726 2.4487 3.5372 3.9253 2.3875 0.4066 0.8065 0.7353 2.4402 0.9618 0.7769 1.1386 1.0557 0.9978 0.0518 0.0574 1.4420 1.0638 0.4698 0.6366 0.0543 0.0582 0.7328 0.5227 0.0444 0.0591 0.9783 0.0671
Asp-Gly-Arg 0.7386 0.8728 0.8241 0.8631 0.7336 0.7621 0.9517 0.8330 0.7058 0.8492 0.8602 0.8809 0.8505 0.8709 0.7767 0.7986 1.0638 1.1241 1.1344 1.2363 1.1253 1.2933 1.1971 1.2887 1.2168 1.0501 1.1424 1.1077 1.1440 1.2237 1.2733 1.2075
Asp-Leu-Lys-Asp 0.7269 0.9082 0.7179 0.7236 0.9220 1.0571 1.7799 1.9956 0.9343 0.6294 1.0647 1.1685 1.0089 1.1169 1.3114 1.0612 1.0074 0.9880 0.7925 1.0342 0.8621 0.9216 0.8949 0.9569 0.9583 0.8886 0.7962 0.8322 0.9930 0.9691 1.0115 0.9670
Asp-Met-Gln-Gln 0.7747 0.6946 0.8170 0.7269 0.7976 0.8116 0.7703 0.9881 0.8169 0.6639 0.7148 0.8459 0.7511 0.7966 0.6682 0.8866 1.2102 1.2035 1.1417 1.2081 1.1822 1.3443 1.0968 1.5463 1.3297 1.1042 1.2347 1.1706 1.2396 1.0694 1.2150 1.1793
Asp-Val-Pro-Ser 0.9064 0.8595 0.5376 0.4319 0.7624 1.1058 1.9612 2.1332 0.8308 0.7872 0.9159 0.8465 0.8876 0.9632 1.0952 0.9756 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Benzene-1,2,4-triol 0.8475 0.7695 0.6881 0.6420 0.6145 0.6850 0.7002 0.9624 0.7813 0.6964 0.7503 0.6264 0.6926 0.7438 0.6832 0.7705 1.0000 1.2108 1.2294 0.9787 1.3401 1.5571 1.4931 1.4601 1.3263 1.2526 0.9967 1.0532 1.8764 1.2208 1.1896 1.1613
Betaine aldehyde 1.0371 1.0139 1.0141 1.0109 1.0001 0.9476 0.9078 0.9978 0.8426 1.0386 1.0189 1.0197 1.0957 1.0193 1.0043 1.0037 0.9081 1.0137 1.0340 0.9889 0.9999 0.9923 1.1133 0.9530 1.0304 1.0195 1.0676 0.9155 0.9749 1.0083 1.0503 0.9582
Biotin amide 0.8181 1.0289 0.9901 0.9310 0.6890 0.9665 0.8431 1.0115 0.9003 0.8102 0.7449 0.9250 0.7854 0.8016 0.9551 1.0583 1.0148 1.3770 0.9401 1.0560 1.1124 1.2857 1.1106 1.1866 1.2221 0.9456 0.9146 0.9960 1.0229 1.1299 1.0760 1.3510
CAPS 0.9190 0.9652 0.9198 1.1695 0.8939 0.9110 0.8862 1.0120 0.9018 0.9054 1.0172 1.0314 0.9453 0.9352 1.1790 0.9615 0.9982 1.0041 0.9738 1.0035 1.1620 1.0643 1.0328 0.9969 1.1988 0.9023 0.9867 0.8786 1.0463 1.1621 1.0299 1.0066
Cathasterone 1.0160 1.0807 1.0102 1.0193 1.0010 0.8950 1.0289 1.0912 1.0786 0.9079 0.9564 0.8996 0.9504 1.0935 0.9329 1.0336 1.0291 1.1166 1.1237 1.0336 0.9611 0.9321 1.1385 0.9830 0.9761 0.8954 0.8452 0.9448 0.9476 1.0436 1.1184 0.9160
Cer(d40:1) 1.2180 1.3593 1.0062 1.1883 1.1701 1.0355 0.8085 1.0885 1.4086 1.4207 1.0690 0.8485 0.9921 1.3115 0.9983 1.0393 0.6509 0.7841 0.4560 0.8175 1.3325 1.0136 0.9695 0.6031 0.2522 0.8264 0.4989 0.7803 2.0059 1.1125 0.7644 0.9886
Cerulenin 1.0526 0.9861 0.9567 0.9963 0.9135 0.8330 0.9286 0.9878 0.9587 0.9336 1.0524 0.8913 0.9508 0.8631 1.0838 0.9881 1.1300 1.0294 1.0249 1.1489 0.9970 1.0066 1.0837 1.0704 0.9225 1.0100 1.0095 0.9403 1.0230 1.0702 1.0973 1.0601
CHAPS 1.0250 1.1021 0.9454 1.0821 0.9490 0.9145 0.9494 1.0157 0.9388 0.8794 1.0609 1.0977 1.0253 0.9820 1.1291 1.0011 0.9762 1.0208 0.9518 0.9548 1.0859 1.0270 1.0227 0.9608 1.1556 0.8904 0.9339 0.8800 0.9828 1.0962 1.0110 0.9525
Cholesta-5,7-dien-3beta-ol 1.1212 1.3686 1.2677 0.9480 1.1045 1.1641 1.0144 1.2706 1.3593 1.0297 1.6089 1.1936 1.3310 1.2845 1.1190 1.4703 0.6672 0.9022 0.7877 0.7288 0.7853 0.9432 0.8744 0.7871 0.7485 0.7613 0.8047 0.8258 0.6465 0.6915 0.7153 0.6749
Chrysoidine free base 0.9858 1.0506 0.9644 0.9319 0.9214 0.8462 0.9547 0.8627 1.0335 0.9045 1.2082 1.3076 1.0306 0.9869 1.0501 1.2330 0.9501 0.9618 1.0693 0.7464 1.0453 1.1299 1.1003 1.0554 0.8335 0.9480 1.1699 0.8399 0.9641 1.0363 0.9235 0.9543
Cinchonain 1a 0.6095 0.6079 0.5358 0.5900 0.6609 0.6731 0.6062 0.7770 0.6003 0.5466 0.6212 0.7497 0.6720 0.6049 0.5653 0.7409 0.9758 1.3394 1.3380 1.4843 1.4172 1.2507 1.4426 1.6727 1.3130 1.1983 1.4731 1.3357 1.4487 1.3292 1.3691 1.4511
cis-1,2-Dihydronaphthalene-1,2-diol 1.2031 1.0833 0.9303 1.0007 0.9793 0.8880 0.8816 1.0428 1.0284 0.8889 0.9028 0.9870 1.0036 0.8851 0.9513 0.9779 0.9180 0.9365 0.9720 0.8580 1.3538 1.0307 1.0976 1.1452 1.0931 0.8557 0.9453 0.8601 0.9853 1.0854 1.1833 1.0463
Citrate 0.3320 0.2650 0.2270 0.1915 0.3565 0.2799 0.2276 0.2194 0.3597 0.2393 0.2122 0.2025 0.4159 0.2522 0.1869 0.1808 1.5189 1.4621 2.5586 1.5402 2.3279 2.7261 1.3944 1.7011 2.3735 1.6957 1.2096 1.2480 2.0714 1.4667 1.3018 1.2556
CMP 0.7862 1.9432 2.5571 2.4956 0.7607 1.1055 1.2295 1.3863 0.8706 1.3320 2.2272 2.4715 0.8032 1.3571 2.0451 2.2858 0.3212 0.2894 0.2467 0.3877 0.2473 0.2533 0.3461 0.2721 0.2349 0.2272 0.3621 0.3909 0.3893 0.4096 0.2501 0.2510
Convicine 0.6143 0.6643 0.7485 0.6497 0.6132 0.6528 0.7930 0.5989 0.6286 0.6901 0.7766 0.6367 0.7726 0.6862 0.7595 0.7422 1.0514 1.4232 1.6323 1.2090 1.1102 1.4888 1.2123 1.5926 1.3870 1.3659 1.3010 1.1193 1.0367 1.2244 1.3473 1.4710
Creatinine 1.1963 0.6977 0.7352 0.4928 1.1079 0.5675 0.5066 0.9240 1.9164 0.5572 0.5541 0.5407 1.4265 0.6724 0.5102 0.8953 1.5199 1.1463 0.9223 0.8908 1.7859 0.7787 1.0809 1.0953 2.4729 0.8056 1.0454 0.7337 1.5475 0.9861 0.9194 0.9686
Cumene 0.9085 1.0934 0.7212 0.6952 1.4446 0.9528 1.1311 0.7284 1.0690 0.6286 0.7191 0.5947 1.0966 1.0022 0.4606 0.6930 0.7940 1.1729 1.4478 1.4324 1.2059 1.3905 0.8998 1.0255 1.3835 1.8126 1.0070 1.3229 0.5411 0.9587 1.0816 0.9093
Cyclic ADP-ribose 1.3654 1.3495 1.3878 1.4423 1.2265 1.3590 1.5026 1.5920 1.3539 1.1783 1.1967 1.3999 1.0357 1.5851 1.2611 1.8449 0.6354 0.5886 0.5293 0.6521 0.6380 0.5535 0.6199 0.7020 0.6648 0.8842 0.4893 0.4570 0.6351 0.6123 0.5832 0.6746
Cys-Met-Cys-Tyr 1.2093 0.5898 0.8060 1.3753 0.5586 0.4762 0.5521 0.8855 0.9599 0.6411 1.2439 1.9087 0.8300 0.9472 0.3760 0.4718 1.2603 1.1945 0.5491 0.4480 0.5175 0.8426 0.9541 1.1014 6.8985 0.4239 0.4580 0.5033 0.7039 0.6596 0.9842 0.6695
Cytidine 0.7787 0.9451 0.9790 0.8172 0.7804 0.8370 0.9442 0.9584 0.8301 0.7818 0.8665 0.8251 0.7707 0.8273 0.9088 0.9306 0.7933 1.0754 1.3810 1.4186 0.7986 1.1405 1.1389 1.3757 1.0529 0.9725 1.1133 1.4545 0.8293 1.0418 1.3462 1.2868
D-4^-Phosphopantothenate 0.4674 0.6414 NA NA 0.6809 1.0442 1.5511 1.9984 0.7015 0.4668 NA NA 0.4923 0.6356 0.6736 0.6507 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
dCMP 0.8372 1.1200 0.7862 0.8748 0.7586 0.9117 0.9560 0.9263 0.9419 0.8316 0.8188 0.9261 0.8467 0.8954 0.8607 0.8282 1.0231 1.1417 1.1523 1.1103 1.0732 1.1081 1.2307 1.1416 1.2003 1.1466 1.0827 1.0381 1.1800 1.1024 1.0760 1.0729
decanamide 1.0505 1.0551 1.0113 1.1422 0.8974 0.8288 0.8704 1.3090 1.1990 0.9720 0.9942 0.9077 1.1750 1.0026 1.0613 1.1607 0.8382 0.8819 1.0055 0.8529 1.0798 1.0158 0.9117 0.8820 1.0002 0.8539 0.5549 0.9986 0.9446 1.2260 1.2337 1.0828
Decanoyl-CoA 0.5084 0.3754 0.4364 0.4321 0.6274 0.5396 0.5611 0.7290 0.5092 0.3645 0.4116 0.4908 0.5719 0.6324 0.4613 0.5435 1.1794 1.2021 1.5175 1.5152 1.6560 1.8460 1.3706 1.7218 1.4619 1.2867 1.5966 1.6515 1.4707 1.1936 1.4682 1.6675
Dehydrophytosphingosine 1.0112 0.9236 1.2718 0.9833 1.1509 0.9341 0.7525 1.1481 0.7808 1.0879 1.3272 1.0543 1.0998 0.7066 1.0577 1.0186 0.8517 1.2154 0.8439 1.0363 0.8714 0.9385 1.1523 1.1443 0.8682 0.9555 0.9132 0.7872 0.8672 0.8194 1.2860 1.1413
Deoxycytosine 0.9039 1.0174 0.9810 0.3259 0.9508 0.9775 1.1789 0.9805 0.7751 0.9294 1.0734 1.0356 1.0791 0.9807 1.1236 1.4079 1.1663 1.0386 0.6273 1.1558 1.0987 1.0836 1.4113 1.1282 0.8302 1.0730 0.8143 1.2649 0.8304 0.7955 0.8095 1.1519
D-Fructose 1,6-bisphosphate 0.3107 0.2948 0.2770 0.2362 0.2272 0.3342 0.3047 0.2734 0.2563 0.2306 0.2777 0.2413 0.3355 0.2771 0.3295 0.2498 1.5723 1.0315 1.9961 1.4764 1.3767 2.0671 1.0795 2.7015 1.6314 1.6994 1.8988 1.9536 1.0564 1.6629 2.0242 2.3165
DG(34:1) 0.6651 0.6771 0.5835 0.7549 0.9204 0.8963 1.7151 3.2507 0.7341 0.6020 0.9646 0.6658 0.8582 0.9730 0.8834 0.8556 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
DG(36:1) 0.8696 0.8671 0.9696 0.8610 0.7845 1.1084 1.4359 1.8945 0.9797 0.7487 0.8495 0.6040 0.9891 0.8288 0.8865 1.0565 1.0317 0.9399 1.8486 0.8945 0.9418 1.0645 0.9764 1.0485 1.2546 0.5123 0.7798 1.2103 1.0935 0.5398 0.9676 0.9742
DG(36:2) 0.7166 0.8441 0.7527 0.6153 0.6354 1.0191 1.4078 2.6488 0.8800 0.7510 0.9157 0.9639 0.7947 0.8900 0.9648 1.2001 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
D-Glucono-1,5-lactone 0.9410 0.7761 1.0336 0.6753 0.6834 0.6686 0.3745 0.8534 0.9804 0.7177 0.7211 0.9330 0.7100 0.7163 0.7237 0.8631 1.1794 1.1209 1.3366 1.1077 0.8987 1.4505 1.3300 1.1321 1.0212 1.3571 1.3548 1.5050 0.9534 1.2745 1.3557 1.2511
D-Glucosamine 0.7803 0.8456 0.8509 0.8948 0.6976 0.7659 0.9201 0.9435 0.8122 0.9981 0.9390 0.8648 0.8094 0.7711 0.8326 0.8533 1.0305 1.0810 1.2179 1.1597 1.1011 1.2659 1.2297 1.1020 1.6184 1.1380 1.0627 1.0403 1.0134 1.0463 1.1552 1.1586
D-Glucosamine 6-phosphate 0.4308 0.4250 0.4490 0.4232 0.4434 0.4197 0.4414 0.4389 0.4023 0.4622 0.4313 0.4351 0.4238 0.4446 0.4534 0.4534 0.9837 1.4673 1.9036 1.8913 1.0701 1.5231 1.7820 2.1785 1.1232 1.3154 1.7152 2.0459 0.9677 1.3835 1.7198 1.9523
D-Glucose 6-phosphate 0.9704 1.0530 1.2220 1.1199 1.1086 1.0194 0.9649 1.3444 1.1997 0.9241 1.1983 1.0811 1.0102 1.0847 1.1215 1.2675 0.4238 0.7969 1.7490 0.4452 1.3182 0.4330 2.1019 2.2531 1.0631 0.3569 0.3717 0.3965 1.3256 0.3514 0.4701 0.4539
Dibenzo[1,4]dioxin-2,3-dione 1.6177 1.4135 1.7530 1.3877 1.3994 1.5792 1.8171 2.6062 1.3636 1.1653 1.6421 1.5775 1.5611 1.2439 1.8612 2.2050 0.6672 0.2621 0.3143 0.3139 0.4794 0.2333 0.3233 0.3015 0.6327 0.2747 0.3002 0.3113 0.5334 0.2483 0.2943 0.3167
dibenzothiophene-5-oxide 0.6818 0.8883 0.4938 0.7647 0.8457 0.7472 0.7785 0.8098 0.7861 0.9991 0.8461 0.8567 0.7269 0.9010 0.7788 0.9820 1.0461 1.4632 1.3271 1.1458 1.1847 1.2518 1.4667 1.0496 1.4187 1.3110 1.0553 1.0033 1.2552 1.1064 1.1013 0.9273
Dihydrochelirubine 0.3384 0.3240 0.3335 0.3304 0.2515 0.3134 0.3493 0.3606 0.3063 0.2899 0.2746 0.3388 0.3193 0.3320 0.3242 0.3563 1.0187 1.4961 2.0198 2.1898 0.9257 1.5055 1.9163 2.3875 1.2527 1.4156 1.7387 2.4101 0.9502 1.4098 1.8177 2.4031
Docosa-4-7-10-13-16-pentaenoylcarnitine 0.9535 0.7399 0.9378 1.1021 0.4081 0.6090 0.5751 0.3707 0.3901 0.4546 0.5830 0.6624 0.7576 1.2179 0.7711 0.8073 1.2929 1.0518 1.0433 0.8908 1.4002 0.9947 1.2951 1.0008 1.4085 0.8373 1.1169 0.9978 1.3651 1.0906 1.1829 0.9851
Dodecanamide 0.9707 0.9350 0.9797 0.8314 1.0708 0.8437 1.1603 1.2176 1.1803 0.8316 1.2144 0.9043 0.9884 0.9588 1.1716 1.0642 1.1775 0.9545 0.8602 0.7823 1.0592 0.9987 0.8840 0.9711 0.8551 0.8390 1.0733 0.7637 1.1033 1.0811 1.3000 0.9742
D-Sedoheptulose 7-phosphate 0.4776 0.4273 0.4474 0.3996 0.4236 0.4694 0.4808 0.6143 0.4609 0.3743 0.4600 0.4805 0.4671 0.4072 0.4688 0.5423 0.8127 1.2089 1.8485 2.1723 0.7724 1.2384 1.5175 2.6619 1.0583 1.3617 1.7990 2.1419 0.7135 1.1529 1.8503 2.2886
Ectoine 1.1885 0.8888 0.9257 0.8327 0.7059 0.8864 0.9791 0.8694 0.9259 0.6569 0.7158 0.8285 0.9234 0.9671 0.8453 0.7360 1.1562 1.0756 1.1390 0.8424 0.9469 1.1393 1.6009 1.0066 1.7277 0.8616 0.9979 0.9314 1.0138 1.2982 1.2693 1.1179
Elaeokanine C 0.5311 1.2272 0.6851 1.1184 0.6622 0.9833 1.0876 1.0511 0.5015 1.0137 1.2289 1.2731 0.5089 1.2868 1.0140 1.0505 0.7592 0.7633 1.1225 1.5789 0.9964 0.7373 1.3761 1.5642 1.0255 0.8379 0.9826 1.4156 0.7331 0.7892 1.1550 0.9399
Epigallocatechin 3,5,-di-O-gallate 0.9735 1.9643 2.7466 2.1999 0.8089 1.0285 1.0713 0.8392 0.8309 1.5884 2.0752 2.4147 1.1349 1.4048 2.2307 2.2549 0.2689 0.3831 0.4052 0.4443 0.4398 0.4424 0.3498 0.4646 0.3637 0.3178 0.3511 0.4104 0.3512 0.5041 0.3342 0.4160
epsilon-Caprolactam 1.1743 1.0214 0.9881 0.9443 0.6056 0.9214 0.8885 1.2027 0.9326 1.1373 0.8642 0.8475 0.9218 0.9688 1.3404 1.0499 1.2144 0.9659 1.0005 1.1986 1.1393 1.2034 0.9465 1.1065 1.1421 0.7076 0.7900 0.7553 0.8433 1.1072 0.9919 1.0788
Epsilon-(gamma-Glutamyl)-lysine 0.9332 0.7334 0.5002 0.6150 0.6435 1.2028 1.7668 2.2662 0.8786 0.7623 0.7535 0.7770 0.8387 1.1099 0.9752 0.9871 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Ethanolamine phosphate 1.2213 1.5445 2.2850 2.4048 1.1041 1.1487 1.5545 2.2136 1.0258 1.3407 2.7217 3.3197 1.1145 1.4412 2.6430 3.5422 0.0873 0.0867 0.0797 0.0831 0.1037 0.0938 0.0733 0.0839 0.1144 0.0868 0.0728 0.0724 0.0912 0.0851 0.0810 0.0798
Evoxanthidine 0.6510 0.6616 1.2895 0.7232 0.5558 0.8515 0.6497 0.9208 0.7972 0.8649 1.4064 0.8038 0.7574 0.6356 0.8971 0.8837 1.8081 1.2099 0.7780 0.9451 1.0311 1.4719 1.2260 1.2905 1.3251 1.3407 1.0964 0.9180 1.0821 1.0866 0.8648 1.2937
FA (12:1) dodecenoic acid 1.0951 0.9475 1.2065 0.9226 0.9925 0.9686 0.8932 0.8421 0.9118 0.9889 0.8960 0.8722 1.0042 0.8385 1.0503 1.0532 1.0054 1.0216 1.1033 1.1746 0.9264 1.0815 1.0123 1.0111 0.7799 0.8714 1.0384 0.9779 0.9640 1.1167 1.3619 1.0703
FA (12:2) 1.2721 1.1579 0.8817 1.0154 0.8231 0.8452 0.9976 1.1320 1.1092 0.9421 0.8628 1.2776 1.0673 0.9204 1.1372 0.9465 1.0051 0.9704 0.7345 1.0236 1.0363 1.1554 1.0368 1.4508 0.6430 1.0073 0.7857 0.8220 0.8712 0.9760 1.2502 0.8436
FA (13:2) tridecadienoic acid 0.3616 2.2389 0.4829 0.8830 0.3170 0.6229 0.5444 0.5428 1.0499 0.7049 1.1895 0.6586 0.6529 2.0503 1.4700 0.8550 1.4264 0.5429 1.3073 1.2258 0.2517 1.1711 2.0743 0.6102 1.4077 1.0932 0.4872 2.4503 1.1885 0.4710 0.8935 0.7742
FA (14:1)nonanoic acid 0.9265 0.8941 1.1770 0.9347 0.9503 0.8961 1.1280 0.9982 1.0266 1.0412 0.9369 1.0593 1.0838 1.0252 0.9741 1.0127 1.0476 0.9928 0.9438 0.9602 0.8214 1.0510 1.0275 1.0234 1.1106 0.9532 1.0801 0.9429 0.9392 1.0766 0.9364 1.0286
FA (14:2) tetradecadienal 0.8462 0.5976 0.6690 1.4290 1.3375 0.6965 0.5737 0.6774 0.9014 1.2885 1.0340 0.8440 1.5122 0.6466 0.4394 0.6953 1.2346 2.5355 1.3577 0.4505 1.3872 0.9795 0.7125 1.1098 1.8402 0.4940 0.9226 1.4643 0.7614 0.5353 1.1581 0.8684
FA (16:2) 1.0169 1.2412 0.7084 1.1306 1.2509 1.1676 1.1058 1.0266 1.1789 0.7483 0.5116 0.6878 1.0816 0.9914 0.7741 0.9712 0.7212 1.3050 1.0596 0.7266 1.2196 1.0674 1.2225 1.2720 1.3273 0.9632 1.1347 1.1556 0.6469 0.9622 0.8164 0.8069
[FA (5:2)] 2,4-pentadienoic acid 0.1089 0.1096 0.0947 0.1392 0.1211 0.1214 0.1150 0.1399 0.1066 0.1276 0.1049 0.1490 0.1193 0.1555 0.1045 0.1059 1.0817 1.7303 2.2304 2.0911 1.1379 1.6736 2.0829 2.5695 1.2899 1.6793 2.0288 2.3899 1.4443 2.0431 2.2734 2.3307
[FA hydroxy(18:0)] 9,10,12,13-tetrahydroxy-octadecanoic acid 0.8772 0.9089 1.2280 1.0342 0.8684 0.9016 0.9064 0.8374 1.0001 1.0450 0.8438 1.0322 1.1435 1.1947 1.0502 1.0826 0.9759 1.2335 1.0586 0.9829 0.9628 0.8093 1.0592 0.9244 0.7412 0.8833 0.9791 1.0284 0.9539 0.9894 1.2731 1.1909
FA hydroxy(18:1)] 0.6318 1.2765 0.6304 0.7409 1.1833 0.8820 1.2187 1.0326 0.6833 0.7044 0.3060 0.4614 1.1507 1.0295 0.5397 0.9386 0.7869 1.3373 1.4522 1.0682 1.1530 1.3914 1.1808 1.3320 1.5890 1.5510 1.2482 1.3886 0.0851 1.1948 0.9952 0.8364
[FA oxo(5:1/5:0/8:0)] (1S,2S)-3-oxo-2-(2^Z-pentenyl)-cyclopentaneoctanoic acid 0.8532 0.8113 1.0187 1.3439 0.8245 0.8958 0.8417 1.3545 0.9334 0.6751 1.1615 1.6878 1.0971 0.8126 1.5272 1.1824 0.7316 0.8479 0.7149 0.9599 0.9710 0.9726 1.3227 1.3056 0.5627 0.8225 1.2028 1.2945 0.7909 0.5991 1.0854 1.4560
[FA oxo,amino(6:0)] 3-oxo-5S-amino-hexanoic acid 0.5692 0.6012 0.5834 0.5263 0.4883 0.4996 0.5805 0.4918 0.4685 0.6284 0.5338 0.6589 0.4996 0.5855 0.4486 0.4977 1.6868 1.6006 1.1803 1.4528 1.6207 1.4493 1.4309 1.4459 1.3305 1.3220 1.3958 1.3554 1.2985 1.6234 1.5193 1.6263
Fenothiocarb 0.8843 1.0370 1.0598 1.0171 0.8563 0.8346 1.0248 1.0272 0.9882 0.7882 1.1231 1.0660 0.8982 0.9274 1.0401 0.9350 0.9284 1.0981 0.9196 1.1496 1.0735 1.1447 1.0690 1.0695 1.0811 0.9958 0.8815 0.8306 0.8385 1.0695 1.1693 1.1741
Fructoselysine 6-phosphate 1.2659 1.4566 1.5302 1.6087 1.1398 1.3834 1.9633 2.4431 1.2196 1.3742 1.6656 1.7362 1.2776 1.3608 1.5519 1.7826 0.4379 0.5117 0.4306 0.4239 0.4125 0.4494 0.4728 0.4603 0.5572 0.4130 0.4090 0.4225 0.4150 0.4684 0.4664 0.4899
[Fv hydroxy,methoxy,methyl,acetyl(5:0)] 3,4,2^,3^,4^-Pentahydroxy-4-methoxychalcone 4-methyl ether 4^-O-(2^^-O-caffeoyl-6^^-O-acetylglucoside) 1.0641 0.8630 0.7816 0.6381 0.9117 0.8883 0.8024 0.7090 1.3686 0.7531 0.7566 0.7331 1.0318 0.9079 0.7859 0.8611 1.2057 1.0182 1.0127 0.9094 1.0889 1.3920 1.0020 1.3755 1.0655 0.9400 0.8943 0.9998 1.3765 1.3216 1.3296 1.2116
gamma-Glutamyl-Se-methylselenocysteine 0.5442 0.5756 0.5566 0.5520 0.4874 0.6213 0.6625 0.8503 0.5849 0.4748 0.5654 0.6194 0.5745 0.4954 0.6278 0.6538 0.7449 1.1977 1.5222 1.9834 0.8753 1.1917 1.2263 2.2934 0.9124 1.3033 1.7123 1.9279 0.6973 1.1574 1.6784 2.1303
gamma-L-Glutamyl-L-cysteine 1.3618 1.8051 1.6441 1.7554 1.6123 1.4618 1.3478 1.7886 1.6052 1.5820 1.6304 1.7269 1.7000 1.5091 1.5355 1.6048 0.3674 0.4423 0.3385 0.3876 0.4555 0.3311 0.3738 0.3839 0.5180 0.3912 0.3400 0.4435 0.3610 0.3576 0.3800 0.4578
gamma-thiomethyl glutamate 1.2938 1.2488 1.1652 1.2694 1.4013 1.1917 1.3128 1.2829 1.2233 1.2764 1.3587 1.1706 1.2699 1.2285 1.1732 1.2288 0.4538 0.5699 0.7494 0.6268 0.6364 0.6386 0.6600 0.9174 0.8696 0.9172 0.8596 0.5897 0.6147 0.4112 0.7728 0.6921
Ganglioside GA1 (d18:1/24:1(15Z)) 0.9737 0.5608 1.4832 2.1937 0.6653 1.0248 0.9316 0.8122 0.7084 1.0791 1.0698 1.0357 0.5405 0.8459 1.4702 0.7791 0.5772 0.9325 0.8587 1.3240 1.9745 1.3439 1.0627 0.9733 0.5946 0.8705 0.8096 0.8665 0.6440 0.7255 1.0630 1.2055
GDP 0.6124 0.6951 0.8483 0.7440 0.5260 0.5661 0.6194 0.7655 0.5084 0.5521 0.8241 0.7455 0.6400 0.6792 0.8308 0.8184 1.0308 1.2104 1.6753 1.3204 1.1677 1.2574 1.4676 1.4715 1.3501 1.4238 1.4262 1.2249 0.9702 1.2714 1.5028 1.2543
GDP-3,6-dideoxy-D-galactose 1.6800 0.7984 0.9928 0.9500 0.8914 0.7092 0.8273 1.4974 1.2501 0.6088 1.3722 1.0312 0.9061 1.3037 1.0579 1.2116 1.5405 1.2661 0.6664 0.7748 0.7680 0.7499 0.8460 1.0003 1.6219 0.5428 1.0404 0.6457 0.5898 1.2101 0.9193 0.7300
GDP-mannose 0.9441 0.8794 0.9287 0.8074 0.7629 0.8210 0.8281 0.8241 0.8457 0.8044 0.8472 0.8301 1.0074 0.9923 0.8596 0.9843 1.0045 1.0706 1.4361 1.1030 0.9909 1.3009 0.9885 1.3958 1.3188 0.9807 1.0209 0.9442 1.1252 1.0472 1.1706 1.1354
Glu-Ala-Ser 0.9466 1.1090 0.8890 0.9136 0.9980 1.1534 1.2687 1.6043 1.0939 1.1413 1.2277 1.0227 0.9437 1.3323 1.0913 1.1575 0.5554 0.8577 0.8691 1.1489 0.5765 0.9253 1.0117 1.1373 0.5812 0.6934 0.9192 1.1470 0.5861 0.9537 0.9572 1.1871
Glu-Cys-Thr 1.0338 0.9621 0.9999 0.8973 0.9345 0.8260 0.8969 0.9804 0.9947 0.8975 0.9382 1.0195 0.8847 0.9198 0.9019 0.9067 1.1149 1.1695 0.9738 0.9653 1.0456 1.0312 1.2794 1.0192 1.3272 1.0229 0.8802 0.8603 1.0796 1.0196 1.1787 1.0387
Glu-Glu 0.9835 0.6468 0.4134 0.5220 0.8195 1.5301 2.4887 2.3344 1.0695 0.8271 0.6531 0.6202 1.0292 1.1564 0.7661 0.7199 NA NA NA NA NA NA NA NA 0.1868 NA NA NA 0.0735 NA NA NA
Glu-Glu-Pro 0.7949 NA NA NA 0.8056 1.5840 1.8921 3.0044 0.8851 0.2799 0.2674 0.4765 0.8820 0.5227 0.3391 0.5095 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Glu-Gly 0.6046 0.5115 0.6348 0.6806 0.5566 0.8078 0.8104 0.7859 0.6052 0.4500 0.4205 0.4369 0.6712 0.6537 0.7734 0.4577 1.8267 1.3469 1.2143 1.2178 1.4802 1.4918 1.1923 1.4979 1.9559 1.1692 1.3266 1.2958 1.3147 1.2440 1.3533 1.2119
Glu-His-Val 1.4432 NA NA NA 1.4107 1.3916 1.4679 1.8930 1.5439 0.2613 0.1926 0.2517 1.4674 0.4899 0.3826 0.3320 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Glu-Met-Ser 0.4329 0.5158 0.4842 0.5017 0.4324 0.5550 0.5118 0.6593 0.4732 0.4722 0.5134 0.5623 0.4709 0.5260 0.4331 0.5248 0.6572 1.2216 1.8262 2.2128 0.8704 1.2604 1.7345 2.9165 0.9318 1.1411 1.5615 2.0913 0.8131 0.9895 1.5449 2.1581
Glu-Pro 1.9445 0.1830 0.1775 0.2584 1.8960 2.0953 2.5768 3.1387 1.9746 0.8998 0.7651 0.4771 1.7620 1.2331 1.0398 0.6654 0.1760 0.3930 0.2108 0.1743 NA 0.2267 0.3601 0.2360 0.1913 0.1979 0.1837 0.1987 0.1264 0.2642 0.1885 0.2662
Glycyl-leucine 0.7753 0.5623 0.6399 0.7058 0.6035 0.5322 0.5535 0.6145 0.6315 0.5101 0.5685 0.5042 0.5756 0.6843 0.5395 0.6869 0.6886 1.0612 1.6054 1.8944 0.7621 1.3030 1.4945 1.8851 1.1211 1.0768 1.5145 2.0489 0.7860 1.2076 1.9650 1.8982
Gly-Gly-Pro 0.7712 0.8907 1.0610 1.0205 0.7987 0.8693 0.9560 0.9989 0.8456 0.8934 0.9006 0.8652 0.8968 0.8470 0.9116 0.9109 1.0344 1.0155 1.1787 1.1388 0.9595 1.2794 1.0993 1.0597 1.3323 0.9927 1.0735 1.1433 1.0107 0.9687 1.1704 1.1059
Gly-His 1.1030 0.9050 0.9648 0.9505 1.0960 1.1663 1.2806 1.5370 1.3421 1.0289 0.9255 0.9786 1.0578 1.1220 0.9629 1.0997 0.7130 0.8615 0.9711 0.8657 1.0263 0.9204 1.0418 0.9274 0.8959 1.0344 0.8737 0.8875 0.8049 0.8714 0.9458 0.8388
Guanine 0.3642 0.9961 1.8333 2.0999 0.4042 1.1646 2.5227 4.4989 0.4096 1.2209 1.5753 1.9211 0.4723 0.9772 1.8000 2.3493 0.4012 0.4480 0.4957 0.4531 0.3795 0.4065 0.5115 0.5061 0.4484 0.3700 0.4757 0.5629 0.4301 0.4192 0.5309 0.5518
Heme 1.0997 0.8413 0.7385 0.6993 0.9665 0.8647 0.6921 0.7272 1.0137 0.6990 0.7572 0.6869 0.9720 0.8055 0.7792 0.7488 1.3308 0.9956 1.0227 0.9949 1.2412 1.3953 1.2322 1.3655 1.1735 1.0858 1.1194 0.9969 1.3330 1.2484 1.1279 1.2449
Heptadecanoylcarnitine 0.4836 0.7060 0.7388 0.8585 0.4771 0.5646 0.7215 0.9111 0.6327 0.6821 0.7038 0.7499 0.5350 0.6542 0.7766 0.7055 0.9962 1.2897 1.5874 1.3747 1.0562 1.3562 1.5902 1.2766 1.6418 1.3643 1.0388 1.3054 1.3340 1.1110 1.2292 1.5473
Heterodendrin 0.8732 0.6884 0.7802 0.9010 0.7442 0.8204 0.6990 0.9351 0.7960 0.7826 0.8350 0.8742 0.8021 0.8460 0.8957 0.7367 1.1909 1.1600 1.2420 1.1654 1.1380 1.2381 1.1256 1.2497 1.4507 0.9674 1.0861 1.1487 1.0131 1.3185 1.2221 1.2738
Homocarnosine 0.7734 0.9208 0.8606 0.9031 0.6823 0.8193 0.9246 0.9211 0.8164 0.6936 0.8053 0.9032 0.7882 0.8999 0.7124 0.7863 1.1125 1.0848 1.2746 1.0131 1.0800 1.1663 1.0538 1.1708 1.3261 1.0417 1.0945 1.5736 1.1404 1.2484 1.3331 1.0758
Homostachydrine 0.8445 0.8935 0.7124 0.7891 0.7687 0.6434 0.8742 0.7863 0.6382 0.8861 0.7110 0.6760 0.8443 0.6572 0.7249 0.8062 1.1346 1.2050 1.1650 1.3194 1.2592 1.3654 1.1929 1.1222 1.7341 1.4002 1.1169 1.0266 1.1897 1.0815 1.2359 1.1955
Hydroxybutyrylcarnitine 0.6608 0.6823 0.7661 0.7372 0.6596 0.7083 0.7467 0.8707 0.7765 0.7342 0.7567 0.7888 0.7802 0.7950 0.7128 0.6620 1.1994 1.2768 1.2260 1.2465 1.1368 1.2654 1.2902 1.2272 1.3531 1.2094 1.1386 1.5089 1.1796 1.2407 1.3813 1.2824
Hydroxyhexanoycarnitine 0.8263 0.6716 0.9362 0.8676 0.9030 0.6707 0.7752 0.6471 0.7147 0.8862 0.7793 0.8794 0.7647 0.8342 0.7597 0.7626 1.1824 1.2054 1.1011 1.2111 1.2666 1.2159 1.3506 1.0961 1.6122 1.0417 1.0791 1.0688 1.1007 1.1307 1.3157 1.3433
Hydroxypropionylcarnitine 0.8520 1.1635 0.9941 1.0939 0.9653 0.9374 1.0468 1.1802 1.0274 1.0293 0.9065 0.9473 0.9372 0.9355 1.0701 1.0067 0.9235 1.0001 1.0538 1.0325 1.0285 0.9905 1.0164 1.0137 0.8861 0.8987 0.8964 0.8981 0.9869 1.0333 1.1872 1.0613
(-)-Hygroline 0.9808 0.9861 1.1954 1.1310 0.7622 1.0935 0.8351 0.4695 1.0177 1.0742 0.9927 0.8438 1.1317 0.8772 1.1906 1.2174 0.8558 0.8980 0.8629 1.1412 1.2127 0.8902 0.9400 1.1405 0.8175 0.8701 0.9871 1.1171 1.1933 1.1779 0.9711 1.1257
Ile-Cys-Gly 0.9074 0.9648 1.0683 0.9719 0.9443 0.8135 0.8293 0.9549 1.1140 0.8699 0.8985 1.0819 1.1130 0.9803 0.9615 1.0329 1.0784 0.9976 0.8798 1.0361 1.2174 0.9728 0.8915 0.9545 1.4783 1.0308 0.9161 0.9396 0.9930 1.0030 1.0299 1.0748
Ile-Leu 1.0612 0.9064 1.0922 1.0040 0.8781 0.9168 0.8561 1.0837 0.9751 0.8798 0.8271 1.0494 1.0361 0.9942 0.9788 1.1813 1.1443 0.9972 1.1469 0.9214 0.9164 0.9622 1.0886 1.0143 0.9182 0.9139 0.9650 0.9338 0.9705 1.2141 1.0911 1.0818
Imidazole-4-methanol 1.0105 0.9984 1.0267 1.1476 0.7259 0.9925 0.7356 0.9510 0.8353 0.9441 0.9843 1.0192 1.1281 0.8374 1.0450 1.2000 1.1977 0.9874 1.1483 1.0697 1.1216 1.0529 1.2458 1.1387 0.6737 1.0220 0.8241 1.3281 0.8352 0.8729 0.7405 1.1596
Indoleacrylicacid 0.6901 0.7710 0.8172 0.8013 0.6503 0.7014 0.6831 0.7670 0.7887 0.6513 0.7805 0.7316 0.7312 0.7033 0.7648 0.6601 1.0647 1.3108 1.3209 1.1857 1.4191 1.3200 1.3587 1.3309 1.4182 1.1398 1.2763 1.1458 1.2141 1.2626 1.3018 1.2376
Inosine 0.4202 0.4292 0.5586 0.4712 0.4670 0.5413 0.5439 0.6364 0.5090 0.4942 0.5246 0.5103 0.4461 0.6194 0.5112 0.6379 1.4724 1.1623 1.2531 1.5108 1.5605 1.5664 1.4762 2.0293 1.6868 1.2818 1.2803 1.5826 1.2341 1.3275 1.4963 1.7589
Isovalerylglutamicacid 0.8190 1.1128 1.1599 0.9973 0.7549 0.8792 0.6388 0.6963 1.4609 0.7584 1.2321 0.9778 0.9894 1.4578 1.0834 1.3378 0.8675 1.1988 0.6368 0.9069 1.1644 1.1098 0.8783 0.5026 0.9960 1.3015 0.9329 0.5019 1.4910 1.1125 0.8364 0.8358
Lacto-N-tetraose 0.8644 0.8789 0.9581 0.9098 0.8569 0.8420 0.9207 0.9471 0.8316 0.8681 0.9590 1.0218 0.9103 0.8916 0.9689 0.9505 0.9726 1.1113 1.0678 1.1764 1.0751 1.1367 1.1215 1.1972 1.0518 1.0802 1.0360 1.0528 1.0509 1.1152 1.0535 1.1212
L-Alanine 0.2629 1.0823 1.3446 0.2827 0.4792 0.2936 1.9251 2.7119 0.6863 1.2742 0.2971 2.1674 1.8135 2.2206 1.7679 0.2628 1.3464 1.1847 0.5973 0.5988 0.5810 0.7440 0.9534 0.6188 1.1089 0.8795 0.5723 1.1889 0.6749 0.7187 0.6781 0.6823
L-beta-aspartyl-L-leucine 0.7012 0.7073 0.7618 0.7501 0.6469 0.9117 0.9475 1.0704 0.7152 0.8043 0.8136 0.6941 0.8226 0.8739 0.7092 0.8546 0.7653 1.4309 1.1851 1.3413 0.6293 1.2669 1.2167 1.3948 0.9836 1.3257 1.2699 1.6403 0.6761 1.1246 1.5035 1.4616
L-Carnitine 0.8375 0.8277 0.9400 0.7941 0.8575 0.9064 0.8940 0.9948 0.9323 0.7807 0.7889 0.8282 0.8064 1.1272 0.7820 0.8442 0.9564 1.1481 1.1179 1.0796 0.9707 1.0989 1.3219 1.1851 1.6695 1.1164 0.9988 0.9824 1.1783 1.0839 1.0787 1.0715
L-Cystine 1.4983 1.6325 1.3209 1.5992 1.6911 0.9080 0.7915 1.5753 1.2192 1.7318 1.2688 1.0914 1.6555 1.4385 1.1524 1.1146 0.6532 0.8081 0.4946 0.6245 0.9921 0.4494 0.5955 0.4356 0.5883 0.9700 0.4195 0.6268 0.9019 0.5366 0.6754 0.5396
Leu-Leu-Leu-Leu 1.0057 1.0528 1.1047 0.9551 0.9182 0.9951 0.9643 1.0805 1.0322 0.9694 0.9062 0.9228 1.0282 0.9861 1.0621 0.9737 0.9278 1.0371 0.9817 0.9986 1.0128 0.9708 1.0867 1.0270 1.0538 0.9738 0.9930 0.9561 0.9070 1.0948 1.0209 1.0011
L-gamma-glutamyl-L-isoleucine 1.0161 0.9567 0.8963 0.8161 0.9111 1.1075 1.1058 1.1146 1.0089 1.0120 0.8471 0.8024 0.9155 1.0992 0.9853 0.9091 0.5993 1.0452 1.3130 1.4184 0.3790 1.0221 1.1627 1.3167 0.6661 0.6759 1.1612 1.3636 0.4982 1.1571 1.2609 1.4569
L-Histidine 0.1264 2.2197 0.6577 1.1360 0.0914 0.1207 0.6027 1.3434 2.6828 0.0949 0.6168 0.1134 0.1175 0.1235 2.9504 0.4922 2.0463 1.0846 1.2683 0.1414 0.1116 1.3124 1.7833 1.3826 2.4062 0.9883 0.1231 3.2355 0.1202 2.2583 0.1258 0.1227
L-Homocitrulline 0.7912 0.5665 0.6324 0.5594 0.6507 0.6338 0.5756 0.5287 0.7773 0.5537 0.5373 0.6050 0.5527 0.7279 0.4771 0.6790 1.8337 1.2838 1.3613 1.3341 1.1638 1.6703 1.2357 1.2070 2.1056 1.2352 1.2563 1.2617 1.2562 1.1558 1.3119 1.0540
L-isoleucyl-L-proline 0.9600 0.8438 1.0220 0.9276 0.8678 0.7963 0.8982 1.0429 0.9479 0.8286 1.0039 1.0002 0.8131 0.9954 0.9174 0.9147 0.9510 1.1600 0.9768 1.0908 1.0486 1.0527 1.0489 1.0926 1.2700 1.0065 1.0911 1.1696 1.0099 1.0152 1.1685 1.0680
L-Methionine S-oxide 1.0288 0.9039 1.1229 1.0436 0.9208 0.7438 0.8616 0.8989 0.8705 0.9473 0.9589 1.0126 0.8878 1.0103 1.0699 0.9893 1.1089 0.9793 1.1228 0.9841 0.7723 0.8447 1.0659 0.9859 1.1806 1.0838 1.0142 1.1341 0.7815 1.2730 1.2026 1.1956
Longifolonine 0.9853 0.9326 1.2339 0.8564 0.8644 0.8395 0.9784 0.7904 0.8785 0.9530 0.9364 0.9635 0.7064 0.9208 0.8126 0.8153 1.0844 1.1526 1.0030 0.8213 1.0090 1.0467 1.1035 1.2095 1.3128 1.0730 1.2087 1.0676 0.8345 1.1193 1.3565 1.1302
L-Phenylalanine 0.7338 1.1172 1.1366 1.0242 1.0273 0.9100 1.0330 0.9238 0.9713 1.0036 1.1104 1.2054 0.8403 0.9542 0.9417 1.1203 1.0631 1.0424 0.7825 1.0398 0.9685 1.0502 1.2120 0.8055 1.0441 0.8811 0.9597 0.9583 1.1102 0.9933 1.1586 0.8774
L-Pipecolate 2.0665 0.4904 0.3753 0.4783 1.8846 1.6615 4.1335 5.7492 1.9301 0.9447 1.3599 2.4572 1.9305 1.5632 1.6424 2.8185 0.0450 0.0294 0.0239 0.0295 0.0439 0.0301 0.0281 0.0282 0.0510 0.0303 0.0284 0.0252 0.0389 0.0283 0.0232 0.0307
L-Tyrosine methyl ester 0.5504 1.1523 1.3681 0.8364 0.7690 0.9986 1.0319 0.8413 1.4499 1.0407 0.8205 0.5890 0.7336 1.1474 0.8327 1.2592 1.3232 1.0056 1.0884 1.0304 1.0153 0.7667 1.4237 0.9948 0.9738 0.8437 1.0006 0.9086 1.0708 1.4112 0.7625 0.9596
Luciduline 0.8970 1.1402 0.9127 1.4167 1.1209 0.9028 1.5331 0.6430 1.0896 0.8073 1.0578 1.0330 1.1157 1.1254 1.0105 1.0347 1.0348 0.6623 0.8920 0.8154 1.0498 0.8447 1.1422 1.1468 0.8675 1.1690 0.7895 0.7151 1.1327 0.9255 0.8432 1.1292
L-Valine 0.9434 0.9980 1.0173 0.9572 1.0611 0.6991 1.0127 0.9908 0.7593 0.8842 0.9514 0.9844 1.0262 0.8442 1.0601 0.7007 1.0087 0.8275 1.1537 1.4950 0.9011 0.8393 1.3379 0.9592 1.0195 1.0877 0.9892 1.1053 1.0129 1.4157 0.8064 1.1509
Lycoflexine 1.0252 1.0388 0.9727 1.0654 1.0380 1.0304 0.9252 0.8736 0.9608 0.8886 0.8821 1.0696 1.0571 1.1223 1.1286 1.0982 0.8975 0.9850 0.9568 1.0934 0.8682 1.0338 1.0055 0.9337 0.9036 0.8682 0.9748 0.9708 0.9454 1.0274 1.2666 1.0928
Lys-Asp 0.9082 0.8872 0.9291 0.8639 0.8088 0.8228 0.7950 0.9720 0.8622 0.8710 1.0305 0.9147 0.8321 0.9019 0.8807 0.8338 1.0152 0.9558 1.1103 1.1119 1.1226 1.2439 1.3048 1.2152 1.1695 1.1280 1.0651 1.0134 1.0345 1.0972 1.1820 1.1169
Lys-Asp-Gly 0.8899 0.9658 0.9823 0.7877 0.7670 0.9184 0.8911 1.0350 0.8943 0.8198 0.9774 0.9523 0.8296 0.8663 0.9157 0.8924 1.0673 1.0084 1.0453 1.1132 0.9720 1.1196 1.1016 1.1400 1.3515 0.9836 1.1169 1.0407 1.0001 1.0977 1.2407 1.2165
Lys-Gly 1.1686 NA NA NA 0.9847 1.3202 1.6917 2.0383 1.2650 0.5181 0.4311 0.3146 1.1150 0.9572 0.6419 0.5535 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
[LysoPC(16:2)] 1-hexadecyl-sn-glycero-3-phosphocholine 0.9987 0.7738 0.9852 1.0621 0.9553 0.8519 0.6503 0.7970 0.9571 0.9316 0.9197 0.9476 0.9571 0.9404 0.7779 0.7863 1.2471 0.9045 1.2975 1.1279 1.3309 1.1040 1.1865 1.2736 1.1328 1.0156 0.9049 1.0058 1.1551 1.0069 1.0836 0.9315
LysoPC(18:1) 1.2024 0.5051 0.6056 0.1824 1.1479 0.3096 0.4066 0.4037 0.8531 0.4704 0.3309 NA 1.0410 0.5385 0.3057 0.5134 1.0689 1.3139 1.1843 0.8600 1.4614 1.2984 1.0614 1.5373 1.2156 1.1738 1.5866 1.2607 0.9886 1.6049 1.5204 1.0943
LysoPC(20:0) 0.8577 0.7843 0.6188 0.5379 0.7956 0.8117 0.4363 NA 1.0082 0.8524 0.5699 0.5706 1.0428 0.7908 0.5371 NA 0.8451 1.0156 1.2076 1.1847 1.5501 1.1915 1.3241 1.3634 1.1254 1.2003 1.3535 1.1159 1.1212 1.2900 1.0314 1.2380
LysoPC(O-16:1) 0.8849 0.9713 0.9886 0.8829 0.8647 0.6917 0.9082 0.7600 0.9379 0.8406 1.0217 0.8367 1.0030 0.9363 0.8392 0.8272 0.9437 1.2831 1.1829 1.0662 1.3442 1.2691 1.4164 1.1912 1.1342 1.0796 0.9108 0.9242 0.9813 1.0095 1.0065 1.0622
LysoPC(O-18:2) 0.8660 0.9484 1.0401 1.1523 0.7602 0.9821 0.7859 0.9447 0.9391 0.8092 1.0715 0.9236 0.9909 1.0383 0.8682 0.8916 0.9411 1.0302 1.1972 1.1771 1.1080 1.0847 1.2444 1.0072 1.0788 1.0288 0.9022 1.0454 1.0206 0.9687 1.0056 1.1482
LysoPE(18:0) 1.3409 0.7452 0.6854 0.3643 0.8789 0.5814 0.5208 0.3690 1.0170 0.6357 0.5427 0.3734 0.9729 0.8053 0.5308 0.3566 1.4277 1.3517 1.1533 1.4270 1.4676 1.4795 1.5805 1.2664 1.4900 1.2367 1.1458 1.1169 1.2143 1.2770 1.3117 1.3339
LysoPE(18:1) 1.2352 0.6434 0.9137 0.6485 0.5755 0.6930 1.1959 1.0980 0.9759 0.5922 0.9082 0.6040 0.9656 1.0181 0.7270 0.7884 1.0739 1.1722 1.2702 0.8711 0.8341 1.5466 1.9664 1.1290 2.0786 0.6926 1.2285 0.8633 0.8048 1.0706 0.8707 0.9450
LysoPE(18:2) 1.1521 0.6710 0.8723 0.7718 0.6113 0.6013 1.3740 1.1579 0.9269 0.5019 0.8347 0.6241 1.0715 1.1059 0.6940 0.7255 0.9462 1.1174 1.1121 0.7626 0.9210 1.2523 1.8840 1.2968 1.5208 0.9206 1.3035 1.0370 0.8324 1.0765 0.9690 1.4873
LysoPE(20:0) 1.0571 0.7052 0.3661 0.2024 0.9098 0.5749 0.3301 0.1556 1.0467 0.5418 0.3386 0.1327 1.0376 0.6306 0.3103 0.1859 1.3426 1.4593 1.5297 1.2343 1.5515 1.5729 1.7290 1.4455 1.5530 1.3991 0.9711 1.2266 1.3570 1.3695 1.3262 1.5730
LysoPE(20:4) 1.1854 0.5669 0.7970 0.7109 0.5307 0.6160 0.9677 0.7331 0.9223 0.5284 0.8904 0.5512 0.8870 0.9099 0.6775 0.7159 1.3112 1.3140 1.5051 0.9047 0.8596 1.4831 1.7695 1.2171 2.1228 0.8195 1.3548 1.0388 0.8635 1.1679 1.0434 1.0346
LysoPE(22:6) 1.5249 0.7940 0.9581 1.2786 0.8862 0.4686 0.9578 0.6218 1.3480 0.3779 0.8492 0.4708 1.2716 0.6898 0.7873 0.8451 1.1714 0.9257 1.0482 1.1670 1.1254 1.2460 1.7713 1.2639 2.0617 0.5365 1.3223 1.0735 0.6899 0.9940 0.8223 0.7222
LysoPE(24:1) 0.9822 1.1885 1.1415 1.0700 1.0783 0.9216 0.9572 0.8871 1.1117 1.0728 0.9126 0.9451 0.9462 1.0882 1.0898 0.9965 0.9186 0.9087 1.1887 1.0056 0.9972 0.9786 1.0281 1.0679 0.9381 0.9611 0.8013 0.8392 1.0482 0.9719 0.8613 1.0961
Lys-Pro 1.2689 NA NA NA 0.8830 1.2441 1.6949 2.4267 1.0177 0.3778 0.3689 0.6813 0.9890 0.6315 0.4351 0.6530 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Lys-Thr-Ser 0.8930 0.9261 1.0128 0.9845 0.8081 0.8574 0.8435 1.0003 0.9404 0.8500 0.9047 1.0319 0.9107 0.9305 0.8991 0.9297 1.1102 1.0939 1.0084 1.0377 1.1242 1.0293 1.1954 1.1226 1.1760 0.9425 0.9905 1.0961 1.1094 1.1132 1.0505 1.0776
Lys-Thr-Thr 0.9167 1.0198 0.8596 1.0785 0.8594 0.9194 0.9420 0.9463 0.9341 0.8789 1.0779 1.0067 0.8814 0.9087 0.8454 0.9805 0.9822 0.9910 0.9880 1.0493 1.0091 0.9729 1.1635 1.2351 1.1349 1.1589 0.9783 0.9434 0.9589 1.2422 1.0638 1.0730
Lys-Val 0.9655 0.1111 NA NA 1.1297 1.6170 1.9010 2.3239 1.0914 0.5243 0.4266 0.3151 1.0842 0.8880 0.6169 0.4126 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Magnoshinin 0.8922 0.6833 0.7481 0.7456 0.6899 0.8313 1.1342 1.0660 0.7946 0.7297 0.9527 0.8252 0.8331 0.7648 0.8497 0.7959 1.1539 1.0969 1.3348 1.3364 0.9065 0.9892 1.0763 0.9395 1.8430 1.1066 1.2930 1.2925 1.1424 1.0313 1.1653 0.9561
Melicopicine 0.9032 1.0172 1.2262 0.8165 0.8430 0.8013 1.0399 0.9175 1.0976 0.9159 1.3866 0.9876 0.9599 1.1780 1.3445 0.8759 1.1804 1.2640 0.7581 1.1171 0.9679 0.8985 0.8610 0.9146 1.0701 1.2209 1.0185 0.7359 0.9112 0.8419 1.0118 0.9172
Met-Ala 1.1139 1.3322 1.3732 1.3362 1.2958 1.1557 1.1444 1.2367 1.3181 1.3152 1.1889 1.2692 1.2639 1.3034 1.1568 1.3929 0.6515 0.8223 0.7871 0.7150 0.7049 0.6171 0.6834 0.8047 0.9263 0.7312 0.7674 0.7977 0.6825 0.6185 0.7695 0.7243
Met-Asp-Ser 0.7921 0.9214 0.8568 0.9974 0.9146 0.9269 0.8671 1.0037 0.8026 0.7500 0.8915 0.8289 0.8576 1.1504 0.9318 1.3147 0.6815 0.9512 1.1992 1.4577 0.6872 0.9720 1.2914 1.2595 0.7069 1.0111 1.4639 1.1426 0.6295 1.0281 1.3439 1.3667
Met-Met-Met 0.7694 0.7346 0.6970 0.8694 0.8531 0.9497 0.8090 1.2126 0.7940 0.7373 0.7798 0.7926 0.8295 0.7892 0.7878 1.0508 1.0838 1.1081 1.2456 1.1874 1.0782 1.0071 1.1744 1.5025 1.2409 0.9909 1.1700 1.3266 0.9865 1.0130 1.1059 1.3236
Met-Ser 1.2563 1.6670 1.4239 1.1748 1.1471 1.1906 1.6224 1.3191 1.1762 1.1789 1.1986 1.2202 1.3469 1.4698 1.2694 1.3012 0.8062 0.8086 0.7353 0.6743 0.7770 0.5096 0.5333 0.6133 0.8606 0.7251 0.5776 0.7127 0.7055 0.6673 0.5766 0.7546
Met-Thr-Asp 0.4437 0.5083 0.7153 0.9396 0.5262 0.5195 0.6457 0.7237 0.4367 0.4823 0.5964 0.7863 0.5587 0.5155 0.4811 0.7781 1.3145 1.0345 1.5609 1.8543 1.0279 1.0387 1.4889 1.8859 1.2204 1.0703 1.2876 1.7036 1.0440 1.0751 1.7288 2.0078
Montanin A 0.8959 1.0636 1.0980 0.9320 0.9147 0.8729 0.9519 1.0456 1.2504 0.8497 1.0688 0.7868 1.0132 1.0008 1.0658 0.9842 1.0259 0.9264 0.9995 0.8015 1.1543 1.0129 1.2467 1.2489 0.8504 0.7636 0.9066 0.9757 1.0766 1.1029 1.0281 1.0860
Myricoside 0.8204 0.9844 1.1457 1.0587 1.0179 0.8704 0.8900 1.3538 0.9689 0.8612 1.2412 0.9205 0.8875 1.1068 1.0704 1.1147 0.8419 1.1349 0.9583 1.0796 0.9344 0.9574 1.1473 0.9814 0.9986 0.8442 1.0913 0.9723 0.9238 0.9542 0.8819 0.9857
Myxalamid D 0.9614 0.9624 1.0849 1.2311 0.8372 1.0188 0.8437 0.8766 1.0681 0.8444 1.1910 1.2625 1.0832 1.1272 0.9225 0.8913 1.0812 0.9600 1.0223 1.0182 0.9082 0.8444 0.8254 0.8701 1.0465 0.8216 0.8735 0.8494 1.2201 1.0130 1.2324 1.2076
N2-Acetyl-L-aminoadipate 0.8149 1.0197 0.8916 0.9098 0.8732 0.8137 0.8884 0.9322 0.8952 0.9713 0.9731 0.9166 0.9554 0.9651 0.9407 0.8658 0.9733 1.1146 1.0768 1.1565 1.1272 1.0980 1.0653 1.1471 1.1636 1.1399 0.9842 1.0803 0.9315 1.0091 1.1748 1.1312
N2-(D-1-Carboxyethyl)-L-arginine 1.1169 0.6036 0.6372 0.9591 0.6237 0.7070 1.6591 2.8360 0.8496 0.4294 1.0738 1.4088 0.6116 0.6339 1.0955 1.6752 0.3357 NA NA NA 0.4472 NA NA NA 0.7418 NA NA NA 0.8705 NA NA NA
N2-(D-1-Carboxyethyl)-L-lysine 1.1220 1.0772 1.1353 0.9643 1.0672 1.0807 1.1163 1.4821 1.0119 0.9855 1.1488 1.2707 0.9636 1.1469 1.1169 0.9984 0.9220 0.8542 0.8293 0.9924 0.7993 0.8878 0.8481 1.0743 1.0881 0.8371 0.8039 0.8273 0.7728 1.0016 0.8499 0.9243
N6-Acetyl-N6-hydroxy-L-lysine 0.9064 1.1209 0.9773 0.9509 0.9387 1.0519 0.9596 0.9759 0.8566 0.8215 0.9901 0.9247 0.9109 1.0136 0.8979 0.8885 0.9616 1.0386 0.9762 1.1164 0.9685 1.1694 1.0718 1.0478 1.2203 1.0860 0.9999 0.9965 0.8614 1.0015 1.2135 1.0853
N-Acetyl-D-glucosaminate 0.7287 0.8294 1.0360 0.5908 1.1371 0.6545 0.7781 1.1464 1.1126 0.6342 1.1261 0.5832 1.0283 1.1864 0.5920 0.6804 1.1681 1.0423 0.8143 0.8102 0.7837 1.0558 0.7999 0.7745 2.2398 1.3867 1.5743 1.6937 0.7191 0.7047 1.0363 1.5528
N-acetyl -D- glucosaminitol 0.8133 0.9076 0.7890 0.9968 0.7899 0.7196 0.7288 0.7886 0.7234 0.8255 0.8164 0.8679 0.8612 1.0874 0.7330 0.7135 1.0600 1.1028 1.4174 1.2074 0.9856 1.3169 1.0633 1.0763 1.4732 1.1868 1.0787 1.0784 0.9949 1.2752 1.2556 1.2656
N-Acetyl-D-mannosamine 0.7765 0.9967 0.9848 0.8536 0.8779 0.8662 0.9212 0.8591 0.8280 0.8072 0.8426 0.8507 0.7670 0.8585 1.0119 1.0663 0.9485 1.0887 1.1428 1.1157 0.9463 1.1468 1.1208 0.9566 1.2465 1.1940 1.0212 1.2173 0.9856 1.3454 1.2444 1.1112
N-Acetyl-L-leucine 0.9084 0.8595 0.9264 0.8335 0.7893 0.8894 0.8872 0.8072 0.8877 0.8977 0.8001 0.8411 0.8139 0.9774 0.8498 0.9192 1.0621 1.0720 1.3115 1.0830 1.0750 1.1490 1.2628 1.0474 1.3913 1.0824 1.0382 1.1975 1.1265 0.9904 1.1140 1.1092
N-Acetylneuraminate 0.7710 0.7027 0.9274 0.9474 0.8137 0.7780 0.7555 1.0117 0.9066 0.7561 0.6928 0.8360 0.7039 0.8708 0.7733 0.9676 0.9710 1.1905 1.2686 1.2114 1.2921 1.1595 1.0800 1.2035 1.2994 1.0112 1.0081 1.2127 1.1330 1.3309 1.2347 1.1792
N-Acetyl-O-acetylneuraminate 0.4395 1.2019 1.6710 1.5919 0.3794 0.6833 0.7339 0.5482 0.4392 1.1894 1.6952 1.8846 0.4556 0.8507 1.6192 1.5604 0.0562 NA NA NA NA NA 0.0783 NA NA NA NA 0.0355 NA NA NA NA
N-Acetylornithine 0.5601 0.5952 0.5519 0.4855 0.5608 0.6423 0.4768 0.5820 0.5937 0.5721 0.6232 0.4442 0.6431 0.6260 0.5030 0.5427 1.8880 1.3813 1.1595 1.2283 1.5558 1.5664 1.5979 1.2148 1.6866 1.4963 1.2257 1.1427 1.3074 1.9275 1.4963 1.1231
N-Acetylputrescine 0.8771 1.0487 1.1954 1.0360 0.8379 0.9876 0.9977 1.1263 0.9443 1.1076 1.1965 1.1729 0.9633 1.1140 1.0290 1.1995 0.7621 1.1137 0.9522 1.0484 0.9414 0.9891 1.0124 0.9320 0.9813 0.8841 0.9110 1.0904 0.7411 0.8608 0.9690 0.9771
N-Acetylvanilalanine 1.0035 0.9124 1.1226 1.0071 0.8321 0.8855 0.8717 1.0895 1.3641 1.2819 0.9802 1.0239 1.0045 1.0998 1.0048 0.7811 0.8660 1.0306 1.3013 0.8159 1.1132 0.9238 0.9955 0.8574 1.2591 1.1121 0.8182 0.7649 0.9478 1.1595 0.8338 0.9361
NADH 0.1996 0.1515 0.1427 0.1057 0.2197 0.1725 0.1423 0.1320 0.2173 0.1267 0.1434 0.1123 0.2149 0.1516 0.1171 0.1353 1.0196 1.3609 3.2630 1.9390 1.1097 2.1718 1.5145 3.7644 1.0740 1.4884 2.4531 2.0261 1.3303 1.4574 1.6271 1.9161
N-Carbamoyl-L-aspartate 2.7423 1.2147 0.3964 0.2115 2.5505 3.4737 3.3745 2.0437 2.8368 1.7104 0.5810 0.3438 2.6647 1.7003 0.8071 0.4991 0.1844 0.3014 0.3691 0.4394 0.2284 0.2743 0.3159 0.4386 0.2335 0.2659 0.3572 0.3524 0.2008 0.2585 0.2822 0.3474
N-Carbamyl-L-glutamate 1.1078 0.7357 0.7188 0.8103 1.0119 1.2693 1.3081 1.4904 1.1090 0.7772 0.7600 0.7578 1.1545 0.9159 0.7864 0.7771 1.0418 1.0107 0.9847 1.0601 0.9775 0.9864 1.0800 1.1634 1.0569 1.0478 0.9692 0.9351 0.9662 1.0302 1.1072 1.0925
N-D-Glucosylarylamine 0.8992 1.0632 1.0684 1.0145 0.9551 0.9836 0.8338 1.0188 1.2044 0.8219 1.4526 0.8895 0.8803 0.8819 0.9407 0.9587 0.8999 0.9280 0.9376 1.0679 1.7419 0.7731 1.3399 0.9394 0.9856 1.0351 0.6998 0.9417 1.0469 1.0941 1.0858 0.6168
N-Ethylmaleimide 0.7719 0.7303 0.8355 0.9149 0.6923 0.8183 0.7927 0.8151 0.7154 0.8135 0.8724 0.5193 0.7454 0.8505 0.7972 0.7601 1.1579 1.2676 0.8105 1.4268 0.9280 0.9961 1.1882 1.0685 1.5562 1.3293 1.1558 1.5267 1.1478 1.2020 1.4658 1.3281
Neuraminic acid 0.7812 0.9829 0.9449 0.9225 1.0172 0.8347 0.9926 0.8945 0.9015 0.8618 1.0718 0.9588 0.8676 0.9315 0.8377 0.8761 1.1094 1.1340 1.1198 1.1888 0.9690 1.0618 1.1956 1.1069 1.3346 1.0296 0.9532 1.0319 1.0065 0.9776 1.0507 1.0532
Nicotinamide 1.4650 0.8050 0.9014 1.2551 0.9613 0.4841 0.7872 0.9342 1.1893 0.6129 0.7638 0.8915 0.7785 0.8605 0.9205 1.1545 1.1155 1.1438 0.6978 0.4505 1.0251 1.2211 1.2427 2.2316 1.8188 0.6694 0.7155 0.8383 0.6936 1.4407 1.1167 0.8142
Nicotinamide D-ribonucleotide 0.9349 1.0347 0.9836 1.0573 0.8343 0.8053 0.7988 0.9320 0.8875 0.9808 0.9213 0.8803 0.8648 0.8333 0.9374 0.9532 1.1459 1.1153 1.1603 1.1566 0.9344 0.9933 1.0181 0.9628 1.0499 1.1470 1.0859 1.0308 1.0566 1.1241 1.2170 1.1623
Nicotinate D-ribonucleoside 1.2581 1.2966 1.3542 1.2460 1.2185 1.1724 1.1824 1.6452 1.2557 1.1782 1.3488 1.3579 1.2969 1.2919 1.2844 1.3468 0.5694 0.5899 0.6574 0.6020 1.0088 0.6419 1.0021 0.7206 1.0539 0.5618 0.9277 0.5572 0.5521 0.5281 0.6475 0.6457
N-(L-Arginino)succinate 1.0423 1.0148 1.0378 1.0399 1.0656 1.2039 1.0043 1.1945 1.1659 0.9333 1.0897 0.9510 0.9896 1.1723 0.9559 1.0344 1.0823 0.9396 0.8607 0.8426 1.1519 0.9611 0.8937 0.7615 1.5241 0.9656 0.7384 0.7256 1.0983 0.8830 0.8473 0.8291
N-Methylpelletierine 1.2226 1.0164 0.9849 0.9516 0.9554 1.1164 0.9188 1.0806 0.7699 0.8309 1.0493 1.0106 0.9211 1.0892 0.9651 0.9923 0.8289 1.1201 1.0754 1.1550 0.7755 1.0817 0.9151 1.2081 0.6320 1.2530 0.8978 1.0867 0.8184 0.9351 1.1763 1.1659
N(pi)-Methyl-L-histidine 1.7585 0.7808 0.4803 0.4137 1.1464 0.6797 0.4869 0.4645 0.9773 0.8893 0.4678 0.3013 1.6403 0.8618 0.4445 0.3666 2.1824 1.3224 0.9639 0.7026 1.8152 1.2352 1.0016 0.7627 2.3879 1.2731 1.0140 0.6950 1.5719 1.2887 1.1265 0.7852
N-stearoyl tyrosine 0.5330 0.6717 0.5823 0.4488 0.4842 0.4278 0.5092 0.3984 0.7626 0.7508 0.5825 0.6505 0.5692 0.8788 0.6217 0.4088 1.3096 1.2638 1.1896 0.9616 1.8313 1.4498 1.3577 1.0289 2.0678 1.3006 1.2317 1.2082 1.4006 1.2712 1.3185 1.1478
O-9Z,12Z-Hexadecadienoyl-R-carnitine 0.5375 0.5826 0.9159 0.5074 0.7384 0.6516 0.5033 0.5934 0.4844 0.6372 0.5550 0.9377 0.4762 0.5410 0.7340 1.0460 1.1594 1.4188 1.3975 1.0368 1.9889 1.1057 1.2849 1.6958 1.1024 1.7159 1.2758 1.3013 1.2448 1.4162 1.2832 1.1464
O-Butanoylcarnitine 0.6915 0.6738 0.6654 0.6645 0.6327 0.6890 0.6451 0.6653 0.6511 0.3360 0.6784 0.6844 0.7019 0.6561 0.6212 0.6450 1.2773 1.4111 1.2737 1.3110 1.3641 1.3656 1.4669 1.3870 1.3912 1.2669 1.3016 1.3235 1.3825 1.4211 1.4644 1.2909
octulose 8-phosphate 0.6206 0.6418 0.6986 0.6119 0.2986 0.7235 0.6958 0.6526 0.6095 0.6052 0.7205 0.6508 0.3649 0.7086 0.7051 0.6663 1.2833 0.7404 1.6109 1.6350 0.6530 1.4921 1.5065 1.8831 1.6102 0.9684 1.3175 1.6583 1.1953 0.9789 1.6832 1.8098
Octylamine 1.0173 0.9570 1.0240 0.9951 0.9429 0.9730 0.9958 1.0331 1.0491 0.9890 0.9835 0.9136 1.0492 0.9616 1.0510 0.9875 0.9485 1.0154 1.0214 1.0133 0.9832 1.0174 0.9660 1.0538 1.0010 0.9929 0.9875 0.9533 0.9924 1.1009 0.9822 1.0482
O-Palmitoyl-R-carnitine 0.6768 0.7481 0.7169 0.6555 0.6274 0.7081 0.6437 0.6303 0.6924 0.6715 0.6785 0.6240 0.6668 0.7087 0.6796 0.6446 1.3305 1.4006 1.1614 1.2961 1.2958 1.4434 1.3466 1.2175 1.7265 1.2854 1.1631 1.1413 1.4792 1.3677 1.4499 1.2719
Ophthalmicacid 0.5044 0.5410 0.4381 0.4780 0.5454 0.5917 0.5340 0.5857 0.5525 0.5602 0.6082 0.5596 0.5349 0.6014 0.5389 0.5072 1.7972 1.4196 1.6577 1.3087 1.6143 1.4920 1.3029 1.2128 1.9043 1.5146 1.1896 1.1186 1.6742 1.6327 1.3233 1.1562
Orotate 0.7389 0.7730 0.6482 0.9791 0.8218 0.7771 0.7905 0.8213 0.8950 0.8300 0.7833 0.8036 0.7540 0.9060 0.7576 0.8824 1.1940 1.0542 1.4426 1.1497 1.1169 1.2899 0.8538 1.1887 1.3224 1.6515 0.9975 1.0204 1.2378 1.1759 1.2383 1.1046
Otonecine 0.8377 0.8602 0.7930 0.7584 0.7005 0.6880 0.7417 0.8350 0.7125 0.6768 0.7505 0.7670 0.7231 0.7938 0.7477 0.7444 1.2655 1.5728 1.2506 1.1018 1.5938 1.1917 1.1340 1.4512 1.2588 1.0652 1.1602 1.2143 1.0183 1.1939 1.2465 1.1513
Ovothiol disulfide 0.7729 0.8532 0.6813 0.9008 0.9525 0.9575 0.8652 1.0771 0.8663 0.8195 0.9210 0.8592 0.8002 0.8299 0.8240 0.9300 0.9013 1.0854 1.0906 1.3013 1.1936 1.1327 0.9786 1.3229 1.0605 1.2014 1.1541 1.2629 1.1580 1.0136 1.0574 1.1749
Pantothenate 0.7951 0.8710 0.9587 0.8952 0.7380 0.8078 0.7453 1.0741 0.7328 0.8327 1.0999 0.9362 0.8691 0.9354 0.9060 1.0190 0.7864 0.9828 1.1450 1.3247 0.9640 0.9998 1.1149 1.3372 1.0671 0.9958 1.1023 1.6743 0.8849 0.9083 1.2226 1.2738
PC(18:2) 0.8561 0.2904 0.5590 NA 0.6005 0.4356 0.8578 NA 0.7752 0.4239 0.7062 NA 0.8647 0.5028 0.3874 NA 1.0842 1.1671 1.1599 0.7917 1.1185 1.5118 2.0547 1.2647 1.9684 0.6735 1.1647 0.9033 0.7850 1.0572 0.9314 1.1619
[PC(18:3)] 1.1585 0.6230 0.4903 NA 0.7496 0.4915 0.6631 NA 0.8862 0.3794 0.5935 NA 1.1075 0.5968 0.3979 NA 1.1719 1.0410 0.9706 1.1222 1.4425 1.2544 1.3224 1.1148 1.3786 1.0346 1.0001 1.1035 1.1870 1.0562 1.3123 1.3614
[PC(19:2)] 1-(1Z,12Z-nonadecadienyl)-sn-glycero-3-phosphocholine 0.9363 1.0659 0.8887 1.0399 1.0442 0.7748 1.2634 0.9381 0.9183 1.1050 1.0409 0.8350 1.0290 1.2116 1.0285 1.0724 1.0004 0.9023 1.0626 1.0495 1.1200 0.9245 1.0476 1.0408 1.0259 1.1072 0.8392 0.9518 1.0013 0.8594 0.9719 0.9035
PC(30:0) 0.9582 1.1136 1.1542 1.1513 1.0243 1.2214 0.9779 1.4845 1.0588 1.0076 1.0616 0.9048 0.9461 1.0772 0.9926 0.9712 0.7887 0.9090 0.8980 0.5941 1.0284 1.1145 0.9793 0.9947 1.0490 0.7487 0.9504 1.0016 0.9611 0.9230 1.0344 0.9196
PC(32:0) 0.8971 0.9830 1.0333 1.6972 0.9688 1.4106 0.9678 1.3967 1.0893 1.0753 0.6761 1.6442 0.9010 0.8723 1.1225 1.6799 0.7203 1.2365 0.5821 0.8847 0.7926 0.6594 0.9054 1.3101 0.6192 0.7902 1.0322 0.7327 0.6045 1.2527 0.6662 0.7961
PC(32:1) 0.4880 1.2147 0.9627 1.0548 0.9382 1.0275 1.0903 1.7864 1.3127 1.1057 0.6274 0.7762 1.0306 1.1715 0.7106 1.0795 0.8410 0.9311 0.9008 1.1381 1.0692 1.1244 0.9653 0.9896 0.8952 0.8547 0.8442 1.0528 0.8931 1.0239 1.0046 1.0951
PC(32:2) 0.8766 0.9725 0.9526 0.6877 0.6375 1.1248 0.9331 1.5787 1.0408 0.8953 0.8042 0.7860 0.8145 0.9507 0.9580 0.8022 0.9558 1.0143 1.0250 0.9224 1.2377 1.3894 1.0643 1.1112 1.0962 0.8400 1.1424 0.9951 1.0463 1.0854 1.2307 1.0289
PC(33:1) 1.0987 1.1059 1.3913 1.3368 1.1671 1.2697 1.4773 2.0533 1.2580 1.1828 1.4135 1.4902 1.2060 1.2895 1.3959 1.1053 0.5914 0.7797 0.5486 0.6737 0.7049 0.7189 0.7152 0.6942 0.5162 0.6950 0.6571 0.6733 0.6708 0.6922 0.7249 0.7027
PC(33:3) 1.0445 1.1379 1.1888 0.9761 1.0101 1.1318 0.9956 1.4860 1.0635 1.0620 1.0872 1.2496 1.0426 1.1610 0.9916 1.2108 0.8391 0.8934 0.7152 0.9754 0.9176 0.8604 0.9465 0.9236 0.8010 0.8198 0.8857 0.8891 0.8987 0.9003 0.9208 0.9742
PC(35:1) 1.0871 1.3189 1.4480 1.1389 0.9530 1.3296 1.9276 2.6453 1.2900 1.3058 1.3196 1.3029 1.1250 1.2710 1.3522 1.3051 0.5082 0.6274 0.5064 0.6570 0.6794 0.6748 0.7714 0.5841 0.5851 0.5514 0.5711 0.6185 0.5510 0.6744 0.6735 0.6462
PC(36:1) 1.2038 1.2633 1.5059 1.2495 1.1739 1.4490 1.7321 2.2973 0.7026 1.3214 1.3903 1.6020 1.1256 1.5065 1.6055 1.0283 0.6312 0.6759 0.5578 0.6438 0.6835 0.6512 0.6510 0.6725 0.5091 0.6061 0.5650 0.7380 0.6222 0.6480 0.2901 0.6978
PC(36:2) 0.7956 1.2886 1.2766 1.2917 0.9741 0.8606 1.3236 1.9657 0.4769 0.6993 0.4894 1.3010 1.1283 1.2012 1.1978 0.6680 0.5534 1.0738 0.4895 1.0340 0.9908 1.1140 1.0971 0.9981 1.0196 1.0088 1.0477 1.0926 1.0306 0.3425 1.1315 1.0375
PC(36:3) 0.8500 1.4782 0.9194 0.7263 0.4373 0.5667 0.9957 1.4897 1.1020 1.1737 1.5504 0.8667 0.4193 1.7870 1.1531 0.6791 0.7216 0.6828 0.9429 1.7938 0.5703 1.0020 0.8594 1.8043 0.6808 0.7816 1.1345 0.6312 1.7274 1.0459 0.7725 0.6546
PC(38:3) 1.0056 1.1219 1.1551 1.0676 0.9787 0.9081 0.9712 1.1901 1.1281 0.9261 1.4015 1.0792 1.0430 0.9503 1.1046 1.0997 0.8121 1.1887 1.0481 0.9921 1.1206 0.9880 1.1114 0.9405 0.8008 0.8176 0.9770 0.8545 0.8546 0.7839 0.7812 0.7982
PC(38:4) 0.9755 1.2113 1.6134 0.7856 0.9664 0.6796 1.2709 1.2952 1.2129 0.7082 1.2796 1.1554 0.8788 1.0864 1.0063 1.2495 0.6144 0.6720 0.6906 1.0248 1.3351 0.7680 1.0639 0.9929 0.9643 0.7531 0.7760 0.8665 1.3196 0.8560 0.9379 0.9899
PC(38:6) 0.8278 0.5910 1.1655 1.1305 1.1253 0.6544 1.4175 0.6979 0.7305 0.5524 0.8366 1.0816 1.0565 1.3123 0.5641 1.1734 0.8941 0.6057 1.6033 0.9259 0.9147 1.6467 1.0829 0.7965 0.4489 0.8757 1.0849 1.4461 1.1052 0.8546 1.0302 1.7675
PC(40:7) 0.7738 0.9050 0.9521 0.8586 0.7809 1.0134 0.8432 1.0675 1.1197 1.0263 1.0499 0.9584 0.8123 0.9820 1.1274 0.9072 0.9115 1.1031 1.0832 0.8750 1.0357 0.9785 0.9967 0.9905 1.0164 1.2010 1.2875 1.0954 1.0114 0.9668 1.1350 1.1346
PC(O-32:0) 0.7530 0.9554 1.1286 1.1046 0.8055 0.9950 0.8967 0.9620 1.1822 0.8479 1.0409 0.9808 0.8439 0.9115 0.9922 0.8513 0.8452 1.0706 1.1022 0.8604 0.9666 1.3861 1.2578 1.1659 1.0232 0.9609 1.0355 1.2040 1.1141 0.7507 0.9975 1.0079
PC(P-34:0) 0.8293 0.9989 1.2878 1.0103 0.8042 1.0084 0.8742 1.0361 1.0933 0.9944 1.0458 1.0129 0.8901 0.9523 0.9552 0.7745 0.8070 1.0246 1.0970 0.8370 1.0062 1.1483 1.0592 1.0154 0.9262 1.0147 1.1003 0.8310 1.0072 1.1114 1.3715 1.0752
PC(P-36:1) 1.0870 1.0568 1.0869 0.9636 0.8319 0.9815 0.7280 0.9980 1.1341 0.9747 1.1329 0.8631 0.7390 0.9598 1.1761 0.9046 0.8176 0.9880 1.2354 1.1254 1.0858 1.0853 1.2843 1.0020 0.9673 0.8852 1.2102 0.7914 0.9618 0.9039 0.9875 1.0509
PC(P-36:4) 0.7868 0.9988 1.0171 0.7668 0.7432 0.8134 0.8822 0.8682 1.0102 0.6554 1.1703 0.8636 0.9850 0.7146 1.1453 0.8943 1.1042 0.8932 1.2097 1.1641 1.0778 1.2984 1.4279 1.2323 0.9966 0.8358 1.3623 0.8122 0.7867 0.9682 1.1616 1.3538
PC(P-38:3) 0.9551 0.8737 1.2125 0.5963 0.5872 0.8906 0.7220 1.1009 1.0209 0.7829 0.9407 0.9483 0.8434 0.9401 1.1476 0.7281 0.9572 1.1268 1.2804 0.8746 1.1694 1.0738 1.3899 1.0020 0.9877 1.1035 1.3123 0.9019 0.9830 0.9344 1.3603 1.2524
PC(P-40:5) 0.6505 0.7599 1.0247 0.7973 0.6645 0.8157 0.6809 0.8340 1.0440 0.9999 1.4213 0.9200 0.8104 0.9669 0.7447 0.8564 1.0747 1.4115 1.1608 0.7847 1.0847 1.2716 1.1581 1.2395 1.1106 0.8565 1.3024 0.7828 1.3016 1.1530 1.1583 1.1315
PE(30:0) 1.0631 0.9456 1.0702 1.1017 1.0140 0.9793 1.0024 1.1090 1.0502 0.9959 1.0036 0.8797 1.0155 1.0389 1.0619 1.0377 1.0642 1.0488 1.0498 1.0509 1.0658 1.0187 0.8161 0.8716 0.9499 1.0702 0.7790 0.8618 0.7754 1.0395 1.0682 1.1011
PE(32:0) 0.9688 1.2482 1.3255 1.1986 0.9621 1.0705 1.0352 1.1353 0.9884 0.9594 1.1378 1.0478 1.1900 1.0349 1.1958 1.0998 0.7873 0.8346 0.7889 1.1342 0.9104 0.9218 1.1222 0.9468 0.6806 0.8381 0.8639 0.9312 0.7660 0.8606 1.0110 1.0045
PE(32:1) 0.9626 1.1412 1.1440 1.1621 0.8877 1.0342 0.9359 1.1603 0.9798 0.9350 1.0693 0.9936 1.1281 1.0729 1.1133 0.9567 0.8433 0.9511 0.8404 1.1170 1.0313 0.9364 1.0888 1.0264 0.8002 0.8879 1.0044 0.9513 0.8126 0.9522 1.0237 1.0565
PE(34:2) 1.3186 1.1048 1.1508 1.1888 1.0282 1.2021 1.2426 1.3453 1.2091 1.0963 1.2979 1.1711 1.2763 1.2239 1.2853 1.3954 0.7519 0.6515 0.7886 0.7919 0.8343 0.7191 0.8565 0.8687 0.7012 0.7980 0.7927 0.7512 0.7507 0.8078 0.8025 0.7970
PE(36:1) 1.1992 1.1302 1.3911 1.5242 1.1390 1.2910 1.4385 1.7211 1.2113 1.1065 1.4470 1.2109 1.2028 1.3154 1.4103 1.4878 0.5670 0.7051 0.6054 0.7145 0.6438 0.7420 0.7814 0.6452 0.5443 0.6427 0.6568 0.6292 0.6330 0.8196 0.7428 0.7009
PE(36:2) 0.7727 1.0429 0.9249 1.0578 1.0344 1.1878 1.1599 1.5826 1.1765 1.0514 1.1970 1.2506 1.0788 1.1216 1.2902 1.3336 0.8102 0.9417 0.8631 1.0188 0.5284 0.9134 0.9067 0.8869 0.7961 0.9033 0.7690 0.7830 0.8132 0.9517 0.9482 0.9036
PE(36:4) 0.7297 1.5381 0.9913 1.5431 0.7869 0.8059 1.5443 1.0550 0.7234 0.9052 1.3461 0.8283 0.6942 0.9844 1.0599 1.1627 0.7508 0.7722 0.6320 1.0909 1.2970 0.9595 0.6904 1.3210 1.1115 0.9534 0.7353 0.9534 0.7311 1.1276 0.7588 1.4167
PE(36:5) 1.0212 1.1035 1.0939 1.1336 1.0731 1.3719 1.2542 1.1409 1.3376 1.1787 1.3118 1.1805 1.1304 1.3235 1.3105 1.1824 0.7043 0.8001 0.7808 0.7637 0.9344 0.9251 0.7905 0.7910 0.7770 0.7660 0.7795 0.6590 0.7955 0.8889 0.8635 0.8329
PE(38:1) 1.2176 1.3441 1.2376 1.3584 1.0389 1.3116 1.1861 1.9091 1.3249 1.3625 1.8558 1.4358 1.2853 1.3215 1.3462 1.4866 0.5338 0.5601 0.6500 0.7081 0.7439 0.7371 0.7023 0.5559 0.5414 0.6278 0.5127 0.6335 0.6210 0.6086 0.6176 0.6243
PE(38:2) 0.9467 1.2600 1.0374 1.0255 0.9546 1.1859 1.1233 1.5423 1.1313 1.0075 1.1387 0.9626 1.1267 0.9112 1.0221 1.2706 0.7341 0.8586 0.9461 0.9937 0.8900 0.9547 1.0541 0.7819 0.9509 0.6924 0.6888 0.8742 0.8982 0.9189 1.1669 0.9505
PE(38:4) 1.0307 1.0878 1.0777 1.1628 0.9050 1.0386 1.0965 1.0672 1.0860 0.9655 0.9592 1.0506 1.0776 1.0206 1.1292 1.0697 0.9012 1.0225 0.8613 0.9983 0.8064 1.0965 0.9382 1.0000 0.8239 0.6814 0.9761 0.8667 1.0223 1.0267 1.1734 0.9804
PE(38:5) 1.1059 1.2701 1.1305 0.6854 1.0463 0.8462 1.0983 1.3824 1.2654 0.7697 1.0618 0.6957 1.1219 1.2077 1.1588 1.1682 0.9954 1.0311 0.9021 1.0842 1.0698 0.6283 1.0604 1.0358 0.9599 1.0411 0.5646 0.6666 1.1415 1.1504 0.8493 0.8052
PE(40:5) 0.9032 1.1604 1.2212 1.1965 0.9292 1.1455 1.0400 1.1633 1.1851 1.0228 1.2996 1.1030 1.0548 0.9944 1.0775 0.9549 0.9060 1.0385 0.8416 0.9657 0.8061 0.9514 1.0110 0.9086 0.9033 0.9140 0.8606 0.7731 0.9206 0.9755 0.9416 0.8309
PE(40:6) 0.9054 0.9329 0.9131 1.0193 0.8585 0.9747 0.8061 0.9521 0.9935 0.7786 1.1395 0.9977 1.1042 1.0184 0.9367 0.9546 1.0007 1.1303 0.9977 0.9363 1.0505 1.1851 1.2301 0.9838 1.1257 1.0843 1.0187 0.9142 1.0889 1.0451 0.9949 0.9287
PE(41:4) 0.8963 1.5992 0.4570 0.3726 0.4584 0.5252 0.7475 0.9865 1.5875 1.2080 1.0040 1.5269 1.3595 1.0491 1.5598 0.6771 1.2744 1.4949 1.1855 0.4830 1.3491 0.7914 1.4608 1.4083 0.7697 1.3005 0.5467 1.2639 0.4340 0.6192 0.9663 0.6376
penem CGP31608 0.8723 0.8990 0.7968 0.9302 0.7892 1.0528 0.8776 0.8838 0.9209 0.8752 0.7747 0.8402 0.6382 0.7854 0.9633 0.8449 1.2886 1.4296 0.9007 1.1928 1.1702 0.9395 1.5094 1.0901 1.1670 1.0131 1.0890 1.1717 1.0835 1.1201 1.0961 0.9940
PE(O-38:5) 0.9165 1.1907 0.9541 1.0623 0.9251 1.0140 0.9769 1.1194 1.0413 1.0759 0.8989 1.0048 0.8533 1.0815 1.0720 1.0228 0.8633 1.2356 0.7770 1.0240 1.1113 0.8372 1.3326 1.0044 0.8022 1.0651 1.0457 0.6770 0.9355 1.0595 0.7949 1.2251
PE(P-34:1) 0.7404 1.0623 1.0285 0.9802 0.8097 1.0327 0.8050 0.7968 0.9978 0.8872 1.0293 0.9852 0.8519 0.9329 0.9874 0.8780 0.9696 1.2252 1.0513 1.1098 1.0612 1.1174 1.2274 1.0969 0.7664 0.9776 1.1210 0.9744 1.0754 0.9807 1.3030 1.1372
PE(P-36:4) 0.6116 0.7918 1.0493 0.8968 1.3540 1.0081 1.2902 1.0901 1.1280 0.9498 0.8322 0.7749 0.9619 0.9501 0.9363 0.7281 1.0653 1.1215 0.7576 1.4659 0.8765 0.8487 1.5854 0.7088 0.9856 1.1167 0.9263 1.0108 1.0669 0.9936 0.8718 1.2455
PE(P-38:5) 0.7327 1.2786 0.7648 1.0447 0.9386 0.9774 0.9003 1.1714 0.9900 0.7476 1.2580 0.7325 0.7823 1.3517 0.9446 0.7726 0.8178 1.3748 0.7512 1.2375 1.0358 1.0898 0.9530 0.8909 1.3140 0.8701 1.0032 0.9675 0.9117 0.8094 1.3909 1.1948
PE(P-40:4) 0.8385 1.0087 0.9857 1.0703 0.9177 0.9068 0.9218 1.0581 1.1337 0.8872 0.9530 0.9704 0.9265 1.0037 0.9005 0.8880 1.0001 1.0888 0.9730 1.1419 1.0855 0.9991 1.1977 1.0833 0.8399 0.9374 0.9799 0.8632 1.0046 1.1379 1.1011 1.1958
PE(P-40:6) 0.9043 0.9690 0.9759 1.1274 0.8207 0.9483 0.8979 0.9892 0.9339 0.8873 0.9798 0.9786 0.9416 1.0328 0.9155 1.0061 0.8718 1.0385 1.0123 1.1435 1.2140 1.0443 1.1264 1.0776 0.8949 1.0600 0.9699 0.9700 0.9730 1.0176 1.1084 1.1694
Phencyclidine 2.4878 0.4305 0.9040 0.8767 1.2316 0.8229 0.8314 1.3739 0.6628 0.6626 2.1240 1.6248 1.2957 0.9308 2.2733 0.7632 0.9182 0.6849 0.7624 1.1694 0.5628 0.9227 0.5722 0.5206 0.5496 0.7394 0.3273 0.4747 1.4678 0.9846 1.2767 0.7708
Phenethylamine 0.9443 1.1406 1.0278 0.9370 0.9449 1.0291 1.0782 0.9690 1.0568 0.9601 1.0276 0.9271 0.9552 1.0137 0.9915 0.9211 0.9799 0.9619 1.0479 0.9619 1.0093 1.0737 1.0676 1.0369 0.9423 1.0299 0.8899 1.0006 0.9469 1.0358 1.1340 0.9575
Phosphocreatine 0.7311 0.6192 0.6869 0.5960 0.7542 0.6563 0.6872 0.6522 0.6966 0.6515 0.6774 0.6610 0.8229 0.7168 0.4989 0.6659 1.2933 1.4167 1.2562 1.2038 1.2309 1.4530 1.4366 1.2891 1.4581 1.3655 1.2772 1.2825 1.2298 1.2494 1.4578 1.3261
PIPES 1.0119 1.0340 1.0140 1.0004 0.9329 0.9999 0.9173 1.0066 1.0361 0.9350 0.8975 1.0005 0.9951 0.9842 0.9856 0.9358 1.0601 1.1220 0.9597 0.9721 0.9942 1.0107 1.0816 0.9989 1.1566 0.9795 0.9036 0.9743 1.0290 1.0829 0.9890 0.9990
[PR] (-)-alpha-Bisabolol 0.9908 0.8454 1.1185 0.8706 1.0256 0.9259 0.8718 0.9754 0.9592 1.0608 0.9843 0.9755 1.0713 1.1383 1.0895 1.0712 1.0051 0.9723 1.0468 0.8680 1.0893 1.1498 0.9862 1.1598 0.9855 0.9995 0.8752 1.0347 0.8613 0.9799 1.0441 0.9684
[PR] Farnesyl pyrophosphate 1.0645 0.8476 1.0018 0.8136 0.8094 0.7698 0.7967 0.7361 0.7810 0.7596 0.9109 0.8255 0.7813 0.8266 0.8762 0.8406 1.2459 1.0726 1.5406 1.1193 1.3408 1.0835 1.0311 1.0884 1.9427 1.0884 1.0528 1.0132 0.8657 0.9288 1.0618 1.0830
Proteacin 0.6951 0.5407 0.5654 0.3573 0.7975 0.7374 0.5956 0.6885 0.5118 0.7842 0.7006 0.8194 0.8177 0.7090 0.5713 0.4074 1.3575 1.0186 1.3541 1.1373 1.1140 1.5013 1.9007 1.2226 1.4168 0.9899 1.1999 1.5721 1.4414 1.2773 1.5972 1.2746
PS(34:0) 1.1422 1.2714 1.1072 1.3515 1.0601 1.3125 1.4544 2.5762 1.2053 1.3216 1.2897 1.1690 1.2818 1.1732 1.3647 1.1990 0.7177 0.6085 0.4392 0.7634 0.7389 0.6431 0.7477 0.6058 0.4483 0.5963 0.6669 0.6599 0.7144 0.7040 0.7551 0.7271
PS(34:1) 1.1374 1.4384 1.3143 1.1887 1.0226 1.2218 1.2664 1.6778 1.1265 1.1067 1.2767 1.1321 1.3567 1.3137 1.3563 1.2082 0.7058 0.7183 0.7632 0.8422 0.7289 0.7937 0.8563 0.7095 0.5655 0.6686 0.7705 0.8133 0.5775 0.7145 0.8479 0.7801
PS(34:2) 1.1809 1.2779 1.3315 1.1330 1.0340 1.4561 1.3455 1.4851 1.2413 1.1957 1.3477 1.1277 1.4269 1.3813 1.3257 1.1583 0.5652 0.5914 0.5574 0.7708 0.7062 0.6924 0.6239 0.5331 0.6019 0.6673 0.9082 0.8533 0.4592 0.8642 0.5905 0.8819
PS(36:3) 1.1598 1.4308 1.4769 1.2279 1.0077 1.3092 1.4099 1.9163 1.1317 1.2562 1.2647 1.2919 1.4806 1.3594 1.5883 1.2341 0.5908 0.6553 0.6912 0.7313 0.6569 0.6730 0.6501 0.6882 0.5116 0.6377 0.6712 0.7162 0.5166 0.6551 0.7100 0.6995
PS(36:4) 1.0742 1.2985 1.2774 1.1788 0.9581 1.1713 1.2046 1.5064 1.0867 1.0730 1.2737 1.2336 1.4099 1.1960 1.2963 1.1026 0.7627 0.7563 0.8054 0.8689 0.7302 0.8213 0.8711 0.8681 0.6883 0.7476 0.8512 0.7467 0.6829 0.7421 0.8401 0.8761
PS(38:6) 0.8972 1.1488 1.0619 1.0630 0.9091 0.9697 0.9767 1.1620 0.9167 0.9340 1.0637 1.0298 1.1562 0.9325 1.1257 1.0201 0.9403 0.9327 0.9927 1.0384 0.9436 0.9134 1.1423 1.0961 0.8922 0.8847 0.9799 0.9082 0.8853 1.0238 1.0325 1.0267
PS(39:4) 0.9093 1.0688 0.9848 0.9701 0.8129 0.9341 0.9220 1.0369 0.8775 0.9109 0.9104 0.9334 0.9497 0.8569 0.9856 0.8751 1.0042 0.9725 0.9188 1.2520 1.1269 1.0873 1.2417 1.1119 1.0555 0.9743 0.9858 0.9467 1.0576 1.0344 1.1327 1.1595
PS(40:8) 0.8297 0.9869 0.9784 0.9565 0.7804 0.8843 0.8466 1.0126 0.8676 0.8998 0.9389 1.0092 1.0692 0.8595 1.0041 0.8865 1.0865 0.9225 1.0690 1.1532 1.1286 1.0566 1.2261 1.2263 0.7868 0.9874 1.1150 1.0486 1.0244 1.0809 1.1337 1.1445
psicoselysine 0.7259 0.8058 0.7736 0.6514 0.7458 0.9118 1.5517 2.0946 0.6664 0.9067 0.9613 1.0390 0.8271 0.9646 1.2117 1.1628 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Pyridoxal 0.4925 0.7385 1.1022 1.2564 0.4848 0.6356 0.9220 1.2500 0.5072 0.7071 1.0226 1.1706 0.4791 0.5995 1.0037 1.3052 0.8519 0.8344 1.3729 1.6154 0.7589 0.7780 1.1696 1.7530 1.1578 0.9309 1.1727 1.5732 0.7249 0.8339 1.3184 1.4771
Pyridoxine phosphate 1.0223 1.1748 0.8893 0.6371 1.0708 0.9400 0.8312 0.8004 1.0073 0.9592 0.8269 0.7116 1.0040 0.9963 0.8538 0.8464 1.2140 1.2543 1.1908 0.8917 1.0588 1.2352 1.0949 0.9145 1.3036 1.1110 1.0018 0.9105 1.0114 1.2560 1.1362 0.8440
Ribitol 0.1820 0.3349 0.2299 0.3340 0.1374 0.3457 0.1643 0.2783 0.1462 0.1451 0.1490 0.1084 0.1963 0.1839 0.1939 0.1624 1.8163 1.4419 2.0809 1.4971 1.6833 1.4559 1.7995 1.2785 1.9038 1.1142 1.4597 1.4528 1.5869 1.0103 1.4615 1.8695
S-Adenosyl-L-homocysteine 1.1651 1.0502 1.1636 1.0187 0.9496 1.0535 1.8975 2.5487 0.9032 1.1953 1.4582 1.6078 1.0277 1.2491 1.7157 1.7458 0.6200 0.5947 0.6133 0.7101 0.6162 0.5962 0.5903 0.7622 0.7646 0.5507 0.5531 0.5602 0.7216 0.7221 0.6013 0.6737
S-Adenosyl-L-methionine 0.8042 1.4214 1.6074 1.6327 0.9753 0.9699 1.2710 1.2256 0.7914 1.3511 1.5276 1.8754 0.9604 1.3813 1.5639 1.8311 0.7005 0.6650 0.6822 0.6526 0.6832 0.6973 0.5706 0.6730 0.8159 0.6589 0.6486 0.6537 0.6957 0.5955 0.7080 0.7095
Saphenic acid methyl ester 0.9902 1.0681 1.1305 1.0573 0.8828 1.0691 0.8881 0.7773 1.1566 1.2667 1.0551 1.0065 1.1430 0.9172 0.8996 0.9061 1.2684 1.1090 0.7970 1.0275 1.0471 0.8367 1.0419 0.7299 0.8911 1.1253 0.8876 0.8447 1.0067 1.2144 1.0613 0.8973
S-glutathionyl-L-cysteine 0.8731 0.8531 0.9570 0.9477 1.0076 0.5622 0.8867 1.3857 0.9329 0.6618 0.8814 0.5968 1.5024 1.1747 0.7326 0.7558 1.1482 1.1137 1.3531 0.9355 1.3909 1.1473 0.7095 1.0318 1.7530 1.0834 0.9515 0.9361 1.1159 0.8372 0.9311 0.8503
Slaframine 0.9001 0.9273 0.8653 0.8874 0.8381 0.8835 0.9327 0.9479 0.9170 0.9079 0.9472 0.8460 0.8750 1.0530 0.7866 0.9530 1.0093 1.0457 1.1085 1.0586 1.0796 1.2192 0.9793 1.2288 1.3810 0.9327 0.9483 1.1673 1.1221 1.0409 1.1653 1.0454
SM(d17:1/24:1(15Z)) 1.2124 0.7541 0.9963 1.0009 1.2090 0.9232 0.9084 1.0803 0.8139 0.8452 1.0686 0.8709 0.9418 1.0282 1.0931 0.9394 0.8628 0.9869 1.1066 0.9195 1.4193 1.1133 1.2939 1.0778 0.7529 0.8944 1.1972 0.8813 0.9690 0.9627 1.0322 0.8445
SM(d32:1) 0.8507 0.9841 1.1246 1.0154 0.8534 0.8779 0.9714 1.0329 0.9944 0.9095 0.8455 0.8938 0.8265 0.9276 0.8651 0.8579 1.0263 1.1742 0.9235 1.0543 1.1407 1.2409 1.1711 1.1301 1.1119 0.9438 0.8658 0.9227 1.0004 1.1158 1.1380 1.2097
SM(d33:1) 0.8053 1.1778 1.4120 1.0489 0.9242 1.0269 0.9823 1.3029 1.1250 0.9741 1.0435 1.4082 0.9641 0.9327 1.0522 1.4271 0.7295 1.1261 0.9383 0.8931 1.0834 0.8625 0.8399 0.8761 0.5396 1.0441 1.0077 0.9862 0.8174 0.8751 1.0100 0.7643
SM(d34:1) 1.3094 0.5184 1.1841 0.5239 1.0516 1.1057 1.0964 1.1907 0.7087 1.0299 0.6888 1.2791 0.5292 0.6284 1.1431 1.2222 0.4784 1.3960 0.9652 0.6787 1.1944 0.6047 0.9361 1.1591 0.9915 1.2364 1.0759 1.2770 1.1674 1.4100 0.7816 1.4379
SM(d34:2) 1.0023 0.9647 1.0380 0.9796 0.8843 0.9594 0.9628 1.0771 1.0646 0.9014 0.9820 0.9253 0.9293 0.9697 0.8879 0.9340 0.9576 1.0168 0.9510 1.1106 1.0691 1.0773 1.1300 1.0698 1.0626 0.9373 0.9717 0.8838 0.9765 1.1192 1.1085 1.0959
SM(d35:1) 1.5020 1.1579 0.9855 1.1516 0.8103 1.0096 0.8591 1.0830 1.2827 0.7955 1.2235 1.0016 0.9374 0.8758 1.1578 1.0016 0.7484 1.0552 0.8867 1.1387 0.9750 1.0117 1.1202 1.0107 0.7363 1.0449 0.8594 0.7663 0.9477 0.8934 0.9636 1.0067
SM(d36:1) 0.8477 1.0485 1.0127 1.1798 0.9287 0.8842 0.9437 0.8396 0.9046 0.8018 0.8011 1.2640 0.7769 0.8481 1.1278 1.0545 0.9382 1.2463 0.8292 1.1272 1.0624 0.9095 1.0650 1.0983 0.5976 1.0808 1.2111 1.4564 0.9746 1.0768 1.0124 1.0507
SM(d36:2) 0.8639 1.0974 1.1960 1.0624 0.9512 0.9819 0.8921 1.1452 1.1414 0.8455 0.8674 0.9583 0.7633 0.6648 0.9861 0.8919 0.7636 1.3052 0.8825 1.2043 1.0739 1.0863 1.0424 0.9336 0.8861 1.0182 0.8931 1.3182 0.9489 1.2570 1.0453 1.0327
SM(d38:1) 0.9603 0.9262 0.9657 1.1700 0.7980 0.7469 0.8798 1.2748 0.9375 0.8190 0.8596 1.4781 0.8117 0.8328 0.9374 0.9080 0.8613 1.3192 0.7302 1.2250 1.0541 0.8761 1.0671 0.9004 0.7353 0.9277 1.2813 1.2642 0.9509 1.2427 1.0926 1.1662
SM(d40:2) 1.0326 0.8945 1.1177 1.1236 0.7828 0.8058 0.8696 1.0693 0.8324 0.8632 0.8996 0.9902 0.8523 0.8410 0.9801 0.9302 0.9043 1.2802 0.8421 1.1173 1.0693 0.9327 1.1876 1.3764 0.8568 1.0731 1.1203 1.3575 0.8771 1.0018 1.0202 1.0986
SM(d42:3) 0.9090 1.1549 1.0485 1.0217 0.8577 0.9080 1.0511 0.5856 1.0856 0.9825 0.7995 0.9363 0.7441 1.0437 0.9515 0.9585 0.9956 1.0941 0.7899 1.1889 1.0951 1.2251 1.2130 1.0549 0.9545 1.0110 0.9770 1.0223 0.7576 1.1569 1.1628 1.2633
SM(d43:2) 1.0351 0.9990 0.9637 1.0674 0.9678 0.8867 0.7975 0.8316 1.0463 1.0384 0.9967 0.9223 1.0197 0.9495 1.0361 0.9719 0.8606 1.0008 1.0922 0.9242 1.0322 1.1427 1.1264 1.0875 0.7224 1.0415 1.0529 1.1371 0.9497 1.0714 1.0654 1.1634
SM(d44:1) 1.1126 0.9978 0.9690 1.1851 1.0467 0.9170 0.8510 1.1261 1.0616 1.1081 1.0430 1.0828 1.2886 1.0588 1.1667 0.9664 0.7685 0.9645 0.6191 1.1607 1.2538 0.8633 1.1067 0.9495 0.4806 1.0165 0.8722 0.8793 1.1430 1.1195 0.9242 0.8975
sn-glycero-3-Phospho-1-inositol 1.7585 1.0874 0.8797 0.8182 1.4803 1.1357 1.3695 1.2722 1.6636 1.0975 1.0462 1.0966 1.4993 1.3159 1.0025 0.9955 0.6410 0.7224 0.8459 0.8023 0.7359 0.7967 0.7181 0.9839 0.9064 0.8189 0.6553 0.6996 0.7205 0.7256 0.7751 0.9338
[SP (14:0)] 1-deoxy-tetradecasphinganine 1.0129 0.8581 1.2971 1.1931 1.1081 0.8540 1.1730 0.9024 0.9897 0.8489 1.0415 1.3741 0.9225 0.9706 0.9825 0.9421 0.8444 1.0651 1.1008 1.0195 1.1628 0.8865 1.1387 1.0602 0.9881 1.1634 0.7782 0.7119 0.8229 0.9333 0.9549 0.8987
[SP (14:0)] N-(tetradecanoyl)-1-beta-glucosyl-sphinganine 0.8850 1.1512 1.3040 1.0097 0.9473 0.9350 1.0813 0.9954 1.0551 0.8861 1.0422 1.1396 0.9269 1.1460 0.9316 0.9769 0.9182 1.0338 0.9746 0.9861 1.1012 0.9268 0.9186 0.9987 1.0417 0.9138 0.9221 0.9229 0.9341 0.9635 1.0048 1.0258
[SP (16:0)] N-(hexadecanoyl)-sphing-4-enine 1.0027 1.0929 0.9430 1.0583 0.9863 0.9545 0.9389 0.9751 1.0915 1.0151 1.1292 1.1589 1.0943 1.1248 0.9557 0.9674 0.7844 0.9429 0.9524 1.0728 1.2032 1.0545 1.0413 0.9373 0.7783 1.0306 0.7945 1.0551 0.9525 0.9595 0.9986 0.9535
[SP (26:0)] N-(17Z-hexacosenoyl)-sphing-4-enine-1-phosphocholine 1.1826 1.0108 0.8283 0.9377 1.1408 0.9388 0.8104 0.8682 0.8876 0.9350 1.2321 1.0572 0.9731 0.9396 0.8694 0.9929 0.8517 1.1095 1.0819 1.2647 1.0974 0.9624 1.1201 0.9716 0.6177 1.0193 1.1995 1.0251 0.8940 1.0016 1.1434 1.0357
[SP hydroxy,hydroxy,methyl(10:2/2:0)] 6R-(8-hydroxydecyl)-2R-(hydroxymethyl)-piperidin-3R-ol 1.1375 1.1168 1.1336 1.4289 0.6290 0.8463 1.1301 1.0339 1.7146 1.0455 0.7087 1.0954 0.8929 1.0089 1.3389 1.1841 0.6062 1.2514 0.6095 0.5575 1.3538 0.6778 1.2591 1.2757 1.2346 0.1953 1.0300 0.8800 0.8444 0.9333 0.9138 0.9327
[SP] Pramanicin 0.9567 1.1278 0.9612 1.0541 0.9848 0.9282 0.9858 0.9641 1.0109 1.0379 1.0023 0.9975 1.0015 1.0666 1.0718 0.9683 1.0165 1.0287 0.9259 1.0214 0.9771 1.0700 0.9754 1.0176 0.9079 1.0658 0.9860 0.9956 0.9393 0.9638 0.9586 1.0309
[SP] Sphing-4-enine 0.6649 0.8753 1.1294 1.1607 0.6405 0.8156 0.7252 0.7401 0.8664 0.7881 0.9362 0.9119 0.8783 0.7907 0.7587 0.9415 0.8629 1.0979 1.2242 1.4386 0.8779 0.9465 1.2288 1.5050 0.9829 1.1079 1.1269 1.4297 0.8131 1.0335 1.2621 1.4388
[SP] Sphinganine-1-phosphate 0.5305 0.7087 1.1403 1.3261 0.7749 0.8213 0.9604 1.5656 0.6655 0.7023 0.9046 1.3223 0.4606 0.7956 0.9060 1.9809 0.9485 0.9337 0.8110 0.9571 1.1786 0.8711 0.8810 1.2089 1.4150 0.8649 0.9997 1.5286 0.9294 0.7495 0.8386 1.2435
[ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene 0.6756 0.9961 0.6337 0.7454 0.9654 1.1032 0.7351 0.5369 1.2319 0.9196 1.7005 1.0952 0.6907 0.7664 0.5669 0.7413 1.6989 0.7604 0.6669 1.0924 0.5845 1.6434 1.4858 1.1759 0.8212 0.9623 1.2437 0.9517 1.7527 0.9948 1.3239 0.7378
[ST Trihydroxy,ox] 3alpha,7beta,12alpha-Trihydroxy-6-oxo-5alpha-cholan-24-oic Acid 1.0168 1.0623 1.0162 0.9418 0.9334 0.8828 0.8724 1.0543 1.3090 0.9096 1.1379 0.8858 1.1551 1.1045 0.9532 0.8019 0.8486 0.8521 1.0280 0.9784 1.1617 0.9272 1.1544 1.0880 0.8949 0.9934 0.8978 1.0160 1.1089 0.7722 1.1144 1.1269
Suberic acid 1.0963 1.0935 0.9924 0.8981 0.8654 0.9278 0.9782 0.9161 0.9198 1.0247 0.8575 0.9159 1.0109 1.0175 1.0081 1.0725 0.9682 1.0485 1.1884 1.0299 0.9878 1.0754 1.0251 0.9381 1.0220 0.9246 0.9419 1.0081 1.0755 1.0860 1.0188 1.0670
Sucrose 0.9306 0.9224 0.9366 0.8771 0.9319 0.8061 1.0216 1.0012 0.9145 0.9287 0.8480 0.9842 0.9634 0.9783 0.8685 0.9924 0.9677 1.0369 0.9203 1.1238 1.0250 1.2127 0.9103 0.9510 1.1203 0.8755 1.0403 1.0431 0.9210 1.1022 1.7246 1.1199
Taurine 0.5868 0.5782 0.6127 0.6984 0.6236 0.5961 0.5857 0.5416 0.6638 0.5721 0.5018 0.5728 0.6289 0.6814 0.5056 0.5250 1.5339 1.4168 1.3463 1.2546 1.6793 1.4144 1.4844 1.2358 1.6148 1.2471 1.3625 1.3044 1.5016 1.5714 1.2719 1.2864
Tetrahydropteridine 0.7884 0.8910 1.0277 1.1614 0.8444 1.0482 1.1894 1.2095 0.8751 1.1021 0.9005 0.9896 1.1326 1.0058 1.0936 1.2591 1.1125 1.0868 0.7054 0.9347 1.1094 1.0414 1.2488 1.2180 0.8237 0.6580 0.8727 0.7924 0.8686 0.8430 0.7900 1.3762
TG(50:1) 0.7138 0.9026 0.8552 0.6871 0.5958 1.3866 3.0519 6.0243 0.8310 0.9740 1.0376 1.0070 0.7420 1.1080 1.4288 1.2846 0.2394 0.4030 0.4167 0.3010 0.3396 0.6484 0.4092 0.3418 0.3433 0.3777 0.2309 0.4124 0.2079 0.4130 0.3374 0.2829
TG(52:2) 0.7847 0.8314 0.9783 0.8933 0.6353 1.2091 2.8926 7.1067 0.7799 1.0079 1.1112 1.4422 0.6021 1.1409 1.5725 1.9834 0.4088 0.4521 0.4424 0.4119 0.3982 0.6440 0.4346 0.4644 0.4206 0.4295 0.3537 0.4164 0.4773 0.3677 0.4102 0.4968
TG(54:3) 0.7187 0.9617 1.0351 0.9971 0.5716 1.4325 3.0519 6.5744 0.6836 1.1574 1.5504 1.7508 0.7073 1.1838 2.0252 2.5051 0.1437 0.2812 0.2989 0.2182 0.3795 0.4760 0.3731 0.3559 0.3055 0.3489 0.2633 0.3740 0.2963 0.2626 0.3878 0.3283
Thiamin 1.1581 1.2565 1.4194 1.4163 0.9720 0.8957 1.1610 1.5579 0.9258 1.3089 1.6584 1.5023 1.1554 1.1996 1.3540 1.3023 0.5003 0.7151 0.7529 0.9416 0.5509 0.7564 0.7490 0.9625 0.6034 0.6312 0.6675 0.8192 0.5524 0.7272 0.8348 0.9921
Thiamin diphosphate 0.8286 1.0722 1.1524 0.8861 0.8390 1.1302 1.8689 2.0302 0.8044 1.0055 1.2818 1.3969 0.9944 1.3028 1.6562 1.5338 0.7119 0.6853 0.9545 0.8213 0.6660 0.6856 0.8219 0.9711 0.8265 0.7152 0.8488 0.7265 0.6054 0.5439 0.8689 0.7637
Thr-Ala-Ala 1.1351 0.8566 0.8510 0.8204 1.0113 1.5656 1.7006 2.1104 1.1651 0.8698 0.9777 0.9311 1.0713 0.9653 0.9823 0.9465 0.7666 0.8654 0.8602 0.9627 0.8720 0.9133 0.8941 0.9092 1.0181 0.8223 0.9285 0.7680 0.8699 0.8136 0.8239 0.9520
Thr-Ala-Pro 1.0906 NA NA NA 0.9229 0.9902 1.5411 2.2364 0.9598 0.2712 0.6068 0.7288 1.0370 0.5825 0.5333 0.4869 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA
Thr-Asp 1.5899 0.8727 0.6833 0.7196 1.3183 1.6143 1.7516 1.3516 1.5636 1.0197 0.7765 0.8162 1.4589 1.1918 0.8194 0.7132 0.8693 0.7628 0.8587 0.9115 0.7309 0.7500 0.7907 1.0800 0.9928 0.7696 0.9254 0.8522 0.7218 0.8498 0.8748 0.9991
Thr-Gly 0.7949 1.0182 0.9902 1.1307 0.8682 0.8664 0.9361 0.9838 0.7518 0.8661 1.0377 1.0119 0.8732 0.9315 0.9007 1.0577 0.9970 0.9882 1.1979 1.1269 1.0501 0.9972 1.0183 1.2136 1.1300 1.0782 0.9901 1.1219 0.8757 0.8910 1.1142 1.1903
Thr-Pro 1.2528 0.0505 NA NA 0.9966 1.3743 2.1920 3.3055 1.2907 0.3325 0.4179 0.3665 1.1883 0.6644 0.5018 0.3843 NA NA NA NA NA NA NA NA NA 0.0409 0.0551 NA NA NA NA NA
trans-Hexadec-2-enoylcarnitine 0.7676 0.6514 0.7580 0.5744 0.5438 0.6633 0.7331 0.6718 0.8059 0.5322 0.5776 0.5172 0.6599 0.7459 0.7080 0.6081 1.3868 1.4164 1.2440 1.4281 1.4373 1.2683 1.5039 1.2349 1.8243 1.3625 0.9763 1.0675 1.3201 1.3177 1.1636 1.4652
Tributyl phosphate 1.2538 1.0969 1.5179 1.0498 0.7072 1.3385 0.6966 1.4409 1.6224 0.9547 1.2631 1.3332 1.2845 0.9257 1.3597 1.0481 0.6833 0.9318 0.5771 0.3103 1.0419 0.7580 0.6881 1.1605 1.3543 0.4548 0.6459 0.6039 0.8167 0.5298 1.5046 1.0462
Trihexosylceramide (d18:1/24:1(15Z)) 0.9956 0.9598 0.9836 1.3851 0.7459 0.7800 0.8482 1.0089 1.2536 0.9036 1.1192 0.9780 0.8145 0.9032 1.1937 0.7904 0.9772 0.9670 0.7668 1.0250 1.2858 1.2064 0.9762 0.7655 1.0223 1.0001 0.8961 1.5041 0.9649 1.0744 0.9048 1.0073
tropine 1.4043 1.1318 1.0091 1.0422 1.1639 1.1056 0.9535 0.9946 1.2737 0.8377 0.6958 1.2781 1.0598 0.8588 0.9779 0.7873 0.9345 0.9569 0.7354 0.8997 0.9249 1.3245 1.0535 0.9724 0.7967 0.7383 0.9065 1.0652 0.9546 0.8564 1.1424 1.1640
Trp-Cys-Gly 1.1513 0.9989 1.0094 0.8904 0.6325 0.7342 0.8915 0.7585 0.9574 0.7603 0.9858 0.9778 0.9799 0.9598 0.8372 0.8744 1.0217 1.1300 1.0720 1.0350 0.9998 1.0276 1.0832 1.1672 1.6718 1.0190 1.0082 1.0363 1.0447 1.1506 1.0022 1.1317
Tussilagine 0.8138 0.8781 0.8085 0.7658 0.7711 0.7593 0.8229 0.8976 0.7634 0.6914 0.9242 0.9610 0.7290 0.8410 0.5693 0.9856 1.0256 1.1074 1.1311 1.0735 1.1627 1.1991 1.2938 1.4554 1.3505 1.1244 1.0662 1.0251 1.2428 1.2479 1.2307 1.2820
Tyr-Tyr 0.9643 0.9527 1.0866 0.9781 0.7619 1.0299 0.9502 0.9519 1.0423 1.0943 0.9836 1.0394 0.8962 0.9079 1.1017 0.9100 1.0797 0.9697 1.0027 0.8220 1.0368 0.9416 1.2042 0.8461 1.1091 1.1835 1.0422 0.9508 1.0058 1.0973 1.0507 1.0066
UDP 0.9322 0.9993 1.1161 0.9245 0.8513 1.0552 1.0558 1.1624 0.9058 0.9222 0.9938 1.0271 0.8761 0.9770 1.1051 1.1100 0.9319 0.9942 1.0477 0.9576 0.8786 1.0697 0.9637 1.1503 1.0613 1.0009 0.9859 0.9792 0.9069 1.0522 1.0277 0.9781
Val-Ala 1.2364 1.3321 1.1825 1.5604 1.1157 1.2864 1.1771 1.2089 0.9779 1.2062 1.3063 1.1857 1.0662 1.6588 1.1707 1.0118 0.5018 0.8764 1.2102 0.7859 0.4992 0.9553 0.8007 0.7077 0.5576 0.8222 0.7308 0.6120 0.5256 0.9668 0.8884 0.8763
Valeroidine 0.9435 1.0494 1.0094 1.0709 0.9253 0.9743 1.0156 1.0204 1.0259 1.0778 1.0280 0.9255 1.0286 0.9709 0.9488 0.9907 1.0281 0.9830 1.0100 0.9168 1.0040 1.0384 0.8969 0.9640 1.1289 0.9503 0.9956 0.9555 1.0711 0.9720 1.0746 1.0058
Vicine 0.9408 0.8593 0.8616 0.9694 0.7837 0.7632 0.8400 0.7928 0.8215 0.8783 0.9015 1.0456 0.8213 0.9536 0.9248 0.7152 1.1258 1.2052 1.1270 1.2476 1.0857 1.2130 0.9463 1.2852 1.3863 0.9971 1.0422 1.1806 1.0440 1.0491 0.9801 1.2120
Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

Factors:

F1cell_type:iRBC | treatment:DHA | treatment_duration_(h):-
F2cell_type:iRBC | treatment:DHA | treatment_duration_(h):3
F3cell_type:iRBC | treatment:DHA | treatment_duration_(h):6
F4cell_type:iRBC | treatment:DHA | treatment_duration_(h):9
F5cell_type:iRBC | treatment:DMSO | treatment_duration_(h):-
F6cell_type:iRBC | treatment:DMSO | treatment_duration_(h):3
F7cell_type:iRBC | treatment:DMSO | treatment_duration_(h):6
F8cell_type:iRBC | treatment:DMSO | treatment_duration_(h):9
F9cell_type:iRBC | treatment:OZ277 | treatment_duration_(h):-
F10cell_type:iRBC | treatment:OZ277 | treatment_duration_(h):3
F11cell_type:iRBC | treatment:OZ277 | treatment_duration_(h):6
F12cell_type:iRBC | treatment:OZ277 | treatment_duration_(h):9
F13cell_type:iRBC | treatment:OZ439 | treatment_duration_(h):-
F14cell_type:iRBC | treatment:OZ439 | treatment_duration_(h):3
F15cell_type:iRBC | treatment:OZ439 | treatment_duration_(h):6
F16cell_type:iRBC | treatment:OZ439 | treatment_duration_(h):9
F17cell_type:unRBC | treatment:DHA | treatment_duration_(h):-
F18cell_type:unRBC | treatment:DHA | treatment_duration_(h):3
F19cell_type:unRBC | treatment:DHA | treatment_duration_(h):6
F20cell_type:unRBC | treatment:DHA | treatment_duration_(h):9
F21cell_type:unRBC | treatment:DMSO | treatment_duration_(h):-
F22cell_type:unRBC | treatment:DMSO | treatment_duration_(h):3
F23cell_type:unRBC | treatment:DMSO | treatment_duration_(h):6
F24cell_type:unRBC | treatment:DMSO | treatment_duration_(h):9
F25cell_type:unRBC | treatment:OZ277 | treatment_duration_(h):-
F26cell_type:unRBC | treatment:OZ277 | treatment_duration_(h):3
F27cell_type:unRBC | treatment:OZ277 | treatment_duration_(h):6
F28cell_type:unRBC | treatment:OZ277 | treatment_duration_(h):9
F29cell_type:unRBC | treatment:OZ439 | treatment_duration_(h):-
F30cell_type:unRBC | treatment:OZ439 | treatment_duration_(h):3
F31cell_type:unRBC | treatment:OZ439 | treatment_duration_(h):6
F32cell_type:unRBC | treatment:OZ439 | treatment_duration_(h):9
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