Data for Multi-omics analysis demonstrates unique mode of action of a potent new antimalarial compound, JPC-3210, against Plasmodium falciparum (Study ST001175)

(Analysis AN001950)

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

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MetaboliteF1F2F3F4F5F6F7F8F9F10F11
1-(14-methyl-pentadecanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerol 0.7584 1.0271 0.9671 0.8841 0.9851 0.6977 0.8179 0.8923 0.8822 1.5675 1.1455
1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one 0.8117 1.0990 1.1140 0.5085 1.0420 0.4509 0.9060 0.5433 0.6771 2.1037 0.9089
1,8-Diazacyclotetradecane-2,9-dione 1.0456 1.1269 1.0540 1.0600 1.0717 1.0681 1.0649 1.0520 1.1137 1.0127 1.0787
1-Methyl-1,3-cyclohexadiene 1.0761 0.9968 1.4675 1.2189 0.8596 1.1963 1.2637 1.3304 0.7517 0.5701 0.9579
1-Methylhypoxanthine 0.9722 1.1805 1.1034 0.8182 0.9170 0.8095 0.8579 0.9141 0.8716 1.4596 0.8592
(1R,4S)-fenchan-2-one 1.3053 1.0721 1.5418 1.3675 1.0367 1.1699 1.3268 1.4364 0.8828 0.5651 1.1227
2,3-Dimethylmaleate 1.0869 1.3045 1.1260 0.9218 1.1457 0.9583 1.1511 1.1133 0.7967 1.2218 0.7102
(24R,24^R)-Fucosterol epoxide 0.8962 1.1268 0.9727 0.9591 0.9967 0.7886 0.9307 0.9846 0.8534 1.3188 0.9586
(2,6-anhydro-3-deoxy-D-arabino-heptulopyranosid)onate 7-phosphate 0.6887 0.7133 0.7172 0.6394 0.6390 0.4693 0.7021 0.6603 0.6050 3.3719 0.6611
2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate 0.8932 1.1333 1.0475 0.9126 1.0521 0.7559 0.9139 0.9518 0.9585 1.1580 1.0319
2-Amino-9,10-epoxy-8-oxodecanoic acid 0.8648 1.1630 1.1894 0.9553 1.1697 0.8186 0.9851 0.9988 0.9039 1.1226 1.2135
2-chlorohexadecanol 0.9496 1.1068 0.9950 1.0521 1.0920 1.1007 1.0368 0.9794 0.9728 1.2225 1.0847
2-hydroxy-3-carboxy-4,5-cyclopropylhex-5-enoate 0.8140 1.1428 1.0776 0.9255 1.0930 0.7971 0.9209 0.9093 0.8744 1.2163 0.9776
2-Methylbutyroylcarnitine 0.9116 1.2132 1.2130 1.0849 1.2893 0.7913 0.9012 1.0516 1.0542 1.1021 1.0750
2-O-Methylcytosine 1.0573 0.9536 1.0355 1.0963 0.9943 0.9535 0.9006 0.9429 0.9758 1.1636 1.1085
3,3^-Thiobispropanoic acid 2.0998 NA NA NA NA NA NA NA NA 0.2668 NA
3,5,7-Trimethyl-2E,4E,6E,8E-undecatetraene 1.1113 1.0493 1.7322 1.1378 0.9092 1.2793 1.4477 1.5751 0.6601 0.4293 0.9850
3-Aminobenzenesulfonate 0.8146 1.1576 1.0495 1.0104 1.2928 0.4311 0.7459 1.0054 0.6004 1.4333 0.9901
3-Butynoate 1.0145 1.1465 1.1118 0.8096 1.0056 0.9470 1.1025 1.1387 0.7319 1.2273 0.6683
(-)-3-Cyanomethyl-3-hydroxy-1H-indol-2(3H)-one NA 1.0296 0.8991 NA 1.0357 NA 0.7462 0.3580 NA 1.1611 NA
3-Hydroxy-N6,N6,N6-trimethyl-L-lysine 0.9236 1.0130 1.0491 0.9751 1.1287 0.7724 0.9314 1.0531 0.9153 1.0677 0.9966
3-Indoleacetaldoxime 0.6167 1.4728 1.4879 0.4272 1.2584 0.3816 0.6108 0.5730 0.2148 2.0598 0.2273
3-Methyleneoxindole 0.6553 1.5458 0.8545 1.2812 1.0350 0.3566 0.7519 0.5643 NA 1.4830 0.1103
3-nitro-2-pentanol 0.8118 1.0091 0.9200 1.1550 1.0178 1.0159 0.8512 1.1737 0.8624 1.1840 0.9412
3-Oxohexobarbital 0.8415 1.5315 1.8622 0.6469 0.8460 0.5703 0.6822 0.6339 NA 1.2849 0.2790
4,8-Dimethyl-1,3E,7-nonatriene 1.1010 0.9891 1.3835 1.1740 0.9531 1.0188 1.0805 1.3620 0.7926 0.4885 1.0429
4a-Hydroxytetrahydrobiopterin 0.7982 0.8886 1.0434 0.9237 1.1031 0.8690 0.9502 0.9659 0.8192 1.3496 0.9956
4-Aminobutanal 1.1093 1.1359 1.2184 1.0144 1.0590 1.0101 1.2529 1.2861 1.0729 1.1218 1.0717
4-Aminobutanoate 0.8038 3.0650 1.0277 0.5348 1.0461 0.4683 0.8824 0.5377 0.7264 1.5694 1.0862
4-Guanidinobutanoate 0.9423 1.3794 1.2485 0.9054 1.1334 0.8734 1.0462 0.9109 0.9201 1.2252 1.0502
4-Hexyl-2,5-dimethyloxazole 1.1958 1.1270 1.0715 1.0485 0.9041 0.9231 1.0090 0.7759 1.3986 1.2088 1.1860
4-(Trimethylammonio)but-2-enoate 0.9001 1.2090 1.0840 1.1135 1.0827 0.8087 0.9631 1.0363 0.9093 1.2557 1.1582
4-Trimethylammoniobutanoate 0.8544 1.1533 1.1093 1.0361 1.0459 0.7801 0.9132 0.9330 0.9149 1.2281 1.0606
5-[2H-Pyrrol-4-(3H)-ylidenemethyl]-2-furanmethanol 0.7691 1.2836 1.0737 1.1213 1.0106 0.9341 0.8802 0.6108 0.6868 1.2315 1.1608
5-6-Dihydrouridine 0.8349 1.1717 1.0605 0.9772 1.0996 0.7792 0.9429 0.9571 0.8019 1.1700 0.9793
5-Acetamidopentanoate 0.9546 1.2589 1.1950 1.1333 1.2041 0.9112 0.9800 1.0547 0.9867 1.2964 1.1868
5-Aminolevulinate 1.0808 1.3271 1.2789 1.0724 1.1285 0.9169 1.1237 1.1514 0.9887 1.2234 1.0158
5-Guanidino-2-oxopentanoate 0.8611 1.3572 1.0990 1.0322 1.0972 0.7186 0.9480 0.8617 0.7802 1.0904 0.9313
5-Hydroxyconiferaldehyde 1.0497 1.0577 1.0879 0.9203 1.0783 0.8800 1.1333 0.9965 1.0721 1.1759 0.9749
5-Hydroxytryptophan 0.7016 1.3135 1.0481 0.7395 1.0005 0.5716 0.7757 0.6820 0.6278 2.2348 0.8092
5^-methylthioformycin 0.9143 0.9915 0.9630 1.0303 1.0307 0.9115 0.8028 1.1410 0.8504 1.2993 0.9057
5-Nitro-2-(3-phenylpropylamino)benzoic acid 0.7333 1.2599 0.8580 0.9610 1.1262 0.4332 0.7756 0.7119 0.7515 1.8925 0.9655
6,7-Dimethyl-8-(1-D-ribityl)lumazine 0.8285 1.1383 1.0752 0.9825 1.0494 0.7636 0.9643 0.9132 0.8444 1.2386 0.9649
6-Acetyl-D-glucose 0.8535 1.0792 1.0473 0.9312 1.0692 0.7915 0.9098 0.9126 0.8920 1.2502 1.0125
8-Amino-7-oxononanoate 0.9688 1.2317 1.1835 1.0971 1.1497 0.9665 1.0396 0.9747 0.9657 1.3898 1.1526
a Cysteine adduct 1.2924 0.7275 1.0070 0.7004 0.6790 0.7566 1.0015 0.9792 1.0492 1.7510 0.8554
Adenine 0.8644 1.1636 1.0585 1.1386 1.1505 0.8890 0.9162 1.0852 0.8225 1.1811 0.9851
Adenosine 0.8647 1.1925 0.9849 0.9193 1.0696 0.7080 0.8877 0.9732 0.9218 1.3778 0.9819
ADP 0.8847 1.1308 0.9520 0.5839 0.8556 0.7231 0.8172 0.7611 0.5337 2.4540 0.5562
Agaritinal 0.8425 1.2817 1.1948 1.2319 1.0105 0.6328 0.9678 1.1646 0.7939 0.9125 1.0533
A-Ketoglutaricacidoxime 0.7319 1.2636 0.9606 0.7383 0.9959 0.5436 0.6671 0.7109 0.5945 1.8646 0.7139
Ala-Ala-Ala-Ser 0.6384 1.2519 0.9898 0.6403 0.8790 0.6029 0.6357 0.6950 0.5655 2.6053 0.6089
Ala-Ala-Asn 1.3915 NA 0.1933 NA NA NA NA NA 1.5449 0.5102 NA
Ala-Asn-Ser 0.4746 0.8147 0.5721 0.4926 0.5644 0.5460 0.4709 0.4646 0.3545 4.1832 0.5504
Ala-Glu-Glu-His 0.6857 1.4808 1.5616 0.1242 1.6077 0.3133 1.3319 0.3874 0.6158 0.9237 1.2254
Ala-Gly-Pro 1.8685 NA 0.2378 0.1153 0.0922 NA NA NA 2.1745 0.5960 0.0932
Ala-Leu-Thr-Ala 0.8735 1.0738 0.9800 0.9090 0.9889 0.8456 0.9110 0.8269 0.8782 1.4748 0.9274
Ala-Pro 1.2135 1.5254 1.4008 0.1423 1.3285 0.1666 0.9606 0.2247 1.5540 1.1591 1.3373
Ala-Val-Gly-Pro 0.8565 1.0334 1.0601 NA 1.0854 NA 0.7449 NA 1.1090 1.0679 0.9448
alpha-Methylstyrene 1.1939 1.3392 1.7889 1.1110 0.8177 1.3470 1.8325 1.5121 0.9034 0.4149 1.0282
AMP 0.9289 1.0127 1.0994 0.8270 1.0340 0.6775 0.9352 0.8864 0.9418 1.3651 0.9749
Asn-Arg 0.9039 NA NA NA NA NA NA NA 1.0961 NA NA
Asn-Asp NA NA NA NA NA NA NA NA NA 1.0000 NA
Asn-Gly-Pro-Pro NA 1.0167 0.8376 NA 1.0395 NA 0.6982 NA NA 1.2436 1.0129
Asn-His 1.3345 NA 0.2268 NA NA NA NA NA 1.6872 0.5765 NA
Asn-Leu-Pro-Pro 0.2663 1.2513 0.8359 NA 1.0924 NA 0.8210 NA 0.3242 1.1939 1.1605
Asn-Pro 0.7448 1.0925 1.0057 0.8546 0.9833 0.6878 0.8278 0.8167 1.4999 1.2925 0.9366
Aspartyl-L-proline 0.9612 1.3149 1.1913 0.2923 1.1546 0.2401 0.9726 0.3206 1.0234 1.5992 1.1543
Asp-Cys-Cys-Ser 0.8911 1.2506 0.9926 0.5235 0.7559 0.7883 0.9794 0.8415 0.4726 2.4134 0.4748
Asp-Gly-Arg 0.7257 1.2989 1.0550 0.6938 1.0966 0.6453 0.7708 0.8456 0.5103 2.0248 0.6210
Asp-Ser NA NA NA NA NA NA NA NA NA 1.0000 NA
Asp-Thr-Cys-Cys 0.9984 0.9134 0.9695 0.5057 0.6986 0.8573 0.6874 0.5044 NA 2.1085 0.3657
Asp-Val-Pro-Ser 0.7475 0.9904 0.9505 0.9185 0.9214 0.6941 0.8338 0.8084 0.8751 1.8311 0.9482
ATP 1.0191 1.5082 1.1516 0.5828 0.8472 0.9110 1.0222 0.7690 0.3713 1.9407 0.4412
Biotin 0.6989 1.1629 0.9705 0.7984 0.7726 0.6857 0.8810 0.9039 0.6965 2.2609 0.6060
Biotin amide 0.8552 1.1046 1.0578 0.9903 0.9983 0.7950 0.8414 0.8979 0.9599 1.2426 1.0602
Cantleyine 0.6820 1.2929 0.9731 1.1379 1.0451 0.6364 0.8350 0.7886 0.9336 1.1109 1.3313
CDP-choline 0.7894 0.9396 0.9727 0.8183 0.9651 0.6858 0.9449 0.8159 0.8989 1.7829 0.8965
Cer(d40:2) 0.8734 0.9055 0.9206 0.9686 0.9792 0.8584 0.9828 0.9379 1.0839 1.1676 1.2029
Choline 1.0610 1.3574 1.2071 1.0391 1.1460 0.8904 1.0191 1.1019 0.9962 1.3015 1.1100
Choline phosphate 0.7500 1.1995 0.9716 1.5346 0.9684 1.1323 0.8740 1.4010 0.7588 1.4436 0.8990
CMP-N-trimethyl-2-aminoethylphosphonate 0.8179 1.2877 1.0191 0.9166 0.9954 0.7138 0.8664 0.8297 0.8393 1.3874 1.0222
Cohibin C 0.8053 0.9760 0.9902 0.8369 1.0463 0.6924 0.8556 0.8979 0.9677 1.5024 1.0410
Convicine 0.8662 1.1023 1.0235 0.9188 1.0179 0.9596 0.9776 0.8828 0.7289 1.5004 0.7189
Creatine 0.9491 1.2439 1.1606 1.1861 1.1395 0.9294 1.0370 1.0666 0.9896 1.3325 1.1930
Creatinine 0.8595 1.0963 1.0777 1.0797 1.0802 0.9578 0.8764 1.0966 0.7771 1.3243 1.0069
Cumene 1.0163 1.0158 1.5883 1.0474 0.8843 1.2220 1.3610 1.4356 0.6270 0.4197 0.9239
cyclic GMP-AMP 0.5343 1.2478 0.9174 0.7685 0.9040 0.6013 0.8478 0.6587 0.6868 2.5123 0.8300
Cys-Gly 0.9681 0.7637 0.9691 0.9461 1.0373 1.0928 0.9916 1.0602 1.1634 1.0273 0.9770
Cys-Gly-Pro 0.7954 1.3924 1.2236 0.8385 1.0094 0.8795 0.8788 0.9348 0.6542 1.3646 0.7932
Cys-Phe-Gly-Gly 0.6776 1.5501 1.2889 0.5869 1.0557 0.8687 0.8662 1.0450 0.1644 1.9838 0.3575
Cys-Trp-Ser-Tyr 1.2577 1.0952 1.2065 0.6048 0.6879 0.8079 1.4062 0.7242 NA 1.5254 0.4008
Damascenine 1.2320 1.3143 0.8740 1.1868 0.9184 0.7951 1.1423 0.7661 1.7047 0.6566 1.8757
Deoxycytidine 0.8695 1.4130 1.0226 0.7171 1.1031 0.8941 0.9135 0.7831 0.5932 1.4108 0.9165
D-erythro-D-galacto-octitol 0.6547 0.9985 0.5849 0.8881 0.6341 0.9262 NA 0.6369 0.7203 2.2271 0.5610
Dethiobiotin 1.1156 1.5146 1.3179 0.2286 1.2062 0.3458 0.9909 0.3630 1.1014 1.0023 1.3494
DG(38:6) 0.5585 1.1209 1.2931 0.6774 1.0776 1.0858 1.1608 1.5314 0.7193 1.1749 0.6525
D-Glucosamine 1.5760 1.0998 1.0181 0.8191 0.8742 0.7842 1.3135 0.8046 0.7517 1.4215 1.0606
D-Glucose oxime 0.8190 1.2288 0.9382 1.0060 0.9241 0.7047 0.9217 0.9709 0.8751 1.4490 0.9137
Dicyclohexyl disulfide 1.0081 1.0731 1.1740 1.1388 1.1081 0.9775 1.1100 1.0850 1.0354 1.2542 1.0050
Dihydroferuloylglycine 0.6637 1.2186 0.9464 1.0059 1.0862 0.5674 0.8352 0.7054 0.8697 1.4389 1.1968
D-myo-Inositol 1,2-cyclic phosphate 0.7307 0.8515 0.7781 0.7757 0.7840 0.6521 0.7984 0.7392 0.5981 2.6966 0.7573
Ergothioneine 1.2347 0.6434 0.8693 0.8717 0.7361 1.0963 1.1881 1.1880 1.5951 0.6956 1.3028
FA (14:2) tetradecadienal 1.2114 1.0770 1.4509 1.2911 1.0316 1.1896 1.2642 1.5675 0.8451 0.5536 1.1516
FA (16:2) 1.2459 1.0594 1.4252 1.2584 0.9752 1.1660 1.2417 1.4258 0.8244 0.6286 1.0953
[FA (18:1)] 9Z-octadecenamide 1.3055 0.9543 1.1407 0.9820 0.8512 0.6997 0.9476 1.1530 0.9414 1.3283 0.8798
[FA oxo(6:0)] N-(3-oxo-hexanoyl)-homoserine lactone 0.6694 1.2740 1.0097 0.9316 1.1020 0.4968 0.8249 0.7045 0.7760 1.7359 1.0151
[FA oxo(8:1)] 5-oxo-7-octenoic acid 0.9858 1.2712 0.9783 0.6984 1.1775 0.9693 1.0121 1.1290 0.8007 1.6959 0.9594
[FA oxo,amino(6:0)] 3-oxo-5S-amino-hexanoic acid 0.9631 1.2323 1.0769 1.0773 1.1856 0.8229 1.0336 1.0783 0.9974 1.3189 1.1084
gamma-Amino-gamma-cyanobutanoate 0.9323 1.0051 1.2750 1.1620 1.2766 0.9600 1.0126 1.1755 1.0107 1.1897 0.9165
gamma-Glutamyl-beta-cyanoalanine 0.8147 1.1166 1.0057 0.9164 0.9534 0.8575 0.9159 0.9836 0.9072 1.3449 1.0068
gamma-Glutamyl-Se-methylselenocysteine 0.0625 0.0670 NA 0.0731 NA NA NA NA NA 1.7786 0.0589
gamma-L-Glutamyl-L-cysteine 0.8198 1.0094 0.9029 1.0583 1.0186 0.9373 0.8902 0.8489 0.7596 1.4256 1.0493
GDP-mannose 0.9578 1.2256 1.2556 0.7174 0.9948 1.0420 0.9296 1.0122 0.7122 1.2973 0.7245
Ginkgotoxin 0.7574 1.1947 1.2073 1.1049 1.2290 0.7078 0.8456 0.7452 0.7601 1.2469 1.0029
Glu-Ala-Gly-CHO 0.4586 1.4032 1.0709 0.5483 1.1265 0.5410 0.7412 0.7488 0.3635 2.4981 0.2784
Glu-Ala-Ser 0.6994 1.1691 0.9438 0.8621 1.0008 0.7173 0.7501 0.8382 0.8168 1.7334 0.9905
Glu-Cys-Cys 1.0153 1.1007 1.0673 0.8740 0.8952 0.6523 1.0300 0.9314 0.8207 1.5509 0.7613
Glu-Glu NA 0.2781 NA NA NA NA NA NA NA 1.1203 NA
Glu-Glu-Pro 0.8197 1.0608 0.9511 NA 0.9656 NA 0.7014 NA 0.9058 1.5063 0.8620
Glu-Leu NA 0.3983 NA NA NA NA NA NA 0.2259 1.4873 NA
Glu-Met-Ser 0.8255 0.8980 0.9394 1.0290 1.0369 0.9706 1.0237 1.0177 1.0075 1.1220 1.0380
Glu-Pro 0.9427 1.3268 1.2782 0.2521 1.2020 0.2534 0.8908 0.3045 1.1557 1.4423 1.2181
Glutathione 1.0531 1.0043 1.0368 1.1230 1.0898 1.1169 1.1143 1.1610 1.2124 1.1642 1.2016
Glutathione disulfide 0.7010 1.4527 1.2303 0.6018 1.0254 0.6662 0.7110 0.7427 0.2669 2.3278 0.4433
Glu-Thr 0.7210 1.3879 0.9748 0.6876 1.0137 0.7030 0.8178 0.7480 0.7355 1.7663 0.9137
Guanine 1.0269 1.1778 0.9742 0.7833 0.8953 0.8519 0.7810 0.9428 1.1676 1.4509 0.7500
Heme 1.0441 1.1228 0.9981 1.2620 1.1145 0.6511 1.2422 1.0403 1.1816 0.3475 1.2749
Heptadecanoylcarnitine 0.8651 1.0771 1.0554 1.0161 1.0454 0.7981 0.9238 1.0225 0.8879 1.1713 1.0156
Hercynine 0.7242 1.1062 0.7812 1.0398 1.1043 0.7123 0.8187 0.8066 0.9873 1.3146 1.2491
Hexadeceylamin 0.8202 1.0753 1.1586 0.9735 1.1146 0.7543 0.8917 1.0980 0.7580 1.1819 1.0055
Hypaphorine 0.8692 1.1117 1.0437 1.0403 1.0374 0.8051 0.9082 0.9735 0.8580 1.1536 1.0393
Hypoxanthine 0.9426 1.2077 1.1296 0.9013 1.0082 0.8522 0.9779 0.9347 0.8137 1.5121 0.9043
Ile-Ala 0.9093 1.1268 1.0430 1.0287 1.0329 0.7982 0.9094 0.9016 0.8995 1.1738 0.9899
Ile-Cys-Phe 0.7968 0.9834 1.1499 1.0453 1.1572 0.9498 0.8579 1.0534 0.4481 1.4483 0.7686
Ile-Gly 1.4074 1.1721 1.0176 1.0006 1.0865 0.8758 0.9149 0.9959 1.6839 0.8620 1.1007
Ile-Ile-Pro 0.9165 1.4056 1.0018 0.7814 1.0101 0.6918 1.0369 0.9460 0.8954 1.2454 0.8484
Ile-Lys-Pro 0.8573 1.1674 1.0317 1.0258 1.0283 0.7871 0.8700 0.9633 0.9113 1.1451 1.0563
Ile-Ser 1.6058 0.6586 0.5823 NA 0.5147 NA 0.5151 NA 1.6057 1.6366 0.5631
indole-3-acetonitrile oxide 0.7231 1.3547 1.3968 0.7035 1.0954 0.5632 0.6918 0.8022 NA 1.8012 0.1679
L-Ala-L-Glu 0.6998 0.9622 0.8477 0.9236 0.8746 0.7428 0.9074 0.8770 0.8261 1.8693 1.0339
L-Alanine 0.9572 1.2892 1.1022 1.2173 1.0936 0.9238 1.0599 1.0014 0.9463 1.4120 1.1454
L-Arginine 1.1538 1.2536 1.2892 0.9928 1.1278 0.9577 1.1959 1.1224 0.9571 1.2865 0.9415
L-Asparagine 0.8745 1.0829 0.8654 0.7568 0.8752 0.7045 0.8097 0.8099 0.7970 2.7270 0.8017
Lauroyl diethanolamide 1.3471 1.0354 1.3933 1.4721 0.9964 0.8834 1.1487 1.4977 0.9127 0.6993 1.1106
L-Carnitine 0.8710 1.1451 1.1065 1.0495 1.0842 0.7967 0.9313 0.9580 0.9330 1.2692 1.0950
L-Citrulline 0.7954 1.0356 0.9243 0.9211 0.9582 0.7802 0.8039 0.8566 0.7929 1.7384 0.9645
L-Cystine 0.5205 0.6528 0.4544 0.4513 0.3983 0.5273 0.6366 0.5062 0.5074 4.3929 0.4653
Leu-Asp 0.8228 1.1957 0.9171 0.9330 1.0964 0.7995 0.9553 0.7714 0.8041 1.3897 0.9405
Leu-Pro 0.9138 1.1790 1.0921 1.0963 1.1016 0.8298 0.9392 1.0163 0.9615 1.2570 1.1127
Leu-Val 0.9852 1.1506 1.1497 0.5451 0.8723 0.4138 0.7579 0.5691 0.9938 2.0153 0.9074
L-Glutamate 0.9279 1.4701 1.0686 0.9719 1.1292 0.8426 0.9348 0.9364 0.9475 1.6911 1.0793
L-Glutamine 1.1263 1.2622 1.2102 1.0030 1.0869 0.9482 1.1380 1.1305 0.9695 1.3754 1.0164
Linoleamide 1.1617 0.7393 1.1492 1.2221 0.7243 1.1943 0.8851 1.1564 0.9686 1.4371 1.0414
L-Leucine 1.0026 1.3939 1.1481 0.8570 1.0856 0.7814 1.1140 0.8925 0.9704 1.7669 0.9544
L-Lysine 1.2567 1.4220 1.2765 0.7938 1.1113 0.7825 1.1286 1.0121 1.1673 1.2874 0.9753
L-Methionine 1.0051 1.1522 1.0537 0.7857 0.9186 0.7608 0.9398 0.8885 0.9704 1.4817 0.7760
L-Methionine S-oxide 0.8671 1.3991 1.1622 0.7531 1.0135 0.6268 0.9538 0.9130 0.6628 1.4924 0.7850
L-Ornithine 1.0516 1.2035 1.1980 1.1610 1.1722 1.0815 1.0318 1.0395 0.9787 1.2251 1.1387
Lotaustralin 0.8396 1.1098 1.0229 1.0070 1.0499 0.8122 0.8898 0.9039 0.8796 1.2025 1.0732
L-Phenylalanine 0.8633 1.1856 1.0301 0.6675 0.9162 0.6396 0.8940 0.6956 0.8416 2.2070 0.8519
L-Pipecolate 1.0441 1.5087 1.3961 0.6550 1.2767 0.5583 1.1551 0.6475 1.0046 1.4144 1.2206
L-Proline 1.0442 1.4306 1.2658 0.9607 1.1261 0.9298 1.1283 1.0444 0.9385 1.3202 1.0476
L-Serine 0.7798 0.9677 0.8328 0.6834 0.7825 0.6769 0.7221 0.7288 0.6547 2.9643 0.7337
L-Threonine 1.1250 1.3567 1.2775 0.9567 1.1280 0.9419 1.1646 1.0568 0.9684 1.2945 0.9792
L-Tryptophan 0.8910 1.1615 1.0165 0.7686 0.9418 0.6980 0.9386 0.8141 0.8827 1.5553 0.9759
L-Tyrosine 0.9652 1.2459 1.0639 0.8307 0.9943 0.7743 0.9813 0.8851 0.9067 1.3878 0.9396
L-Valine 0.9539 1.3052 1.1460 1.1665 1.1925 0.8959 1.0568 1.0422 0.9357 1.2647 1.1682
Lys-His 1.3661 1.2276 1.3854 0.0867 1.2491 0.1246 0.8438 0.1969 1.3266 1.1340 1.1575
LysoPC(16:0) 0.8966 1.1749 0.9663 0.7599 0.9561 0.6099 0.9542 0.8695 0.8281 1.8292 0.8507
[LysoPC(16:2)] 1-hexadecyl-sn-glycero-3-phosphocholine 0.7690 1.1048 1.0194 0.8834 0.9455 0.7547 0.8968 0.7874 0.7926 1.8165 0.9522
LysoPC(18:0) 0.8915 1.2173 0.8876 0.8023 0.8848 0.6034 1.0829 0.8015 0.9319 1.6941 0.9667
LysoPC(18:1) 0.8648 1.1797 1.1008 0.7055 0.9831 0.6438 0.8040 0.8922 0.7392 2.0023 0.7309
LysoPC(O-16:1) 0.8498 1.1980 1.0545 0.8459 1.0008 0.7670 0.8925 0.8637 0.7972 1.5909 0.8989
LysoPC(O-18:0) 0.7849 1.0479 1.1351 0.8969 1.0207 0.8298 0.8522 0.8438 0.8511 1.5884 0.9047
LysoPE(18:1) 0.8385 1.1521 0.9746 0.8662 0.9693 0.7923 0.8806 0.9038 0.8294 1.6869 0.8817
LysoPE(20:4) 0.7850 1.1995 1.1867 0.7276 1.0479 0.6666 0.6758 0.8251 0.5540 2.1904 0.6808
LysoPE(O-18:0) 0.7431 1.2184 1.0199 0.9377 0.9563 0.6513 0.8188 0.8897 0.8347 1.6592 1.0241
LysoPE(P-20:0) 0.8044 1.0789 0.9903 0.9388 0.9126 0.8578 0.9205 0.9346 0.8782 1.5863 0.9645
Lys-Pro 1.1436 1.3165 1.1787 0.1746 1.0991 0.1543 0.9231 0.1849 1.4574 1.3742 1.1056
Lys-Thr-Ser NA NA NA NA 0.4936 NA NA NA NA 1.0844 NA
Lys-Val 0.8278 1.1009 1.0489 1.0243 1.0713 0.8066 0.8767 0.9928 0.8874 1.1531 1.0300
Mesaconate 0.8701 1.1367 0.6449 0.6158 0.7459 0.9233 0.5685 0.5814 0.6989 2.3832 1.0349
Met-Ala-Gly 0.7513 1.2051 0.9686 1.0816 1.0633 0.6798 0.7737 0.8165 0.9614 1.2376 1.1689
Methacholine 0.9215 1.1707 1.1379 1.0477 1.0984 0.7769 0.9981 1.0062 0.9591 1.2744 1.0906
methiin 0.9722 1.1041 1.0457 0.9655 0.9685 0.9234 0.9875 1.0850 0.9240 1.1055 0.8915
Methocarbamol 0.9686 1.0191 0.8508 1.1926 0.8871 0.6843 0.9478 0.8518 1.4130 0.6008 1.7525
Met-Phe-Asp NA NA NA NA NA NA NA NA 1.0000 NA NA
Met-Pro 1.2638 NA NA NA NA NA NA NA 1.3662 0.4960 NA
Montecristin 0.7236 0.9968 0.9478 0.9018 0.9606 0.7452 0.9528 0.8196 0.8672 1.6310 1.0589
Muramic acid 0.8692 1.1598 1.0795 0.9245 1.0577 0.8203 0.9080 0.9821 0.8276 1.2334 0.9285
N-(1-Deoxy-1-fructosyl)isoleucine 0.9123 1.2541 1.0847 0.7295 0.9244 0.7750 1.0226 0.8658 0.8226 1.6072 0.6652
N-(1-Deoxy-1-fructosyl)proline 0.9900 1.5669 1.1631 0.8014 0.9357 0.8101 1.1286 0.9762 0.7345 1.1766 0.6869
N2-Acetyl-L-aminoadipate 0.7973 1.1678 1.0105 0.9388 0.9805 0.7641 0.8819 0.9105 0.8626 1.4283 0.9770
N2-Fructopyranosylarginine 1.0823 1.3451 1.2209 0.7014 0.8898 0.8734 1.0886 0.9208 0.6384 1.4805 0.5497
N-(3-acetamidopropyl)-4-aminobutanal 0.9363 1.0327 1.2146 0.9638 1.2100 0.9190 1.1541 1.0445 1.1354 1.2577 1.1486
N-(3-oxohexanoyl)-L-homoserine 0.7214 1.4342 1.1962 0.9495 1.3723 0.6572 0.7778 0.9101 0.6543 1.7323 0.8837
N6-Acetyl-N6-hydroxy-L-lysine 0.8501 1.1691 1.0808 1.0113 1.0371 0.7945 0.8857 0.9921 0.8693 1.1425 1.0150
N6-Galacturonyl-L-lysine 0.7467 1.1150 0.9314 0.8891 0.9503 1.0082 0.8056 0.8503 0.6869 1.6790 1.0000
N6,N6,N6-Trimethyl-L-lysine 0.8794 1.0201 1.0099 1.0501 1.0735 0.7977 0.8950 0.9115 0.9369 1.1875 1.0168
N-Acetylanthranilate 0.8287 1.1427 1.0045 0.8475 0.9833 0.8120 0.8424 0.9334 0.8198 1.5477 0.9129
N-acetyl-demethylphophinothricin 0.9883 1.0254 1.0356 0.8954 0.8802 0.8554 0.9018 0.9172 0.9082 1.5744 0.9682
N-acetyl -D- glucosaminitol 0.7789 1.1195 0.9763 0.9599 0.9548 0.7287 0.7877 0.9148 0.8002 1.5560 1.0899
N-Acetyl-D-mannosamine 0.8601 1.0844 0.9416 0.9553 0.9168 0.8348 0.9079 0.9050 0.8251 1.4959 1.0225
N-Acetyllactosamine 0.7886 1.1135 1.0234 0.9443 1.0536 0.8017 0.9032 0.8752 0.8463 1.3242 1.0428
N-Acetyl-L-citrulline 0.8294 1.0617 1.0730 0.9158 1.1992 0.8808 0.6544 1.1951 0.5577 1.5904 0.6167
N-Acetyl-L-glutamate 5-semialdehyde 0.5692 1.0224 1.1091 0.9939 1.1120 0.5401 0.9822 0.9807 0.7249 1.8377 0.7288
N-Acetyl-L-leucine 0.9729 1.2569 1.1478 1.0783 1.1473 0.9180 1.0106 1.0648 1.0662 1.3381 1.1425
N-Acetylmethionine 2.0319 0.7810 0.8557 0.5096 0.7139 0.5392 0.4870 0.5396 2.2724 1.5113 0.6149
N-Acetylputrescine 1.0138 1.2918 1.2094 1.0727 1.1757 0.7930 1.0603 1.0851 0.8893 1.3683 1.1057
NAD+ 0.7705 1.1530 0.9992 0.9136 1.0313 0.7700 0.8623 0.8511 0.8539 1.5027 0.9228
NADP+ 0.8676 1.1822 0.9864 0.7483 0.9512 0.8701 0.8847 0.8555 0.5712 1.9388 0.6427
N-Butyryl-L-homoserine lactone 0.8362 1.1686 0.9840 1.0068 1.0177 0.9086 0.8700 0.9370 0.8865 1.5732 0.9385
N-dimethylethanolamine 1.1998 1.3216 1.2740 1.3739 0.8698 1.0280 1.0217 1.3273 0.9718 0.7625 1.0707
Nebrosteroid M 0.8219 1.1226 1.1052 0.9061 0.9499 0.9235 0.9087 0.9727 0.9099 1.2221 1.0579
NG,NG-Dimethyl-L-arginine 2.6447 0.5054 0.6002 0.4404 0.4979 0.3378 0.4477 0.4045 3.4137 1.1775 0.5034
N-hydroxyisoleucine 1.0856 1.1159 1.0824 1.0190 1.0777 0.9027 1.0798 0.9939 1.0438 1.1651 1.0804
Nicotinamide D-ribonucleotide 0.7327 1.2346 1.1144 0.7410 1.0212 0.5028 0.7833 0.5648 0.9645 1.8894 0.7577
Nicotinate 0.8860 1.1174 1.1369 1.0612 1.0328 1.0827 0.8875 1.1398 0.8651 1.0933 0.9099
N-Methyl-2-pyrrolidinone 0.8376 1.0052 1.1369 0.9412 1.1024 0.8807 1.3543 1.1449 0.9916 1.0844 0.9937
N-Methylnicotinate 1.1155 1.1111 1.2621 0.8950 1.0275 0.8754 1.1091 1.1444 0.8198 1.4501 0.8638
N-Methylpelletierine 0.8703 1.4974 0.9462 0.7741 1.7649 1.3770 0.8298 0.9238 0.7242 1.1837 0.7013
O-9Z,12Z-Hexadecadienoyl-R-carnitine 0.8112 1.0934 1.0659 1.0092 0.9993 0.8390 0.9376 0.9613 0.9804 1.2088 0.9922
O-Acetylcarnitine 0.8841 1.1253 1.0651 0.9765 1.0280 0.7647 0.9129 1.0032 0.9497 1.2651 1.0634
O-Acetyl-L-homoserine 0.8450 1.1880 1.0965 1.0782 1.3261 0.6824 0.7578 0.7918 0.9929 1.4914 0.9084
O-Butanoylcarnitine 1.0159 1.1690 1.1997 1.1290 1.1660 0.9245 0.9904 1.1109 1.0207 1.1367 1.1139
Oleoylcarnitine 0.8314 1.1177 1.0311 1.0244 1.0509 0.7554 0.9179 0.9553 0.8800 1.2069 1.0666
O-Palmitoyl-R-carnitine 0.8728 1.0845 1.0439 1.0527 1.0326 0.8016 0.8654 0.9632 0.8557 1.2726 1.0034
O-Propanoylcarnitine 0.8692 1.1503 1.0268 1.0120 1.0322 0.7786 0.8935 1.0468 0.8475 1.1294 1.0812
Otonecine 0.8516 1.2044 1.1480 1.0091 1.0016 0.8740 0.9056 0.9665 0.9253 1.1509 1.0665
Pantothenate 0.8355 1.1765 0.9465 0.8198 0.9191 0.7864 0.9222 0.8100 0.8192 1.8543 0.8882
PC(14:1) 0.7510 1.2215 0.9987 0.8189 0.9879 0.8880 0.9403 0.7798 0.8396 1.6884 0.8397
PC(18:2) 0.9549 1.2852 1.2206 0.8348 1.1322 0.7843 0.8807 0.9499 0.8300 2.2540 0.8135
PC(30:0) 0.8997 1.1149 1.0557 0.9436 0.9794 0.8337 0.9262 0.9072 0.8726 1.2933 0.9778
PC(32:0) 0.9231 1.0497 1.0992 0.9891 1.0070 0.8658 0.9699 0.9355 0.9836 1.0474 1.0510
PC(32:1) 0.8628 1.1208 1.0558 0.9215 1.0198 0.8673 0.9183 0.8611 0.9696 1.2045 1.0134
PC(34:1) 0.9325 1.1416 1.1095 0.9858 1.0449 0.8982 0.9564 0.9452 0.9559 1.1178 1.0302
PC(34:2) 0.9008 1.1248 1.0712 0.9931 1.0265 0.9162 0.9671 0.9206 0.9519 1.1887 1.0338
PC(36:1) 0.9562 1.1005 1.1342 1.0279 1.0356 0.8822 0.9536 0.9698 0.9606 1.0688 1.0616
PC(36:2) 0.9054 1.0980 1.0757 1.0080 1.0360 0.8987 0.9894 0.9443 0.9440 1.1704 1.0281
PC(38:4) 0.9462 1.0525 1.0543 1.0268 1.0331 0.8924 0.9700 0.9339 0.9462 1.0391 1.0177
PC(38:5) 0.9505 1.0794 1.0408 1.0109 1.0378 0.8963 0.9735 0.9293 0.9567 1.0380 0.9959
PC(38:6) 0.9311 1.0511 1.0390 1.0074 1.0590 0.8912 0.9564 1.0212 0.9567 1.0181 0.9936
PC(40:6) 0.9150 1.0366 1.0770 0.9918 1.0261 0.8716 0.9027 1.0033 0.9927 1.0778 1.0157
PC(40:7) 1.1360 1.0086 1.0654 1.1329 1.0423 0.9427 0.9953 1.0774 0.9897 0.7340 0.9819
PE(32:0) 0.7300 0.9886 0.9212 0.8900 1.0604 0.7018 0.8715 0.8266 0.9121 1.5843 1.0582
PE(32:1) 0.7538 0.9877 0.9224 0.9090 1.0484 0.7246 0.8760 0.7838 0.8901 1.5719 1.0870
PE(34:1) 0.9256 0.9460 1.0838 1.0099 1.0150 0.9846 0.9799 0.9853 0.9850 1.0409 1.0046
PE(34:3) 0.8119 1.0066 1.0510 1.1198 1.0471 0.8764 0.8090 1.0221 1.0133 1.1637 0.9365
PE(36:4) 1.0027 0.9720 1.0339 1.0154 1.0299 0.9930 0.9658 1.0040 0.9591 0.9797 1.0314
PE(36:5) 0.9832 0.8708 0.9448 1.0227 1.1040 0.8496 0.9535 1.0765 0.9735 1.0557 1.0413
PE(38:1) 0.9246 1.0729 1.0918 0.9666 1.0006 0.8839 0.9055 0.8896 0.9665 1.1479 1.0190
PE(38:2) 0.7604 1.0157 0.9078 0.8128 1.0084 0.6461 0.8135 0.7518 0.4592 2.1425 0.9537
PE(38:6) 0.9497 0.9898 1.0777 1.0904 1.0708 1.0151 0.8137 0.9251 0.9928 0.9445 1.0900
Pentylbenzene 1.0487 1.0036 1.6629 0.9988 0.8677 1.1790 1.3514 1.5155 0.6183 0.4085 0.9144
PE(O-38:5) 0.9171 0.9307 0.9828 0.9698 1.0439 0.9565 0.9283 0.9470 0.9906 1.0821 1.1530
PE(P-36:2) 0.7857 1.0802 0.8752 1.0054 1.0355 0.9412 0.9506 0.9581 1.0038 1.1496 1.0881
PE(P-36:4) 0.9663 1.0126 0.9626 0.9815 1.0027 0.9542 0.9447 0.9818 1.0686 1.1644 0.8605
PE(P-38:5) 0.9380 0.9206 0.9799 0.9498 1.0405 0.9106 0.9491 0.9659 1.0065 1.1290 1.0843
PE(P-40:5) 0.8166 0.9294 0.9425 0.9418 1.0098 0.8980 0.9067 0.9551 1.0827 1.2486 1.1003
Phenolsulfonphthalein 0.5744 0.9339 0.8001 0.5661 0.6782 0.4996 0.6861 0.6835 0.6410 3.2297 0.6296
[PI(36:0) 0.8065 0.9764 1.0409 0.9827 1.0541 0.8258 0.8838 0.9061 0.9797 1.2483 1.0639
Picolinamide 1.0832 1.3908 1.2743 0.9580 1.2078 0.9565 1.1623 1.1806 0.8953 1.2641 0.8701
Pipericine 1.0481 1.2774 1.2121 0.7807 0.7119 0.3515 0.8892 2.9353 1.0699 1.6988 1.1335
Pirbuterol 0.9166 1.3748 1.0933 1.0753 1.1724 0.9113 1.0320 1.0939 0.9769 1.2958 1.1027
p-Lactophenetide 0.8980 1.3151 1.1556 1.1138 1.2010 0.8658 0.9871 0.7463 0.9501 1.3053 1.4144
Pro-Ser 1.8616 0.1052 0.2822 0.1292 0.1325 NA NA NA 2.3757 0.7156 NA
(+)-Prosopinine 0.9987 1.0380 0.7483 0.9742 1.0641 1.1371 1.0607 1.2206 0.9965 1.1177 1.0973
PS(34:0) 0.7244 0.9897 0.8382 0.8633 0.9641 0.7080 0.9127 0.8094 0.9835 1.6366 1.1582
PS(34:1) 0.8086 0.9879 1.0066 0.8995 1.0775 0.7597 0.8801 0.8694 0.9141 1.4124 1.0271
PS(36:0) 0.7198 0.9691 0.9162 0.8113 0.9704 0.7202 0.8327 0.8329 0.8580 1.7880 1.0978
PS(52:0) 0.6806 1.2066 0.6707 0.9237 0.9491 0.5730 0.9746 0.8031 1.0447 1.5913 1.1346
Pseudopelletierine 1.0488 1.5665 1.5729 0.7111 1.3180 0.7724 0.4959 1.0857 0.4046 1.7791 0.3899
psicoselysine 0.8871 1.1474 1.1295 0.9331 1.1108 0.8330 0.9209 0.9382 0.8414 1.1081 0.9561
Pyridoxal 0.9405 1.1057 1.0989 0.9724 1.1159 0.9250 0.9976 1.0351 0.7759 1.0667 0.8360
Pyridoxine 0.9904 1.2679 1.2042 0.8607 0.9865 0.7800 1.0537 1.0042 0.8089 1.1122 0.8312
(S)-1-Pyrroline-5-carboxylate 0.8829 1.1452 1.1095 1.0573 1.0319 0.9996 0.9576 1.0033 0.9331 1.1564 1.0363
S-(2-Hydroxyethyl)glutathione 0.9886 0.8804 0.8441 1.0440 0.8910 1.1019 1.1663 1.0698 1.1155 0.9669 1.0428
(S)-3-[(Cyanophenylmethyl)amino]-3-oxopropanoic acid 0.9795 1.4846 1.9183 0.6630 0.7940 0.6690 1.0502 0.3563 NA 1.0024 0.2984
S-Adenosyl-L-homocysteine 0.8303 1.1703 1.0691 0.9373 1.0903 0.7282 0.9376 0.9022 0.8390 1.1742 1.0743
S-Adenosyl-L-methionine 0.7452 0.8963 0.8640 0.9514 0.8264 0.8245 0.7048 0.9155 0.7090 2.2409 0.7669
Ser-Arg 1.0709 NA 0.1845 NA NA NA NA NA 1.1329 NA NA
SM(d32:1) 0.9065 1.1223 0.9990 0.8735 0.9169 0.8252 0.9269 0.8631 0.8950 1.4776 0.9395
SM(d33:1) 0.8882 1.0937 0.9315 0.8650 0.7848 0.8260 0.9062 0.8466 0.8743 1.7313 0.9663
SM(d34:1) 0.8442 1.1052 1.0221 0.8631 0.8990 0.8184 0.9025 0.8204 0.9025 1.7301 0.9623
SM(d34:2) 0.8448 1.1155 1.0965 0.8388 0.8701 0.7540 0.8912 0.8099 0.8703 1.6285 0.9544
SM(d35:1) 0.8091 1.1171 0.9753 0.8977 0.9281 0.8433 0.8988 0.7334 0.9217 1.5423 1.0103
SM(d36:1) 0.8681 1.0551 1.0382 0.8273 0.8931 0.8100 0.9130 0.7863 0.8462 1.6789 0.9236
SM(d36:2) 0.9036 1.1473 1.0476 0.9144 0.9800 0.8769 0.9978 0.6760 0.8809 1.3218 0.9960
SM(d38:2) 0.9742 1.0483 1.0664 0.8754 0.8700 0.8770 0.9084 0.8115 0.8828 1.4711 0.9989
SM(d40:1) 0.8681 0.8447 0.9103 0.9236 0.9088 0.8640 1.0132 0.9721 1.1121 1.3298 1.1158
SM(d40:2) 0.8890 1.0476 1.0216 0.9287 0.9322 0.8458 0.9087 0.8614 0.8672 1.4661 0.9762
SM(d41:1) 0.9774 1.0991 0.8954 0.9637 1.0217 0.9390 0.9769 0.8979 1.0193 1.0788 1.0789
SM(d41:2) 0.9002 0.9613 1.0437 0.9791 0.8963 0.8662 0.9787 0.9128 0.9357 1.4079 0.9367
SM(d42:2) 0.9890 1.0044 1.1087 0.9651 1.0240 0.9086 0.9927 0.9774 1.0185 1.0790 1.0958
SM(d44:2) 0.9002 1.1457 0.8663 1.0484 0.8761 0.8777 0.9961 0.8966 1.1305 1.1344 1.1338
sn-glycero-3-Phosphocholine 0.9542 1.3571 1.1575 1.0336 1.1876 0.7853 1.0211 1.0007 0.9920 1.4239 1.1713
[SP (16:0)] N-(hexadecanoyl)-sphing-4-enine 0.8159 0.8904 0.9110 1.0711 0.9880 0.8098 0.9803 0.9769 1.1350 1.1264 1.1877
[SP (24:0)] N-(15Z-tetracosenoyl)-sphing-4-enine 0.7695 0.8837 0.7086 1.0454 0.9128 0.8146 1.0352 0.9739 1.5329 0.9399 1.4262
[SP amino(18:0/2:0)] 2S-aminooctadecane-1,3R-diol 0.7968 0.9990 1.0249 1.0663 1.0951 0.7880 1.0426 0.9472 0.9590 1.2339 0.8512
[SP] Sphing-4-enine 1.0386 1.1246 1.0913 1.0631 1.0890 0.8640 1.0675 1.0271 1.0739 1.1797 1.1564
[ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene 0.7473 1.0923 1.0876 0.9783 1.0946 0.8014 0.8690 0.9455 0.8991 1.2518 0.9730
Stearoylcarnitine 0.8633 1.1598 1.0452 1.0829 1.0581 0.7910 0.9123 0.9465 0.9028 1.0279 1.0872
Sulfacetamide 0.7383 1.0603 0.9682 0.7565 0.9732 0.7671 0.5734 0.8421 0.7254 2.1535 0.7879
Thiamin 1.0036 1.1760 1.1073 0.9190 0.9960 0.7640 1.0313 0.9953 0.7837 1.1741 0.9055
Thr-Ala 0.8175 1.1086 0.9958 1.0825 1.0515 0.7464 0.8754 0.9671 0.8909 1.2406 0.9932
Thr-Arg 1.1541 NA NA NA NA NA NA NA 1.4438 0.6013 NA
Thr-Cys 1.0535 1.2005 0.9496 0.8625 1.1590 NA 0.7660 0.6463 1.0171 1.4387 0.5414
Thr-Pro 1.2960 1.3610 1.2497 0.1390 1.1693 0.1403 0.9648 0.1696 1.6286 1.0784 1.2146
Tributyl phosphate 1.0352 0.7672 0.8570 1.2057 0.7011 0.7482 1.4644 2.3884 0.9636 0.8957 1.0629
Triethanolamine 0.8868 1.0283 1.0241 1.1599 1.2002 0.9366 0.8107 1.0538 0.9054 0.9269 1.7935
Trimethyl-2-propenylpyrazine 1.0531 0.7770 1.0948 0.8694 1.0453 0.9535 1.0531 1.1341 1.0054 0.9114 1.0881
Trp-Cys-Gly 0.6629 1.4105 1.2862 0.8384 1.1422 0.6757 0.8599 0.9771 0.3813 1.5975 0.6759
Trp-Trp-Tyr-Tyr 0.7107 1.2918 1.0336 0.4833 0.7209 0.6255 1.0344 0.6520 0.6306 2.5791 0.4772
UDP 0.7579 1.0292 0.9009 0.8659 0.9146 0.8249 0.8938 0.8561 0.6515 2.0274 0.7483
Undecanoylcholine 1.1471 1.2580 0.9509 1.0616 1.1465 0.9607 0.9565 0.9058 1.1540 1.2932 1.0779
Val-Arg 1.3472 NA 0.1884 NA NA NA NA NA 1.6568 0.4660 NA
xi-4,5-Dihydro-2,4(5)-dimethyl-1H-imidazole 1.0640 1.0665 1.0384 0.9598 0.9962 1.0000 1.0321 1.0032 0.9412 1.0367 0.8471
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Factors:

F1Condition:Aqm treated
F2Condition:Atov treated
F3Condition:CQ treated
F4Condition:DHA treated
F5Condition:DMSO treated
F6Condition:JPC treated
F7Condition:LF treated
F8Condition:MQ treated
F9Condition:PYN treated
F10Condition:QC
F11Condition:TQ treated
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