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

(Analysis AN001951)

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

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MetaboliteF1F2F3F4F5F6F7F8F9F10F11
13-14-DihydroPGF-1a 1.0553 1.6444 1.5395 0.7008 0.6877 1.3295 1.8295 1.3074 0.4192 0.5472 0.8436
1,8-Diazacyclotetradecane-2,9-dione 0.9255 1.1186 1.1126 0.9065 1.0995 0.8912 1.0656 1.0086 0.9946 1.5142 1.0136
1-(9H-Pyrido[3,4-b]indol-1-yl)-1,4-butanediol 0.9198 1.2975 1.0185 1.0068 1.0559 0.6253 0.9436 0.8176 0.7935 1.1956 1.0266
(1R*,3R*,3^S*)-1,2,3,4-Tetrahydro-1-(2-thio-3-pyrrolidinyl)-beta-carboline-3-carboxylic acid 0.3530 1.1027 0.3330 0.2093 0.4496 0.2696 0.2884 0.2736 0.3089 4.9876 0.4792
1-thio-β-D-glucose 0.8056 1.1014 0.9505 0.8599 0.9864 0.7506 0.8522 0.8262 0.8337 1.6388 0.9796
2,7-Anhydro-alpha-N-acetylneuraminic acid 0.7940 1.1022 0.9811 0.9078 0.9996 0.7665 0.8564 0.8664 0.8329 1.5441 0.9856
2(alpha-D-Mannosyl)-D-glycerate 0.7311 0.9549 0.8030 0.8149 0.8391 0.6538 0.7989 0.7375 0.6862 2.4026 0.8452
2-Benzothiazolesulfonamide NA NA NA NA NA NA NA NA NA 1.0000 NA
2-C-Methyl-D-erythritol 4-phosphate 1.0459 1.2162 1.1995 0.7926 0.9992 0.9197 1.0920 1.0291 0.7843 1.1583 0.6717
2-Decaprenyl-3-methyl-6-methoxy-1-4-benzoquinone 0.8776 0.8525 0.7860 0.9121 0.9296 0.8427 0.9617 0.8732 1.1292 1.4113 1.2002
2-Dodecylbenzenesulfonic acid 0.9858 1.0428 1.0960 1.0057 1.1883 0.9431 1.0619 1.2526 0.9318 1.3740 1.1576
2-Hydroxy-1,3-dimethoxy-8,9-methylenedioxycoumestan 0.8651 1.2476 1.1088 0.7935 0.9949 0.6503 1.0263 0.9933 0.7734 1.3657 0.9129
2-Hydroxy-2,4-pentadienoate 1.2304 1.2508 1.2022 1.0247 1.1003 0.9785 1.2248 1.2055 1.0147 1.2030 0.9131
2-Hydroxy-6-keto-2,4-heptadienoate 0.9755 1.1535 1.0419 0.9903 1.0110 0.9550 0.9642 1.1227 0.8320 1.2287 1.0418
2-Hydroxyethanesulfonate 0.8357 1.1074 1.0486 1.0383 1.0466 0.8136 0.9022 0.9120 0.8967 1.1359 1.0916
2-Isopropylmaleate 1.0146 1.0428 1.0060 0.9533 1.0738 0.8846 1.0733 0.9689 0.9720 1.3840 1.0727
2-Methyl-4-propyl-1,3-oxathiane 0.9532 1.0198 1.0770 0.8512 1.0266 0.9499 1.0332 1.0036 0.8185 1.2858 0.8067
2-Octenedioicacid 0.9786 1.1449 1.1087 1.0347 1.1094 0.8271 1.0359 1.1484 0.9673 1.1373 0.9401
2-Oxobutanoate 1.2402 1.2731 1.2126 1.0520 1.0814 1.0429 1.2271 1.2127 1.0459 1.1105 0.9019
2-Oxoglutaramate 0.7046 0.9846 1.1177 0.8921 1.0296 0.9133 0.9446 0.9205 0.7430 2.2896 0.9730
2-Oxoglutarate 0.9949 1.4153 1.1573 0.8831 1.1205 0.7970 1.0592 0.9114 0.6847 1.7891 0.8746
3a-7b-12a-Trihydroxyoxocholanyl-Glycine 0.9255 1.2969 1.1257 0.8344 0.9243 0.7333 1.0595 1.0523 0.7481 1.3805 0.8275
3-Amino-2-oxazolidone 0.9741 1.1279 1.0772 1.0693 1.2002 0.9271 1.1191 1.1137 1.0680 1.3073 1.1108
3-beta-D-Galactosyl-sn-glycerol 0.7995 1.1391 0.9776 0.9673 1.0263 0.8473 0.8448 0.9210 0.8672 1.3426 1.0185
3-Methylbutanoic acid 1.0719 1.1215 1.1285 1.0463 1.1958 1.0214 1.1481 1.0776 1.1004 1.1677 1.1127
3-Methyldioxyindole 1.0066 1.1278 1.0071 0.9035 1.2182 0.6689 0.9256 0.9134 0.9066 1.0214 1.0220
3-Oxododecanoic acid 1.1312 1.1504 1.8939 1.1236 1.0007 1.4087 1.6663 1.6782 0.6018 0.4136 0.9590
3-Phospho-D-glycerate 0.8490 1.2432 0.9981 0.6275 0.9503 0.8945 0.9834 0.8394 0.4927 2.0463 0.5231
4-Amino-4-deoxychorismate 0.8703 1.1684 1.0750 0.9594 1.1130 0.6830 0.9271 0.8464 0.7894 1.2865 0.9360
4-Hydroxyphenylacetylglycine 0.8951 1.3322 1.0976 0.7667 1.0340 0.9824 0.9783 0.8658 0.5954 1.4240 0.7270
5-Acetyl-2,4-dimethyloxazole 0.8328 1.2031 0.9957 1.0755 1.1113 0.6621 0.8573 0.8121 0.7994 1.2594 1.0466
5-Methylthio-D-ribose 0.9708 1.0922 0.9110 0.6154 0.8707 0.3805 0.8108 0.7836 0.6240 2.1559 1.0264
5-Oxoproline 0.9358 1.3301 1.1218 0.8329 0.9943 0.7963 1.0847 0.9277 0.8229 2.1299 0.8850
7E,9E,11-Dodecatrienyl acetate 1.0843 1.0323 1.0847 0.9979 1.0482 0.9935 1.0575 1.0305 1.0277 0.9504 0.8695
9-Oxononanoic acid 0.9810 1.1099 1.0549 0.9860 1.0809 0.8635 0.9880 1.1205 0.8447 1.0856 0.9847
Ala-Asp 0.7661 1.1837 0.8769 0.7801 0.9379 0.6730 0.8506 0.7745 0.6624 2.0896 0.7686
Ala-Leu-Trp-Ser 0.3266 1.2486 0.9594 NA 1.2284 NA 0.8431 NA 0.1498 1.1278 1.1193
Ala-Met-Asp-Tyr 1.2922 1.1330 1.3230 0.9841 1.1413 1.0064 1.1501 1.2665 0.8835 0.2180 0.9550
alpha,alpha^-Diethyl-4,4^-bis(2-propynyloxy)stilbene 0.7608 1.0456 0.8990 0.9815 1.1659 0.8845 0.8605 0.9429 1.0751 1.1868 0.9362
alpha-Irone 0.9957 1.0147 0.9669 1.0696 0.9952 0.9184 1.0119 1.0803 1.0468 1.0495 1.1160
AMCC 0.8461 1.3371 1.2079 0.9715 1.0666 0.6573 0.8721 0.8486 0.7368 1.2778 0.8658
Arecoline 1.0389 1.0773 1.0712 0.9797 1.0550 0.9737 1.0341 0.9996 0.9714 1.0861 1.0143
Arg-Lys-Pro-His 1.0675 1.0287 1.1882 1.0270 0.9823 1.0135 1.0874 1.0455 0.7962 1.0298 0.9215
Asp-Gly 0.8137 1.2347 0.8910 0.5785 0.8715 0.5380 0.9340 0.6763 0.6237 2.6518 0.7196
Atovaquone NA 2.1930 NA NA NA NA NA NA NA 0.2047 NA
Benzyl sulfate 1.0842 1.1616 1.1540 0.9178 0.9662 0.9712 1.0382 1.0627 0.7936 1.0482 0.8121
Bile salt 0.9527 1.1331 1.1114 0.8242 0.9820 0.7022 1.0899 0.9177 0.7674 1.3205 0.9572
Caffeic acid 4-O-glucuronide 1.1774 1.4904 1.1601 0.8044 1.0478 0.6167 0.7327 0.7297 0.4443 1.6762 0.8406
CDP-ethanolamine 0.7442 0.9004 1.0197 0.9450 0.9603 0.6740 0.8272 0.8317 0.7867 1.8373 0.9613
Cer(d36:1) 0.7667 1.1344 0.8201 1.1176 0.9960 0.6752 1.0343 0.9728 1.3203 0.8503 1.3357
Chenodeoxyglycocholate 1.0034 1.1772 1.1043 0.8050 0.9691 0.8214 1.1220 0.9950 0.7983 1.2448 0.8756
cis-Aconitate 1.1104 1.2575 1.3370 1.0170 1.0889 0.9300 1.0845 1.1125 0.9514 1.3095 1.0030
Citrate 1.5912 1.1828 1.4010 0.7467 0.8988 1.4280 1.3843 1.2238 0.9596 1.0047 0.7601
Clavulanic acid 0.6747 1.2667 1.0707 1.2008 1.0887 0.5363 0.9730 0.9509 0.8591 1.0109 1.1680
CMP-2-aminoethylphosphonate 0.6883 0.9460 0.8158 0.7586 0.9163 0.6852 0.6982 0.7939 0.7065 2.4092 0.8101
D-4^-Phosphopantothenate 0.7814 0.9538 0.9238 0.7963 1.0039 0.6880 0.8668 0.8305 0.7722 1.9071 0.8992
D-Arabinonate 0.9056 1.2376 1.1523 1.0701 1.1636 0.9175 1.0036 1.0074 1.0285 1.4062 1.1009
Deamino-NAD+ 0.8465 1.2538 1.1156 0.8510 0.9869 0.8861 0.9393 0.9716 0.8822 1.2231 0.9065
D-Fructose 1.1367 1.2183 1.2375 1.1792 1.2116 0.9640 1.1821 1.1514 1.1202 0.8326 1.2082
D-Fructose 1,6-bisphosphate 1.1303 1.5144 1.2953 0.8172 1.1500 1.0963 1.1385 1.0470 0.5567 1.3006 0.6690
D-Galacturonate 0.5743 1.0321 0.7343 0.6136 0.7874 0.5747 0.6033 0.6350 0.5928 3.0696 0.7099
D-Gluconic acid 0.8956 1.3483 1.1463 1.0430 1.1751 0.8884 0.9729 0.9813 0.9674 1.5373 1.1089
D-Glucono-1,5-lactone 0.8544 1.2282 1.0994 1.0250 1.1276 0.8582 0.9631 0.9472 0.9447 1.6527 1.0742
D-Glucose 6-phosphate 0.8430 1.0803 1.0390 0.8963 0.9452 0.7508 0.8778 0.8988 0.7659 1.6421 0.8932
D-glycero-L-galacto-Octulose 0.9013 1.0791 0.9967 1.0390 1.0881 0.8608 0.9042 0.9640 0.9470 1.0191 1.0814
Dihydro-4,4-dimethyl-2,3-Furandione 1.5177 1.1044 1.4099 1.1258 0.6877 0.7048 0.4378 0.8858 NA 1.9544 0.2028
dihydrogeranylgeranyl-bacteriopheophytin 0.8126 0.9620 1.0656 1.0199 1.0463 0.8219 0.9076 0.8994 0.9840 1.2396 1.0166
D-Mannitol 1-phosphate 0.7074 0.8730 0.8237 0.7384 0.8533 0.6875 0.7448 0.7356 0.6603 2.6186 0.7139
Docosahexaenoicacid 1.0215 1.1266 1.0259 0.8921 1.0346 0.7658 1.1751 1.1144 0.8950 1.3039 0.6529
D-Ribose 0.8538 1.3073 1.0987 1.0493 1.1258 0.9252 0.9634 0.9973 0.9874 1.5828 1.1427
D-Ribose 5-phosphate 0.6977 0.9639 0.8766 0.7163 0.8560 0.6876 0.7014 0.7266 0.6055 2.5672 0.7794
D-Sedoheptulose 7-phosphate 0.8640 0.8612 1.0308 0.8623 0.7705 0.6144 0.8540 0.8124 0.7043 2.1772 0.8891
FA(16:0) 1.0652 1.2371 1.1131 1.1211 1.0263 1.0582 1.1049 1.1429 0.8418 1.3371 0.8053
FA(16:1) 1.0973 1.3705 1.2404 0.9722 0.9968 1.0320 1.1716 1.1974 0.8902 1.4019 0.8080
FA (17:0) 1.0234 1.3050 1.1248 1.1580 0.9605 0.9653 1.0725 1.1275 0.8911 1.4774 0.9434
[FA (18:1)] 9Z-octadecenoic acid 1.1418 1.3494 1.2134 0.9898 1.0721 0.8889 1.1890 1.1152 0.9114 1.4130 0.9232
[FA (18:3)] 9Z,12Z,15Z-octadecatrienoic acid 1.1528 1.2999 1.1757 0.8837 0.9899 0.8838 1.1812 1.0311 0.8300 1.3552 0.7645
FA (20:0) 1.0996 1.3924 1.2527 0.9851 1.0453 1.0048 1.1593 1.0912 0.8510 1.4275 0.8977
FA (20:4) 1.1314 1.1914 1.0208 0.8688 1.0289 0.8445 1.0335 1.0739 0.8835 1.1891 0.8144
[FA (22:5)] 7Z,10Z,13Z,16Z,19Z-docosapentaenoic acid 1.1080 1.1684 1.0885 0.8614 1.0008 0.8305 1.0894 0.9879 0.9216 1.1961 0.8445
[FA (6:0)] hexanal 1.0557 0.9423 1.7012 0.9890 0.8896 1.2026 1.4378 1.4532 0.6270 0.4180 0.8214
FA (8:0) octanoic acid 0.9372 0.9958 1.1179 0.9567 1.0118 0.8487 1.0403 1.1039 0.8867 1.2387 0.9511
FA (8:1) 0.9895 1.2926 1.4735 0.7919 1.0846 0.6297 0.7333 0.9502 0.5951 2.0617 0.7500
FA (8:1) octenal 1.1445 0.9933 1.6118 1.1645 0.9356 1.1208 1.3672 1.5587 0.6757 0.4737 0.9342
FA hydroxy(18:0) 1.0192 1.2394 1.1848 1.0215 1.1242 0.9361 0.9848 1.0528 0.9075 1.2745 1.0259
FA hydroxy(18:1)] 1.0755 1.1523 1.5708 0.9426 0.9583 1.3566 1.4724 1.3658 0.6756 0.7838 0.8517
FA hydroxy(7:0) 1.2435 1.0383 1.6082 1.0549 0.8931 0.7913 1.1503 1.2211 0.7385 1.2947 0.7959
FA hydroxy(8:0) hydroxy-octanoic acid 1.1567 1.0423 1.2904 0.8464 1.1190 0.7948 0.9793 1.0168 1.0443 1.2348 0.9865
FA hydroxy(9:0) hydroxy-nonanoic acid 1.0422 0.8356 1.0950 0.8564 0.6388 0.9119 1.1658 2.1045 0.6373 1.6233 0.7879
FA methyl(14:0) 1.0525 1.1957 1.1178 0.9993 0.9482 1.0060 1.0352 1.0877 0.8141 1.3421 0.8065
FA methyl(14:0) dodecanedioic acid 1.6726 0.6893 0.8242 NA 1.0069 NA 0.3758 1.6410 0.8038 1.4750 0.3782
FA methyl(15:0) tridecanedioic acid 0.9844 1.0270 1.9062 0.7510 0.7757 1.6825 1.8177 1.7166 0.4074 0.5751 0.8275
FA methyl(16:1) 1.0721 1.4261 1.2031 1.0322 1.0315 0.8888 1.1988 1.1252 0.8446 1.5060 0.8021
FA methyl(18:0) 1.0910 1.1355 1.1392 1.0683 1.0406 0.9310 1.1015 1.1140 0.9678 1.3998 0.9967
FA methyl(6:0) 0.8733 1.1513 1.1614 0.9541 1.0557 0.8187 0.9189 0.9938 0.7811 1.6337 0.9133
FA oxo(16:0) 1.0647 1.0458 1.4137 1.0769 1.0747 1.1127 1.2466 1.3134 0.7349 0.8772 0.9324
FA oxo(18:0) 1.0336 1.1210 1.1784 0.9824 1.0855 0.9206 1.1221 1.0331 0.8754 1.4397 0.9022
FA oxo(7:0) 0.9154 1.0680 1.1409 0.9427 1.0683 0.8006 0.9999 0.9667 0.9185 1.8168 0.8900
FA oxo(8:0) oxo-octanoic acid 0.9927 0.9860 1.1160 0.9593 1.0423 0.9838 1.0412 0.9187 1.0348 1.0444 1.1065
[FA trihydroxy(4:0)] 2,3,4-trihydroxy-butanoic acid 0.8875 1.2953 1.1750 1.0598 1.1880 0.9240 0.9845 1.0321 0.9596 1.4447 1.1394
Furfural diethyl acetal 1.0673 1.5872 1.6925 0.7691 1.0218 0.6063 0.6051 0.6296 0.2382 2.5897 0.2831
Galactinoldihydrate 0.6282 1.3540 0.9748 0.8486 1.0138 0.5985 0.7615 0.6910 0.7357 2.0129 0.9399
Glycerophosphoglycerol 0.8328 1.1189 0.9930 0.9664 0.9869 0.8089 0.8698 0.9102 0.8305 1.4109 1.0058
HEPES 1.1560 1.3520 1.2904 0.9037 1.0792 0.9309 1.2004 1.1149 0.9019 1.4347 0.8700
Hexanoic acid 0.8370 1.5508 1.4629 0.8063 1.2939 0.7373 0.7897 0.9018 0.4633 1.9880 0.5567
Hydroxymethylphosphonate 0.7598 1.1914 1.1119 0.9363 1.1613 0.6433 0.8364 0.8095 0.7009 1.4175 0.9653
Icosatrienoic acid 0.9984 1.1329 1.0269 0.8907 0.9601 0.8067 1.0974 0.9814 0.8433 1.2291 0.8954
Ile-Ala-Ser 1.0355 1.1671 1.0899 0.9790 1.0678 1.0594 1.0791 1.0298 0.9806 1.4417 0.9608
Ile-Lys-Gln-Tyr 1.1076 1.0738 1.0626 1.0365 1.1157 1.0354 0.7865 0.9712 1.0347 1.0634 1.0506
IMP 0.7388 0.9770 0.9331 0.8358 0.9069 0.6925 0.7667 0.8162 0.7749 2.1209 0.8238
Indole-3-acetaldehyde 0.7257 1.3037 1.0976 0.5800 1.0679 0.4888 0.6675 0.9155 NA 1.9626 0.2462
(-)-Jasmonic acid 0.8073 1.2222 1.3334 1.2480 0.8033 0.5078 0.6337 0.7446 NA 1.6227 0.0714
Kinobscurinone 0.8542 1.0968 1.1339 0.9186 1.0561 0.8436 1.0427 0.9386 0.8542 1.1622 0.9213
L-Aspartate 0.7341 1.0352 0.7856 0.6351 0.8168 0.5930 0.6845 0.6640 0.6882 3.7000 0.7604
L-Cladinose 1.0061 0.9686 1.1476 0.7761 0.7600 0.7846 1.0792 1.3475 0.6484 1.8092 0.8759
L-Histidine 1.0826 1.4237 1.3235 0.9082 1.1848 0.8623 1.0755 0.9806 0.9222 1.3627 1.0066
Linoleate 1.1758 1.3399 1.2592 0.9673 1.0777 0.9647 1.1783 1.1277 0.8944 1.3557 0.8436
L-Rhamnono-1,4-lactone 0.6752 3.1309 1.2987 2.1274 0.7920 0.4398 0.4264 0.5756 0.9047 0.5187 0.6981
LysoPE(18:0) 0.9182 1.2119 1.1695 0.8169 1.0893 0.7682 0.8270 1.0444 0.7142 1.6030 0.8021
LysoPE(18:2) 0.8120 1.1936 1.1507 0.7705 1.0734 0.7361 0.8177 1.0240 0.7090 1.7409 0.6717
LysoPE(22:4) 0.8427 1.2677 1.4112 0.7071 1.0519 0.6189 0.6860 0.8312 0.4039 2.1552 0.5590
Mannitol 1.0165 1.2192 1.1520 1.1307 1.1802 0.9869 1.0425 1.0836 1.0491 1.2362 1.1509
Margaroyl-EA 0.7344 1.0784 0.6825 1.0565 0.9589 0.6849 1.0388 0.7645 1.6475 0.9496 1.3517
mercuriphenyl acetate 0.2153 0.4930 0.2347 0.1545 0.2578 0.1557 0.2606 0.1922 0.2729 5.7939 0.1564
meso-Tartaric acid 0.9703 0.9940 1.0314 0.9766 0.9714 0.9805 0.9831 0.9970 0.9792 1.2381 0.9816
Met-Cys-Cys 0.7173 1.1533 0.8737 1.0662 1.1101 0.6380 0.7234 0.7898 0.8963 1.4000 1.2061
Met-Ser 1.1290 1.2095 1.1361 1.1170 1.1239 0.9009 1.0648 1.2667 1.0061 0.3593 0.9558
Miraxanthin-I 0.2321 0.2984 NA NA 0.1078 NA NA NA NA 1.3936 NA
Monoglyceride citrate 0.7808 1.0561 0.8690 0.6287 0.8209 0.6169 0.9645 0.7029 0.8052 2.2129 0.9000
N-Acetyl-D-fucosamine 0.7329 1.0853 0.9618 0.8870 1.0186 0.7229 0.8793 0.8031 0.8831 1.6154 0.9706
N-Acetyl-D-glucosaminate 0.8260 1.0796 0.9717 1.0319 1.0367 0.7776 0.9609 0.9172 0.8979 1.2118 1.0789
N-Acetyl-D-glucosamine 6-phosphate 0.6308 1.1690 0.8506 0.7435 0.9619 0.7139 0.7561 0.6905 0.7920 2.1453 0.8533
N-Acetyl-D-mannosaminolactone 0.7975 1.5514 1.0835 0.8005 1.2100 0.7300 0.9597 0.7850 0.7774 1.1212 0.8445
N-Carbamoyl-L-aspartate 0.1157 7.3980 0.1550 0.1041 0.1595 0.1111 0.1293 0.1144 0.0924 2.1353 0.1045
N-Nitrosoproline 0.9103 0.7855 0.9274 0.8737 0.9175 0.9999 1.1054 1.0848 1.1394 1.1606 1.0981
N-Nonanoylglycine 1.0474 1.0735 1.0099 0.9923 0.9953 0.8125 1.0010 1.0980 0.9346 1.2790 1.0571
N-Succinyl-L-glutamate 0.7452 0.9995 1.0556 0.7938 1.0022 0.9377 0.9009 0.9881 0.7338 1.6647 0.8260
N-Undecylbenzenesulfonic acid 0.9843 1.1162 1.1429 1.0132 1.2130 0.8782 1.0237 1.2284 0.8956 1.3922 1.0839
Octadecanoic acid 1.0252 1.2521 1.1416 1.1140 1.0708 0.9921 1.1159 1.1036 0.8918 1.4178 0.9095
Orotidine 0.8592 1.0936 1.0148 0.9738 1.0651 0.8090 0.8875 0.9309 0.8623 1.2250 1.0525
Orthophosphate 1.0922 1.0785 1.1305 1.0148 1.0786 1.0945 1.0828 1.1090 0.9705 1.2378 0.9608
PA(34:1) 0.8119 0.9157 0.9677 1.0029 1.0693 0.7015 0.8276 0.9128 0.9211 1.4446 1.0543
PA(34:2) 0.7886 0.9769 0.9907 1.0281 1.0374 0.7200 0.8461 0.8749 0.9146 1.4223 1.0598
PA(36:2) 0.7515 0.9101 0.9963 1.0170 1.0611 0.7020 0.8187 0.8754 0.9530 1.4281 1.1212
PA(36:3) 0.7836 0.9690 0.9813 0.9736 1.1122 0.7507 0.7436 0.8862 0.9783 1.4018 1.0437
PA(36:4) 0.8508 1.0141 1.0008 1.1129 1.1686 0.8766 0.9231 1.0018 1.0555 1.4235 1.1693
PA(O-38:5) 0.7683 0.9345 0.9691 1.0429 1.0214 0.7629 0.8331 0.9501 0.9232 1.4024 1.1029
para-Trifluoromethylphenol NA NA NA NA NA NA NA NA NA 0.4023 1.8965
[PC acetyl(18:2)] 1-(9Z,12Z-octadecadienoyl)-2-acetyl-sn-glycero-3-phosphocholine 0.8749 1.1595 1.1700 0.7963 0.8917 0.5345 0.6156 0.7096 NA 1.3813 NA
P-DPD 0.8626 1.1230 1.0491 1.0261 1.0293 0.7720 0.8938 0.9700 0.8602 1.2095 1.0133
PE(30:4) 2.3194 1.1123 0.9545 0.8673 0.8626 1.1093 1.1918 0.7327 1.2285 0.6993 1.1242
PE(34:2) 0.9929 1.0953 0.9663 0.9230 1.1032 0.9266 0.9771 1.0207 1.0317 0.8367 1.1174
PE(36:1) 0.9593 0.8815 0.9452 1.0147 1.0329 0.9929 0.9405 1.0810 1.0311 1.0704 1.0092
PE(36:2) 1.0210 0.9809 1.0667 1.0012 1.0146 1.0231 0.9897 0.9984 1.0438 0.8896 1.0207
PE(38:4) 1.0133 0.9261 0.9943 1.0196 1.0051 0.9922 1.0054 1.0245 1.0671 1.1008 1.0486
PE(38:5) 0.9711 0.9902 0.9938 0.9958 1.0227 0.9506 0.9899 0.9873 1.0553 1.1120 1.0915
[PG (16:0)] 1-hexadecanoyl-sn-glycero-3-phospho-(1^-sn-glycerol) 0.8780 1.0063 0.9967 0.9150 0.9914 0.9172 0.8365 0.9257 0.7539 1.5157 0.9729
[PG (18:0)] 1-octadecanoyl-sn-glycero-3-phospho-(1^-sn-glycerol) 0.8350 1.0379 0.9832 0.8901 0.9908 0.8332 0.8692 0.9527 0.8075 1.5190 0.9753
[PG (18:1)] 1-(9E-octadecenoyl)-sn-glycero-3-phospho-(1^-sn-glycerol) 0.8918 1.0045 1.0705 0.9935 1.0392 0.9078 0.8950 1.0058 0.9119 1.4488 1.0289
PG(34:1) 0.8368 1.0577 1.0099 0.8796 1.0131 0.7185 0.8657 0.8856 0.8450 1.4816 1.0571
PG(36:1) 0.8232 1.0081 1.0239 0.8956 1.0100 0.7146 0.8645 0.8984 0.8768 1.4950 1.0381
PG(36:2) 0.8071 1.0306 0.9937 0.9048 1.0137 0.7340 0.8615 0.9382 0.8827 1.4573 1.0555
PG(38:5) 0.8248 1.0656 0.9978 0.9524 0.9820 0.8085 0.8586 0.9974 0.9524 1.2864 1.0958
PG(40:5) 0.8969 1.0244 0.9126 0.9266 1.0060 0.7808 0.8521 0.9815 0.9174 1.4187 1.0099
Phosphoenolpyruvate 0.8247 1.3460 0.9801 0.7820 1.0351 0.9140 0.9247 0.8912 0.6684 1.5715 0.7014
Phytuberin 1.1521 0.8538 1.6247 0.9783 0.8808 0.9496 0.9648 1.1818 0.8953 1.4145 0.8893
PI(36:2) 0.8773 0.8693 1.0044 1.0507 1.0636 0.8519 0.8811 0.9231 0.8744 1.3262 1.0110
PI(36:3) 1.0026 0.8872 1.0485 1.1810 1.0334 0.8942 0.9604 1.0290 0.9790 0.9338 1.0398
PI(36:4) 0.9833 0.9456 1.1394 1.1739 1.0710 0.9056 0.9334 1.0568 1.0187 0.8155 0.9865
PI(40:5) 0.8745 0.8706 0.9270 1.1111 1.0303 0.8687 0.8886 1.0179 0.9368 1.2350 1.0709
[PR] Abietic acid 1.0133 1.1647 0.9552 0.8473 0.8608 1.1705 1.0134 0.9112 0.8038 1.1567 1.3913
PS(18:0) 0.9698 1.3769 1.3185 0.7391 1.0642 0.7717 0.8450 0.8437 0.5977 1.7126 0.6452
[PS(18:1)] 1-(9Z-octadecenoyl)-sn-glycero-3-phosphoserine 0.9164 1.1607 1.1320 0.7282 1.0559 0.8990 0.8760 0.8908 0.8085 1.3756 0.9687
PS(36:1) 0.8600 0.9063 1.0467 0.9541 1.0491 0.7847 0.8731 0.9154 0.9406 1.3599 1.0184
PS(36:2) 0.8453 0.9784 1.0663 0.9712 1.0442 0.7983 0.8828 0.8596 0.8824 1.3845 0.9759
PS(36:3) 0.8467 0.9716 0.9363 0.9912 1.0790 0.7772 0.9239 0.8479 0.9172 1.3608 1.0148
PS(36:4) 0.9097 1.0160 1.0116 1.0068 1.0319 0.7922 0.9436 0.9210 0.9117 1.2130 1.0403
PS(38:4) 0.8568 0.9451 0.9987 0.9950 1.0182 0.8291 0.8964 0.9119 0.9312 1.3141 1.0680
PS(38:5) 0.8914 0.9610 0.9992 1.0646 1.0061 0.8489 0.9211 0.9140 0.9266 1.2539 1.0224
PS(38:6) 0.8964 0.9358 1.0236 0.9365 1.0637 0.7868 0.9729 0.9016 0.9021 1.2258 1.1161
PS(40:4) 0.8461 0.9147 1.0063 0.9752 1.0468 0.8176 0.8744 0.9311 0.9462 1.2989 1.0953
PS(40:5) 0.8444 0.9357 1.0100 0.9890 1.0268 0.8097 0.9143 0.9193 0.9537 1.2977 1.0628
Pyrophosphate 0.3454 0.4205 0.3526 0.2593 0.3268 0.3567 0.3224 0.3236 0.2441 5.6506 0.2477
Pyruvate 1.0736 1.0632 1.2315 1.0259 1.0433 0.9650 0.9964 1.0808 0.8325 1.0684 1.0554
Quinate 0.9529 1.2652 1.1639 1.1100 1.1738 0.9137 1.0036 1.0151 0.9645 1.3781 1.1713
(R)-2-Hydroxyglutarate 0.7546 1.0406 0.8875 0.8680 0.9279 0.7199 0.7792 0.8107 0.7498 3.0013 0.8658
(S)-2-Acetolactate 1.1845 1.2996 1.1570 1.0097 1.0731 0.9832 1.2164 1.1475 1.0182 1.1898 0.8910
(S)-3-Methyl-2-oxopentanoic acid 0.9574 1.1760 1.2168 0.8372 1.1771 0.7963 0.8324 0.8602 0.6181 1.8826 0.7470
Sambutoxin 0.8932 1.1903 1.1708 0.8054 1.0815 0.7000 0.7904 0.9168 0.7170 1.6594 0.7535
(S)-Dihydroorotate 0.1876 7.1223 0.2598 0.2179 0.2274 0.1715 0.2109 0.2089 0.2246 1.7441 0.2275
Secobarbital 0.9783 1.0328 0.9773 1.0104 1.0155 1.0095 1.0444 0.9773 0.9971 1.2797 1.0350
(S)-Lactate 1.0709 1.3098 1.3084 1.0145 1.1641 0.8624 1.0414 1.0503 0.8857 1.3608 1.1031
(S)-Malate 1.0226 1.3619 1.1522 0.8157 1.1969 0.8728 1.1064 0.9399 0.8879 1.6481 0.9434
sn-glycero-3-Phosphoethanolamine 0.7858 1.0549 0.8384 0.9046 0.9723 0.6559 0.8001 0.7631 0.8343 2.0610 0.9117
sn-Glycerol 3-phosphate 0.6520 1.2926 0.9472 0.7126 0.9269 0.7151 0.7736 0.7698 0.6161 2.4398 0.8490
sodium dodecyl sulfate 0.9803 0.9080 1.5068 0.8829 1.0134 1.4426 0.7779 1.0703 0.7763 1.0933 1.0649
[SP] Sphinganine-1-phosphate 0.7706 1.0358 0.9472 1.0201 1.0327 0.8363 0.9023 0.9594 0.8707 1.3440 1.0335
Sulfate 0.3592 0.4141 0.3448 0.3279 0.3628 0.4012 0.3530 0.3649 0.3336 5.1651 0.3430
Taurine 0.7651 0.9994 0.8515 0.9113 0.9184 0.7621 0.8229 0.8667 0.7785 1.9949 1.0439
Tetradecanoic acid 1.0240 1.0213 1.0724 1.0129 1.0486 0.9876 1.0377 1.0392 1.0084 1.0144 1.0185
tetrahydrogeranylgeranyl-bacteriopheophytin 0.8172 0.9242 1.0145 1.0084 1.0510 0.8364 0.9038 0.9461 0.9185 1.2849 1.0598
Thr-Ser 2.3818 0.4925 0.5911 0.1817 0.4485 NA 0.3327 NA 2.8995 1.0034 0.4671
Thr-Ser-Ser 0.2025 0.5918 NA NA 0.2342 NA NA NA NA 1.7705 0.4653
Thymine 0.8260 0.9083 1.3522 0.5238 1.1895 0.7089 0.8125 0.6268 0.6782 1.6631 0.9521
Tiotropium 0.7479 1.1736 0.8735 0.6656 0.8484 0.8648 0.9569 0.7668 0.8788 2.0672 0.9112
Trifluoroacetic acid 1.1598 1.1130 1.1842 1.0917 1.1220 1.1646 1.1628 1.2396 1.1129 0.7811 1.0736
Tyr-Tyr 0.8758 1.0158 0.8775 1.1882 1.0444 0.6306 0.9875 0.7987 1.1515 0.8497 1.4796
UDP-glucose 0.6610 0.9192 0.7963 0.6837 0.8362 0.6572 0.7046 0.7481 0.5944 2.8286 0.6308
UDP-N-acetyl-D-glucosamine 0.7224 0.9140 0.8499 0.7647 0.8766 0.6585 0.7180 0.7819 0.6903 2.4608 0.7851
Uracil 1.0060 1.1132 1.0436 0.9298 1.1896 0.9359 1.0666 1.0738 1.0121 1.3109 0.9964
Ursodiol 0.9782 1.1307 1.2275 0.9053 1.2348 0.7653 1.1191 0.9835 1.0191 1.3424 0.9903
xi-8-Hydroxyhexadecanedioic acid 1.5320 1.2068 1.2774 0.6494 0.6806 1.6940 1.0594 0.9059 0.7306 0.4534 1.1461
Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

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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