Data for Longitudinal Metabolomics of the Human Microbiome in Inflammatory Bowel Disease (Study ST000923)

(Analysis AN001516)

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

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MetaboliteF1F2F3F4F5F6
5alpha-cholestan-3beta-ol 1.0691 0.7798 1.3145 1.1080 0.9108 0.9761
beta-sitosterol 1.6117 0.9380 0.7882 0.6142 0.8847 0.7785
C14:0 CE 1.0764 0.9523 1.1801 0.6562 0.6043 1.8911
C14:0 LPC 0.6884 1.4930 0.4635 0.5568 1.1152 1.3125
C16:0 CE 1.1678 1.2074 0.8539 0.6966 0.7414 1.0773
C16:0 CE [M+NH4]+ 1.2051 1.1552 0.7799 0.7493 0.7474 1.1004
C16:0 Ceramide (d18:1) 1.2008 1.2360 0.9119 0.5859 0.8040 0.9081
C16:0 LPC 0.9385 1.3673 0.5127 0.5403 0.9619 1.3561
C16:0 LPE 1.0249 1.1671 0.8187 0.9066 0.9340 0.9256
C16:0 SM 1.1905 1.1079 0.3132 0.3047 1.2086 1.6599
C16:1 CE 1.1727 1.2146 0.5722 0.3205 1.0158 1.3878
C16:1 CE [M+NH4]+ 1.2803 1.1428 0.4696 0.2465 1.0630 1.4391
C16:1 LPC 0.7636 1.4834 0.4657 0.6488 0.8261 1.5529
C16:1 LPE 0.9734 1.2565 0.6490 0.9599 0.8257 1.0582
C16:1 MAG 0.9642 1.0044 1.0615 1.1804 1.0090 0.7310
C16:1 MAG [M+NH4]+ 0.8887 0.9860 1.1712 1.1391 1.1303 0.6230
C16:1 SM 1.3563 1.0344 0.1842 0.1945 1.1846 1.8575
C18:0 CE 1.0456 0.9561 1.1748 1.1250 0.8025 0.9977
C18:0 CE [M+NH4]+ 1.1172 0.9080 1.1973 1.1518 0.7842 0.9450
C18:0 LPC 0.8872 1.4139 0.3068 0.3420 1.0723 1.6528
C18:0 LPE 0.7513 1.4943 0.2144 0.2390 1.2175 1.7153
C18:0 MAG 1.1738 1.0459 0.7377 0.7660 0.9107 1.2705
C18:0 MAG [M+NH4]+ 1.3102 1.0077 0.6535 0.7520 0.8715 1.2628
C18:0 SM 1.0572 1.4998 0.5560 0.4059 0.7819 1.1528
C18:1 CE 1.1939 1.2631 0.8034 0.5276 0.8188 1.0257
C18:1 CE [M+NH4]+ 1.2776 1.2317 0.7734 0.4772 0.8192 1.0349
C18:1 LPC 1.1868 1.1852 0.5281 0.7130 0.9286 1.1307
C18:1 LPE 1.1562 1.1392 0.6573 0.6870 0.9106 1.2465
C18:1 SM 1.1457 1.2149 0.5655 0.2858 0.9470 1.5943
C18:2 CE 1.2857 1.2818 0.5328 0.3213 0.9067 1.2131
C18:2 CE [M+NH4]+ 1.3627 1.2626 0.4580 0.2657 0.9193 1.2396
C18:2 LPC 0.9948 1.3927 0.7603 1.0057 0.7443 0.6166
C18:2 LPE 1.1208 1.3444 0.7484 0.8217 0.7912 0.6574
C18:3 CE 1.2214 1.3704 0.6456 0.3073 0.8877 0.9976
C18:3 CE [M+NH4]+ 1.2689 1.3354 0.6102 0.3313 0.9264 0.9128
C20:0 LPE 0.8978 1.0358 0.9012 0.8932 1.1036 1.2012
C20:0 SM 1.3308 1.1257 0.2838 0.3686 1.0811 1.3069
C20:3 CE 1.1014 1.0190 0.8894 0.7875 1.1791 0.8299
C20:3 CE [M+NH4]+ 1.1691 0.9611 0.8428 0.7402 1.2654 0.8045
C20:3 LPC 1.0206 1.2554 0.5320 0.5735 0.9708 1.4091
C20:4 CE 1.3292 1.2423 0.3951 0.2481 0.9893 1.3363
C20:4 CE [M+NH4]+ 1.4080 1.2121 0.3786 0.2468 0.9715 1.2726
C20:4 LPC 0.9090 1.5008 0.2736 0.3466 0.8884 1.3288
C20:4 LPE 0.9103 1.2830 0.9680 0.5229 0.8957 0.8910
C20:5 CE 0.9403 0.7791 0.1538 0.3935 2.2673 1.1349
C20:5 CE [M+NH4]+ 0.8987 0.6974 0.2923 0.5951 2.2587 1.1233
C20:5 LPC 1.0221 1.3711 0.7526 0.9333 0.7804 0.6639
C22:0 Ceramide (d18:1) 1.1800 1.2227 0.9978 0.5635 0.8794 0.7912
C22:0 LPE 0.8630 1.5309 0.2990 0.3618 1.0549 1.2959
C22:0 SM 1.2603 1.1582 0.3388 0.3642 1.1005 1.4066
C22:1 MAG 0.5874 1.2483 0.7907 1.6607 0.3705 1.5757
C22:1 MAG [M+NH4]+ 0.4750 1.0586 0.4528 2.1949 0.4134 1.6797
C22:1 SM 1.4953 0.9322 0.2060 0.3397 1.1826 1.5547
C22:4 CE 0.9452 1.5304 0.6586 0.3257 0.7518 1.2481
C22:4 CE [M+NH4]+ 0.9896 1.4501 0.6663 0.2837 0.7332 1.2763
C22:5 CE 0.9880 1.2708 0.5053 0.4152 1.1813 1.1663
C22:5 CE [M+NH4]+ 1.1175 1.2555 0.5627 0.4706 1.0366 1.1095
C22:6 CE 1.0644 0.9747 0.3708 0.6425 1.3958 1.4683
C22:6 CE [M+NH4]+ 1.0821 0.9690 0.3829 0.7075 1.3248 1.4675
C22:6 LPC 0.5749 0.6409 0.1053 0.3702 3.2282 0.3863
C24:0 Ceramide (d18:1) 1.2002 1.2648 0.7942 0.5183 0.8861 0.9126
C24:0 SM 1.1264 1.1263 0.3285 0.3232 1.1797 1.6453
C24:1 Ceramide (d18:1) 1.4084 1.2914 0.4900 0.4098 0.8192 0.9889
C24:1 SM 1.3274 1.0519 0.1643 0.1852 1.2286 1.7139
C2 Ceramide (d18:1) 0.9808 1.2220 0.9202 1.6409 0.4076 0.6461
C30:0 DAG 1.4802 0.4529 0.3654 0.3198 1.2159 2.8334
C30:0 PC 1.0930 1.1936 0.2895 0.3455 1.2917 1.4850
C32:0 DAG 1.3521 0.7223 0.4800 0.6562 1.1846 1.7633
C32:0 PC 1.1427 1.1647 0.1273 0.1204 1.4929 1.5559
C32:0 PE 0.9740 1.2425 0.8734 0.7243 0.8625 1.1316
C32:1 DAG 1.0899 0.8965 0.6714 0.5804 1.5945 0.9990
C32:1 DAG [M+NH4]+ 1.2182 0.7866 0.6491 0.6334 1.5977 0.9641
C32:1 PC 1.2233 1.4925 0.0748 0.1383 1.0473 1.3373
C32:2 DAG 1.1156 0.9042 0.7437 0.6719 1.4843 0.9135
C32:2 DAG [M+NH4]+ 1.0602 0.8638 0.8395 0.6210 1.4651 1.1267
C34:0 DAG 1.4892 0.6850 0.5950 0.6996 1.2278 1.3010
C34:0 PC 0.9388 1.0540 0.0858 0.1819 1.8344 1.4836
C34:0 PE 0.6687 0.6768 0.7462 1.7520 1.5557 0.9318
C34:1 DAG 1.3654 0.7165 0.6359 0.8279 1.3380 1.0657
C34:1 DAG [M+NH4]+ 1.4394 0.7040 0.4130 1.0507 1.3634 0.8441
C34:1 PC 1.2787 1.3965 0.1801 0.2837 1.1243 0.9665
C34:1 PC plasmalogen 1.0890 1.1376 0.1397 0.1427 1.4799 1.7463
C34:2 DAG 1.3728 0.7299 0.7435 0.7949 1.2841 1.0275
C34:2 DAG [M+NH4]+ 1.4516 0.7109 0.5868 0.7700 1.3297 1.0436
C34:2 PC 1.7216 1.3199 0.2448 0.2756 0.7837 0.7458
C34:2 PC plasmalogen 1.0978 1.2840 0.2704 0.4511 1.1797 1.2757
C34:3 DAG 1.4181 0.7209 0.6118 0.6405 1.4463 1.0261
C34:3 DAG [M+NH4]+ 1.4785 0.7404 0.4942 0.5542 1.5106 0.9966
C34:3 PC 2.4756 0.9720 0.3170 0.2087 0.4276 0.3372
C34:4 PC plasmalogen 0.1883 0.9031 0.8029 0.0146 3.6910 0.2416
C36:0 DAG 1.3208 0.8405 0.7854 0.7735 1.0801 1.1677
C36:0 DAG [M+NH4]+ 1.7114 0.7095 0.7287 0.7208 0.9465 1.0558
C36:1 DAG 1.3178 0.6213 0.6009 0.9630 1.4614 1.0770
C36:1 DAG [M+NH4]+ 1.3517 0.5220 0.4380 1.5150 1.4420 0.7556
C36:1 PC 1.1311 1.3259 0.1099 0.2538 1.4670 1.0234
C36:1 PC plasmalogen 0.9541 1.1851 0.0641 0.0553 1.5851 1.7490
C36:2 DAG 1.3725 0.6841 0.6931 0.8165 1.3036 1.1520
C36:2 DAG [M+NH4]+ 1.5638 0.6145 0.3959 1.0238 1.2236 1.1272
C36:2 PC 1.6065 1.1063 0.1457 0.4343 1.2259 0.7398
C36:2 PC plasmalogen 1.1124 1.2380 0.0486 0.0852 1.4006 1.5024
C36:3 DAG 1.3523 0.7365 0.6907 0.8206 1.2684 1.1069
C36:3 DAG [M+NH4]+ 1.5063 0.6650 0.4463 0.8727 1.2491 1.2155
C36:3 PC 1.7387 1.2364 0.2599 0.4714 0.7859 0.6880
C36:4 DAG 1.2827 0.7267 0.8073 0.8127 1.3173 1.0779
C36:4 DAG [M+NH4]+ 1.3487 0.6516 0.7335 0.7177 1.4118 1.1956
C36:4 PC-A 1.8544 1.2641 0.5068 0.4895 0.5512 0.4629
C36:4 PC-B 1.8382 1.3193 0.2332 0.2535 0.6334 0.9252
C36:4 PC plasmalogen 1.0454 1.2132 0.1250 0.1258 1.3570 1.7484
C36:5 PC plasmalogen 0.9513 1.5070 0.1178 0.1497 1.0580 1.6917
C38:2 PC 1.0419 1.1146 0.2300 0.3198 1.5146 1.3014
C38:3 PC 1.1282 1.4072 0.0194 0.0343 0.8148 1.2373
C38:4 DAG [M+NH4]+ 1.1411 0.7775 0.1840 0.1749 2.0210 1.6356
C38:4 PC 1.6952 1.2161 0.0447 0.0729 0.6321 0.8632
C38:4 PC plasmalogen 0.7991 1.2153 0.0151 0.0601 1.3318 2.0961
C38:5 DAG 0.9461 0.9692 0.1883 0.1827 1.8255 1.7608
C38:5 DAG [M+NH4]+ 1.0777 0.8165 0.1374 0.2456 1.8471 1.7727
C38:6 PC 1.1844 1.7969 0.1624 0.0603 0.5603 0.6755
C42:0 TAG 0.8239 0.4816 0.3927 0.4820 1.3404 3.6605
C42:0 TAG [M+NH4]+ 0.6564 0.1653 0.0800 0.2157 1.7088 4.9246
C44:0 TAG 0.7833 0.2282 0.2536 0.3802 1.3979 4.5193
C44:0 TAG [M+NH4]+ 0.6090 0.1244 0.0618 0.2471 1.5850 5.2178
C44:1 TAG 0.9868 1.0071 0.9838 0.7162 1.0993 1.2405
C44:1 TAG [M+NH4]+ 1.0011 1.1873 0.5383 0.6177 1.0852 1.3693
C44:2 TAG 1.1500 0.9467 0.6838 0.3802 1.5582 1.0607
C44:2 TAG [M+NH4]+ 1.1547 1.0896 0.5279 0.3621 1.5591 0.8091
C45:0 TAG 0.9927 0.6326 0.9205 0.4253 1.1086 2.7783
C46:0 TAG 0.7761 0.2381 0.2060 0.2452 1.4923 4.6939
C46:0 TAG [M+NH4]+ 0.7418 0.1171 0.0712 0.1603 1.7563 5.0213
C46:1 TAG 0.9393 1.0138 1.0043 0.6822 1.1381 1.1769
C46:1 TAG [M+NH4]+ 1.0088 1.1624 0.5291 0.5899 1.1800 1.2753
C46:2 TAG 0.9401 1.1850 0.7529 0.4063 1.2504 1.1794
C46:2 TAG [M+NH4]+ 0.9204 1.2656 0.5906 0.3356 1.3378 1.1028
C46:3 TAG 0.9699 1.5896 0.3663 0.1943 1.2404 1.0479
C46:3 TAG [M+NH4]+ 0.9508 1.3725 0.5204 0.3535 1.2092 0.9698
C48:0 TAG 1.2178 0.6964 0.3139 0.3762 1.3071 2.4892
C48:0 TAG [M+NH4]+ 1.2542 0.5628 0.1842 0.2525 1.3517 3.0372
C48:1 TAG 0.7615 0.8282 0.9805 0.5974 1.7225 1.2506
C48:1 TAG [M+NH4]+ 0.9970 0.6302 0.4644 0.4077 2.2206 1.3436
C48:2 TAG 0.9377 0.9217 0.9909 0.4889 1.4296 1.2274
C48:2 TAG [M+NH4]+ 1.2725 0.7478 0.5031 0.3144 1.7876 1.2303
C48:3 TAG 0.7173 1.1247 0.9938 0.3463 1.2339 1.5407
C48:3 TAG [M+NH4]+ 0.7938 1.1498 0.6731 0.2730 1.3570 1.5595
C48:4 TAG 0.7662 1.5226 0.9035 0.2884 1.0678 1.0763
C48:4 TAG [M+NH4]+ 0.9056 1.2112 0.5964 0.2776 1.4463 1.0253
C49:1 TAG [M+NH4]+ 0.9962 0.2071 0.1778 0.0913 3.0344 1.8200
C50:0 TAG 1.0260 0.8767 0.4711 0.4216 1.2546 2.2537
C50:0 TAG [M+NH4]+ 1.1615 0.6879 0.4144 0.3792 1.3813 2.3942
C50:1 TAG 1.0315 0.8546 0.9041 0.7116 1.3340 1.2642
C50:1 TAG [M+NH4]+ 1.2222 0.6423 0.6606 0.4635 1.8695 1.1300
C50:2 TAG 1.0685 0.8090 0.6819 0.7429 1.4268 1.3620
C50:2 TAG [M+NH4]+ 1.5253 0.5538 0.3483 0.5186 1.7964 1.1132
C50:3 TAG 1.0749 0.7327 0.9805 0.5268 1.4849 1.4087
C50:3 TAG [M+NH4]+ 1.2608 0.6450 0.4948 0.4645 1.8623 1.2262
C50:4 TAG 1.1782 0.7453 0.4431 0.5747 1.5970 1.3604
C50:4 TAG [M+NH4]+ 1.3559 0.6622 0.2311 0.6210 1.9766 0.9721
C50:5 TAG 0.8402 0.8476 0.3635 0.7206 1.6994 1.1966
C50:5 TAG [M+NH4]+ 1.1509 0.7355 0.1209 2.1639 0.9627 1.0393
C51:0 TAG 1.0047 0.7746 0.3838 0.2814 2.1502 1.4919
C51:0 TAG [M+NH4]+ 0.8872 1.0237 0.8585 0.8741 1.1670 1.2229
C51:1 TAG 0.8054 0.4261 0.4150 0.3369 2.6911 1.4848
C51:1 TAG [M+NH4]+ 0.8678 0.5526 0.6449 0.4207 2.4981 1.1336
C51:2 TAG 0.9289 0.7034 1.0011 0.6481 1.7006 1.2130
C51:2 TAG [M+NH4]+ 1.2304 0.5234 0.7308 0.4499 2.0128 1.1351
C51:3 TAG 1.1223 0.6920 0.7893 0.6579 1.5617 1.3975
C51:3 TAG [M+NH4]+ 1.3344 0.5209 0.3364 0.4647 1.9603 1.4221
C52:0 TAG 1.0121 1.0395 0.7440 0.5925 1.1426 1.4676
C52:0 TAG [M+NH4]+ 1.1545 0.9436 0.7670 0.5811 1.1367 1.4218
C52:1 TAG 1.0700 0.6279 0.7785 0.5788 1.7775 1.3705
C52:1 TAG [M+NH4]+ 1.1264 0.4130 0.6338 0.3938 2.4483 1.0997
C52:2 TAG 1.1077 0.7333 0.8010 0.6708 1.4214 1.4621
C52:2 TAG [M+NH4]+ 1.3255 0.5486 0.8534 0.3954 1.7837 1.1913
C52:3 TAG 1.1056 0.7612 0.7245 0.7194 1.3823 1.4775
C52:3 TAG [M+NH4]+ 1.3779 0.5807 0.4265 0.5416 1.7910 1.2630
C52:4 TAG 1.0327 0.7842 0.7871 0.8858 1.3683 1.2951
C52:4 TAG [M+NH4]+ 1.2943 0.5424 0.2979 0.8756 1.8548 1.1303
C52:5 TAG 1.1278 0.6972 0.4971 0.8980 1.5426 1.3567
C52:5 TAG [M+NH4]+ 1.2266 0.5394 0.2297 1.5594 1.6179 0.8393
C52:6 TAG 1.1968 0.7861 0.4215 1.0617 1.2667 1.1947
C52:6 TAG [M+NH4]+ 1.7449 0.6480 0.1895 0.8515 1.4294 0.7844
C52:7 TAG 1.7011 0.5629 0.2203 1.6488 0.8497 0.8484
C53:2 TAG [M+NH4]+ 1.0621 0.4741 1.4992 0.3363 1.9673 0.9948
C53:3 TAG 1.2052 0.5791 1.3180 0.5488 1.3494 1.3843
C53:3 TAG [M+NH4]+ 1.3279 0.4838 1.0869 0.3874 1.7770 1.1234
C54:1 TAG 1.0687 0.5566 0.9523 0.5070 1.8282 1.3852
C54:2 TAG 1.2225 0.6007 0.9181 0.5685 1.4990 1.4560
C54:2 TAG [M+NH4]+ 1.2413 0.4725 1.0326 0.3845 1.9077 1.1822
C54:3 TAG 1.1518 0.6747 0.8201 0.6662 1.4046 1.5454
C54:3 TAG [M+NH4]+ 1.3204 0.5099 0.9783 0.4236 1.6614 1.3440
C54:4 TAG 1.0823 0.7509 0.7551 0.7350 1.3562 1.5466
C54:4 TAG [M+NH4]+ 1.2564 0.6075 0.5100 0.5674 1.7306 1.4277
C54:5 TAG 1.0694 0.7610 0.6770 0.7453 1.4214 1.5077
C54:5 TAG [M+NH4]+ 1.2260 0.6027 0.3717 0.6773 1.8115 1.3735
C54:6 TAG 0.9941 0.7535 0.6192 0.8132 1.5571 1.4285
C54:6 TAG [M+NH4]+ 1.1136 0.5439 0.3105 1.0341 1.9583 1.1073
C55:2 TAG 1.2668 0.4618 1.4313 0.4299 1.6709 0.9574
C55:3 TAG 1.1510 0.5132 2.1058 0.4629 1.3000 1.0563
C56:1 TAG 1.0737 0.5637 1.5275 0.2982 2.0271 0.6307
C56:1 TAG [M+NH4]+ 0.7601 0.3786 1.0834 0.1701 2.5035 0.3026
C56:2 TAG 1.1549 0.7083 1.3246 0.5236 1.4929 0.9043
C56:2 TAG [M+NH4]+ 0.8607 0.4502 1.4507 0.1608 2.6643 0.3965
C56:3 TAG 1.2019 0.6907 1.1323 0.4875 1.6036 0.9282
C56:3 TAG [M+NH4]+ 1.0419 0.4168 1.2888 0.2458 2.5741 0.5336
C56:4 TAG 1.2136 0.8081 0.5801 0.7076 1.4990 1.0862
C56:4 TAG [M+NH4]+ 1.2935 0.5269 0.4730 0.4324 2.3234 0.7626
C56:6 TAG 1.2287 0.7284 0.5489 1.0140 1.3883 1.0953
C56:6 TAG [M+NH4]+ 1.2272 0.6020 0.3039 1.3977 1.5222 0.9257
C56:7 TAG 0.9455 0.8984 0.0230 0.1075 1.6998 2.5134
C58:10 TAG 0.1111 0.1615 0.0033 0.0333 5.5399 0.4866
cholesterol 1.2291 1.1388 0.8537 0.6252 0.9328 0.9082
linoleoylethanolamide 0.8440 1.4867 1.4420 0.5113 0.5318 0.9501
palmithoylethanolamide 0.9781 1.2795 1.2510 0.6363 0.8243 0.7771
piperine 1.0107 0.8684 1.0460 0.8709 0.8752 1.7076
sphingosine 0.9848 1.3936 0.9704 0.6656 0.8175 0.7342
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Factors:

F1Diagnosis:CD | sex:Female
F2Diagnosis:CD | sex:Male
F3Diagnosis:nonIBD | sex:Female
F4Diagnosis:nonIBD | sex:Male
F5Diagnosis:UC | sex:Female
F6Diagnosis:UC | sex:Male
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