Data for (Study ST003799)
(Analysis AN006246)Values for each metabolite have been scaled by dividing by the mean across all factors Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study| Metabolite | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 | F10 | F11 | F12 | F13 | F14 | F15 | F16 | F17 | F18 | F19 | F20 | F21 | F22 | F23 | F24 | F25 | F26 | F27 | F28 | F29 | F30 | F31 | F32 | F33 | F34 | F35 | F36 | F37 | F38 | F39 | F40 | F41 | F42 | F43 | F44 | F45 | F46 | F47 | F48 | F49 | F50 | F51 | F52 | F53 | F54 | F55 | F56 | F57 | F58 | F59 | F60 | F61 | F62 | F63 | F64 | F65 | F66 | F67 | F68 | F69 | F70 | F71 | F72 | F73 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 2-Aminobutyric acid | 0.4961 | 0.4899 | 0.4868 | 1.2937 | 1.3115 | 1.2988 | 0.2740 | 0.2649 | 0.2661 | 0.4814 | 0.4729 | 0.4623 | 3.2624 | 3.0816 | 3.0787 | 0.2239 | 0.2304 | 0.2340 | 0.5136 | 0.5200 | 0.5046 | 0.2163 | 0.2003 | 0.2157 | 3.3494 | 3.4236 | 3.2912 | 1.2238 | 1.2221 | 1.1545 | 0.2737 | 0.2796 | 0.2842 | 0.5265 | 0.5306 | 0.5415 | 1.2823 | 1.3017 | 1.3002 | 0.2182 | 0.2169 | 0.2188 | 3.7584 | 3.8560 | 4.1073 | 1.2336 | 1.2105 | 1.2328 | 0.2311 | 0.2310 | 0.2453 | 0.8958 | 0.4528 | 1.2647 | 0.2814 | 0.5046 | 0.4678 | 0.4596 | 1.3617 | 1.5091 | 1.3629 | 0.2579 | 0.3498 | 0.1760 | 0.5117 | 0.5096 | 0.4924 | 2.7214 | 2.6606 | 2.7641 | 0.1964 | 0.2012 | 0.2015 |
| 2-Aminoheptanoic acid | 0.5458 | 0.5043 | 0.5119 | 1.2155 | 1.2546 | 1.2580 | 0.0180 | 0.0178 | 0.0245 | 0.5614 | 0.5298 | 0.5417 | 13.0346 | 12.5974 | 12.3667 | 0.0163 | 0.0142 | 0.0125 | 0.5746 | 0.5356 | 0.5216 | 0.0098 | 0.0083 | 0.0081 | 0.5292 | 0.4982 | 0.4942 | 1.1161 | 1.0714 | 1.0333 | 0.0102 | 0.0178 | 0.0117 | 0.4818 | 0.4752 | 0.4860 | 1.1707 | 1.1057 | 1.1284 | 0.0186 | 0.0146 | 0.0122 | 0.6922 | 0.6872 | 0.6983 | 1.0431 | 1.0348 | 1.0436 | 0.0112 | 0.0137 | 0.0126 | 0.5903 | 0.4201 | 1.0930 | 0.0145 | 0.5748 | 0.5452 | 0.5334 | 1.2563 | 1.2249 | 2.9655 | 0.0175 | 0.0361 | 0.0121 | 0.5450 | 0.5520 | 0.5188 | 1.4675 | 1.4364 | 1.4603 | 0.0190 | 0.0236 | 0.0271 |
| 2-Hydroxy-3-methylbutyric acid/3-Hydroxyisovaleric acid | 0.2031 | 0.2082 | 0.2085 | 0.4489 | 0.4471 | 0.4475 | 0.3000 | 0.3019 | 0.3137 | 0.2889 | 0.2844 | 0.2792 | 7.9089 | 7.8737 | 7.6914 | 0.3302 | 0.3429 | 0.3180 | 0.3310 | 0.3444 | 0.3486 | 0.3436 | 0.3514 | 0.3247 | 2.1305 | 2.1967 | 2.1207 | 0.3753 | 0.3835 | 0.3706 | 0.3031 | 0.2962 | 0.3249 | 0.1599 | 0.1677 | 0.1520 | 0.4569 | 0.4550 | 0.4500 | 0.3244 | 0.3358 | 0.3373 | 1.5151 | 1.6228 | 1.6656 | 0.3878 | 0.3832 | 0.3908 | 0.2700 | 0.2687 | 0.2786 | 1.7584 | 0.1486 | 0.4027 | 0.4301 | 0.1552 | 0.1450 | 0.1441 | 0.5060 | 0.6510 | 6.0829 | 0.3788 | 2.4322 | 0.3704 | 0.1521 | 0.1564 | 0.1513 | 4.8320 | 4.8320 | 4.9017 | 0.3717 | 0.3867 | 0.3800 |
| 2-Hydroxy-3-methyl-pentanoic acid/2-Hydroxyisocaproic acid | 0.3042 | 0.3089 | 0.3165 | 0.5949 | 0.6081 | 0.5948 | 0.1735 | 0.1946 | 0.1964 | 1.0307 | 1.0282 | 1.0201 | 4.8437 | 4.8861 | 4.9036 | 0.1127 | 0.1157 | 0.1144 | 0.9306 | 0.9367 | 0.9332 | 0.0757 | 0.0755 | 0.0739 | 2.7368 | 2.7976 | 2.7830 | 0.5098 | 0.5219 | 0.5051 | 0.1501 | 0.1494 | 0.1449 | 0.1944 | 0.1894 | 0.1866 | 0.6107 | 0.6123 | 0.5923 | 0.1010 | 0.1042 | 0.1089 | 2.5694 | 2.6108 | 2.6835 | 0.5218 | 0.5198 | 0.5317 | 0.0693 | 0.0714 | 0.0720 | 1.2724 | 0.1876 | 0.5305 | 0.6612 | 0.2269 | 0.2125 | 0.2117 | 0.6305 | 0.8598 | 2.1317 | 0.4036 | 1.3908 | 0.3797 | 0.2881 | 0.2893 | 0.2848 | 6.4988 | 6.4633 | 6.4913 | 0.3435 | 0.3442 | 0.3436 |
| 2-Hydroxybutyric acid/3-Hydroxybutyric acid | 0.0974 | 0.1022 | 0.0964 | 0.2478 | 0.2478 | 0.2499 | 0.3364 | 0.3434 | 0.3462 | 0.0839 | 0.0879 | 0.0830 | 4.3165 | 4.3000 | 4.1704 | 0.3384 | 0.3327 | 0.3510 | 0.1622 | 0.1626 | 0.1637 | 0.9375 | 0.9350 | 0.8356 | 2.0834 | 2.0991 | 2.0690 | 0.2263 | 0.2320 | 0.2299 | 0.4091 | 0.4087 | 0.3913 | 0.0842 | 0.0866 | 0.0897 | 0.2535 | 0.2527 | 0.2460 | 0.3504 | 0.3259 | 0.3658 | 1.1340 | 1.1234 | 1.1416 | 0.2341 | 0.2270 | 0.2304 | 0.3850 | 0.3932 | 0.3946 | 1.0751 | 0.0969 | 0.2332 | 0.9186 | 0.0676 | 0.0675 | 0.0680 | 0.6151 | 2.1366 | 3.6157 | 10.6414 | 4.1661 | 4.4663 | 0.1194 | 0.1154 | 0.1191 | 4.5924 | 4.6722 | 4.8357 | 0.2132 | 0.2067 | 0.2130 |
| 2-Hydroxyglutaric acid | 1.1807 | 1.1505 | 1.0571 | 1.4714 | 1.5175 | 1.4556 | 0.0271 | 0.0274 | 0.0276 | 0.4247 | 0.4287 | 0.4259 | 1.7835 | 1.7575 | 1.7350 | 0.0430 | 0.0618 | 0.0435 | 1.1714 | 1.1681 | 1.0864 | 0.0315 | 0.0377 | 0.0279 | 4.6303 | 4.6938 | 4.3409 | 1.3108 | 1.3044 | 1.0790 | 0.0405 | 0.0419 | 0.0420 | 0.5158 | 0.6063 | 0.6759 | 1.4856 | 1.4940 | 1.5704 | 0.0329 | 0.0338 | 0.0352 | 3.2183 | 3.0521 | 3.1082 | 2.2753 | 2.2957 | 2.3296 | 0.0376 | 0.0373 | 0.0321 | 0.2969 | 1.1251 | 1.4172 | 0.0262 | 0.4153 | 0.3952 | 0.3796 | 1.4950 | 1.3872 | 1.6488 | 0.0382 | 0.0185 | 0.0209 | 0.3824 | 0.4224 | 0.4418 | 2.2421 | 2.2501 | 2.2554 | 0.0143 | 0.0146 | 0.0145 |
| 2-Isopropylmalic acid | 1.6244 | 1.7944 | 1.2740 | 1.5452 | 1.5309 | 1.5757 | 0.0330 | 0.0298 | 0.0312 | 0.1840 | 0.1812 | 0.1782 | 1.5940 | 1.5299 | 1.4931 | 0.0584 | 0.0624 | 0.0614 | 0.3659 | 0.3660 | 0.3515 | 0.0366 | 0.0376 | 0.0324 | 1.2769 | 1.2532 | 1.2405 | 1.8463 | 1.7426 | 1.6153 | 0.0516 | 0.0532 | 0.0528 | 0.2096 | 0.2641 | 0.3118 | 1.5811 | 1.5800 | 1.8026 | 0.0392 | 0.0406 | 0.0388 | 0.4631 | 0.4635 | 0.4613 | 3.3044 | 3.3764 | 3.3680 | 0.0241 | 0.0231 | 0.0178 | 0.1459 | 0.5532 | 1.5691 | 0.0317 | 0.1217 | 0.1094 | 0.1068 | 1.9759 | 1.8047 | 1.8665 | NA | NA | NA | 0.1338 | 0.1352 | 0.1389 | 2.0659 | 2.0293 | 2.0125 | NA | NA | NA |
| 2-Phosphoglyceric acid | 1.8569 | 2.6315 | 2.1200 | 0.9173 | 0.8770 | 0.9205 | 1.4028 | 1.3059 | 1.2270 | 1.7736 | 1.1997 | 1.1571 | 1.0894 | 1.0665 | 1.0505 | 1.6967 | 1.7467 | 1.7588 | 1.2599 | 1.0554 | 1.0973 | 0.3018 | 0.3078 | 0.2812 | 0.9489 | 0.9733 | 0.9802 | 1.9478 | 2.2632 | 2.5237 | 0.6981 | 0.5889 | 0.6346 | 0.6963 | 0.5657 | 0.6553 | 0.4089 | 0.4221 | 0.3867 | 1.7919 | 1.5431 | 1.1828 | NA | 0.3607 | 0.2752 | 0.4487 | 0.3841 | 0.4564 | 0.1884 | 0.1792 | 0.2029 | 0.6347 | NA | NA | 0.5073 | 1.0228 | 0.6604 | 0.6079 | 0.5472 | 0.4705 | 0.4160 | 0.3609 | 0.3891 | 0.5328 | 1.1471 | 1.0405 | 1.0248 | 1.6784 | 1.5195 | 1.6738 | 0.3133 | 0.2826 | 0.2113 |
| 3-(3-Hydroxyphenyl)propanoic acid | 0.0268 | 0.0262 | 0.0262 | 0.1079 | 0.1117 | 0.1113 | NA | NA | NA | 0.0266 | 0.0264 | 0.0260 | 2.8538 | 2.7618 | 2.6859 | NA | NA | NA | 0.0276 | 0.0281 | 0.0273 | NA | NA | NA | 1.9866 | 2.0540 | 1.9773 | 0.1008 | 0.1017 | 0.0959 | NA | NA | NA | 0.0259 | 0.0253 | 0.0269 | 0.0988 | 0.0999 | 0.0996 | NA | NA | NA | 2.0551 | 2.0827 | 2.0261 | 0.0960 | 0.0963 | 0.0954 | NA | NA | NA | 0.6997 | 0.0235 | 0.0984 | NA | 0.0280 | 0.0252 | 0.0254 | 0.1129 | 0.1044 | 7.6202 | 18.9653 | 0.6917 | 0.0866 | 0.0267 | 0.0257 | 0.0250 | 5.6806 | 5.6181 | 5.9258 | NA | NA | NA |
| 3^,5^ cyclic AMP | 0.7684 | 0.7499 | 0.7367 | 1.4879 | 1.4589 | 1.4831 | 1.3167 | 0.8389 | 1.2771 | 0.7213 | 0.7110 | 0.6925 | 1.2017 | 1.1561 | 1.1564 | 1.1880 | 1.2554 | 1.2575 | 0.7718 | 0.7787 | 0.7439 | 1.2680 | 1.2524 | 1.2991 | 0.8672 | 0.8361 | 0.8271 | 1.4725 | 1.4823 | 1.3861 | 0.8174 | 1.2407 | 0.8864 | 0.7143 | 0.7231 | 0.7229 | 1.4638 | 1.4760 | 1.4605 | 1.1722 | 1.1260 | 1.1482 | NA | NA | NA | NA | NA | NA | 0.0130 | 0.0101 | 0.0076 | 0.5325 | 0.6718 | 1.5024 | 0.9336 | 0.7821 | 0.7149 | 0.7101 | 1.2914 | 0.8449 | 0.9031 | 0.7044 | 0.7415 | 0.8008 | 0.7046 | 0.6916 | 0.6716 | 1.3695 | 1.3917 | 1.3677 | 1.1196 | 1.1174 | 1.1367 |
| 3-Indolepropionic acid | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 2.3524 | 2.2880 | 2.2053 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0138 | 1.0724 | 1.0299 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.8253 | 0.8198 | 0.8040 | NA | NA | NA | NA | NA | NA | 0.0667 | NA | NA | NA | NA | NA | 0.0144 | NA | NA | 1.4356 | 3.0045 | 0.0967 | 0.0116 | NA | NA | NA | 1.2724 | 1.2049 | 1.2821 | NA | NA | NA |
| 3-Methyl-2-oxovaleric acid/Ketoleucine | 2.8848 | 2.9277 | 2.5640 | 0.5666 | 0.5449 | 0.5145 | 0.6895 | 0.7720 | 0.8202 | 1.1841 | 1.2442 | 1.3041 | 0.4975 | 0.4797 | 0.5402 | 0.9751 | 1.0619 | 1.0282 | 0.5585 | 0.5639 | 0.5783 | 0.9748 | 0.8514 | 1.0687 | 3.2765 | 3.4827 | 3.4270 | 0.4394 | 0.6742 | 0.2017 | 0.5567 | 0.4725 | 0.5119 | 0.6322 | 0.5848 | 0.5557 | 0.6423 | 0.5692 | 0.5971 | 1.1183 | 1.0512 | 0.9867 | 1.3962 | 1.5316 | 1.4282 | 1.7635 | 1.6700 | 1.8884 | 1.4549 | 1.6145 | 1.6683 | 0.7872 | 0.5700 | 0.7377 | 0.5813 | 0.9141 | 0.8857 | 0.8466 | 1.5127 | 1.2658 | 0.9236 | 1.1525 | 1.1538 | 1.3602 | 0.6199 | 0.5565 | 0.5999 | 1.0871 | 0.6941 | 0.9934 | 0.3625 | 0.3783 | 0.3425 |
| 3-Methyladipic acid/Pimelic acid | 0.6948 | 0.6513 | 0.6142 | 0.8371 | 0.9492 | 0.8875 | 2.3577 | 3.1827 | 2.3444 | 0.2713 | 0.2695 | 0.2568 | 0.8021 | 0.7801 | 0.7635 | 3.4905 | 3.4191 | 3.7816 | 0.5387 | 0.5336 | 0.5115 | 4.1464 | 3.9526 | 3.7701 | 0.6770 | 0.6373 | 0.6135 | 0.8944 | 0.8441 | 0.7662 | 3.4982 | 4.2318 | 3.4376 | 0.3815 | 0.4082 | 0.4369 | 1.1758 | 1.1864 | 1.1620 | 3.8157 | 3.8697 | 3.9001 | 0.4224 | 0.4230 | 0.4109 | 1.1943 | 1.1575 | 1.1720 | 3.5950 | 3.7296 | 3.7940 | 0.3249 | 0.5133 | 1.1569 | 3.2641 | 0.1079 | 0.0973 | 0.0985 | 0.9581 | 0.8686 | 0.8181 | NA | NA | NA | 0.1878 | 0.2144 | 0.2391 | 1.0135 | 1.0247 | 0.9998 | NA | NA | NA |
| 3-Phosphoglyceric acid | 1.2614 | 1.1708 | 1.2130 | 0.7298 | 0.6851 | 0.7367 | 1.3769 | 1.4366 | 1.5431 | 0.8535 | 0.8091 | 0.8118 | 1.1966 | 1.1554 | 1.1395 | 2.1632 | 2.1390 | 2.1395 | 1.0644 | 0.9364 | 0.9233 | 0.5698 | 0.6110 | 0.5541 | 1.0847 | 1.0539 | 0.9817 | 1.8487 | 2.0522 | 2.2422 | 0.8852 | 0.9367 | 0.9971 | 0.5026 | 0.4753 | 0.4904 | 0.4128 | 0.4512 | 0.4548 | 4.7213 | 4.4945 | 5.0896 | 0.6033 | 0.6669 | 0.6204 | 0.6355 | 0.6341 | 0.6378 | 0.2703 | 0.2570 | 0.2790 | 0.7274 | 0.0454 | 0.2229 | 0.2701 | 0.8082 | 0.7280 | 0.7052 | 0.5615 | 0.3320 | 0.4656 | 0.8344 | 0.9156 | 1.1510 | 1.7292 | 1.5931 | 1.5759 | 1.5153 | 1.5344 | 1.4456 | 0.2512 | 0.2588 | 0.2504 |
| 4-hydroxybenzaldehyde | 0.2412 | 0.2593 | 0.2257 | 0.5190 | 0.4830 | 0.5139 | 0.3683 | 0.3519 | 0.3631 | 0.8489 | 0.7500 | 0.7877 | 0.9775 | 1.0054 | 0.9639 | 0.4282 | 0.4199 | 0.4516 | 0.7857 | 0.5659 | 0.5307 | 0.5833 | 0.4494 | 0.5937 | 0.2303 | 0.2113 | 0.1842 | 0.9244 | 0.9154 | 0.1975 | 0.5036 | 0.7094 | 0.5076 | 0.8956 | 0.8655 | 0.7668 | 3.3331 | 3.3451 | 3.2063 | 0.7162 | 0.7739 | 0.7309 | 0.4933 | 0.4899 | 0.4217 | 1.0424 | 1.0760 | 1.0480 | 0.5048 | 0.4918 | 0.4894 | 0.6006 | 0.8173 | 3.4029 | 0.6937 | 1.4397 | 1.3184 | 1.3116 | 3.1085 | 1.9329 | 1.9477 | 0.3777 | 0.6297 | 0.3750 | 0.8791 | 0.8708 | 0.7876 | 2.2634 | 2.2947 | 2.2089 | 0.4687 | 0.4668 | 0.4863 |
| 4-Pyridoxic acid | 0.5258 | 0.6583 | 0.6482 | 0.9234 | 0.8194 | 0.8844 | 0.8913 | 1.1064 | 1.4998 | 0.2280 | 0.3210 | 0.3283 | 1.0609 | 1.1588 | 1.1385 | 3.0001 | 2.4436 | 2.8338 | 0.3414 | 0.3521 | 0.4311 | 1.5741 | 1.3763 | 1.3837 | 0.5590 | 0.4592 | 0.5268 | 0.9313 | 0.9754 | 0.8769 | 2.1942 | 2.1353 | 2.0442 | 0.4018 | 0.3774 | 0.4980 | 1.2648 | 1.2591 | 1.2802 | 2.0994 | 2.2459 | 2.2257 | 0.2538 | 0.2603 | 0.3659 | 1.0797 | 1.1197 | 1.1031 | 1.2225 | 1.6163 | 1.5853 | 0.7837 | 0.6477 | 1.0386 | 1.1289 | 0.3272 | 0.4308 | 0.3870 | 0.8157 | 1.0361 | 0.9779 | 1.3045 | 1.3024 | 1.4727 | 0.4236 | 0.4774 | 0.4393 | 1.3177 | 0.8755 | 1.0004 | 1.8452 | 2.0810 | 1.8644 |
| 6-Phosphogluconic acid | 0.2763 | 0.2578 | 0.2666 | NA | NA | 0.2369 | 0.8554 | 0.6321 | 0.7593 | 1.3082 | 1.3886 | 1.2999 | 1.6785 | 2.9700 | 2.6954 | 1.1200 | 1.1633 | 1.1429 | 1.4916 | 1.2709 | 1.6068 | 0.9562 | 0.8386 | 1.0228 | 0.5783 | 0.3877 | 0.5371 | 1.1386 | 0.9542 | 1.2393 | 1.0409 | 1.0485 | 1.1950 | NA | NA | NA | NA | NA | 0.2556 | 0.7162 | 0.6677 | 0.7680 | 0.6759 | 0.5570 | 0.3848 | 0.3725 | 0.3617 | 0.4650 | 1.7497 | 1.7242 | 1.7560 | 0.4444 | NA | 0.2585 | 0.8034 | 0.4399 | 0.7676 | 0.9532 | 1.2732 | 0.8177 | 0.7066 | 1.6651 | 2.1426 | 2.4831 | 0.3707 | 0.4497 | 0.4118 | 0.2783 | NA | 0.2219 | 1.1356 | 1.1324 | 1.1731 |
| Adenine | 0.2021 | 0.2089 | 0.1996 | 0.1283 | 0.1373 | 0.1497 | 0.3905 | 0.3910 | 0.4024 | 0.1724 | 0.1715 | 0.1726 | 0.4715 | 0.4661 | 0.4439 | 0.4051 | 0.3852 | 0.3546 | 0.9451 | 0.9178 | 0.8996 | 1.9379 | 1.7390 | 2.1860 | 0.6664 | 0.6323 | 0.6219 | 0.7401 | 0.7802 | 0.2139 | 0.9538 | 0.9674 | 0.9838 | 0.6195 | 0.5948 | 0.5950 | 1.6067 | 1.6156 | 1.5973 | 0.5002 | 0.4756 | 0.4749 | 0.8337 | 0.8043 | 0.7966 | 1.2705 | 1.3041 | 1.2997 | 1.2012 | 1.1942 | 1.3068 | 0.7537 | 1.3884 | 0.3300 | 0.9003 | 0.6922 | 0.6314 | 0.6118 | 0.8539 | 1.2780 | 0.7581 | 1.0435 | 1.6995 | 1.0378 | 1.1533 | 1.1966 | 1.0715 | 3.9715 | 4.0116 | 3.9098 | 2.7592 | 2.8597 | 2.9010 |
| Adenylsuccinic acid | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.5236 | 0.3993 | NA | 1.3293 | 1.4152 | 1.3326 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| Adipic acid/Methylglutaric acid | 0.9474 | 0.9039 | 0.7945 | 1.3481 | 1.4441 | 1.4763 | 0.2575 | 0.2778 | 0.2286 | 0.5886 | 0.5773 | 0.5489 | 1.4025 | 1.3449 | 1.2966 | 0.1577 | 0.3368 | 0.3248 | 1.0562 | 1.1346 | 0.9869 | 0.3127 | 0.3147 | 0.2889 | 0.8931 | 0.8492 | 0.8527 | 1.4874 | 1.4037 | 1.3179 | 0.3065 | 0.3880 | 0.3068 | 0.6811 | 0.7710 | 0.9188 | 1.8018 | 1.7880 | 1.8225 | 0.3143 | 0.3433 | 0.3515 | 0.8743 | 0.8751 | 1.1453 | 2.0844 | 2.0343 | 2.0666 | 0.1547 | 0.3092 | 0.2923 | 0.2516 | 0.6969 | 1.7158 | 0.1941 | 0.2986 | 0.2799 | 0.2860 | 1.4285 | 1.2601 | 1.2768 | NA | NA | NA | 0.4499 | 0.4617 | 0.5389 | 1.7119 | 1.7354 | 1.6257 | NA | NA | NA |
| Adonitol/Arabitol | 0.5752 | 0.5479 | 0.5627 | 2.1008 | 2.1676 | 2.0777 | 0.7621 | 0.8040 | 0.8393 | 0.5057 | 0.6103 | 0.4746 | 2.0916 | 2.1746 | 2.0579 | 0.8126 | 0.8410 | 0.8562 | 0.5536 | 0.5414 | 0.5320 | 0.3597 | 0.3577 | 0.3470 | 0.6210 | 0.5964 | 0.5792 | 2.0541 | 2.0848 | 2.1170 | 0.7760 | 0.7846 | 0.8095 | 0.3955 | 0.4121 | 0.4200 | 1.9849 | 1.9850 | 1.9635 | 0.8219 | 0.8064 | 0.8400 | 0.3249 | 0.3182 | 0.3281 | 1.7497 | 1.7299 | 1.8048 | 0.7723 | 0.7612 | 0.8187 | 0.4172 | 0.2117 | 1.2022 | 0.7156 | 0.7278 | 0.6937 | 0.6627 | 2.1897 | 2.2019 | 2.3111 | 0.7933 | 1.5485 | 0.8229 | 0.4700 | 0.4381 | 0.4467 | 1.9807 | 2.0113 | 1.9949 | 0.8307 | 0.8356 | 0.8723 |
| ADP | 0.9631 | 0.8480 | 0.8942 | 0.5585 | 0.6068 | 0.5925 | 0.5300 | 0.5453 | 0.5903 | 0.9684 | 0.9511 | 0.9406 | 0.6945 | 0.6632 | 0.6643 | 0.3650 | 0.4161 | 0.4463 | 2.1834 | 1.9442 | 1.8694 | 1.9954 | 2.2515 | 1.5397 | 0.8264 | 0.7784 | 0.7592 | 0.5579 | 0.4924 | 0.4402 | 0.4746 | 0.5314 | 0.5691 | 3.7120 | 3.6465 | 4.0989 | 1.2073 | 1.1926 | 1.2053 | 4.0938 | 3.8626 | 4.1711 | 0.0609 | NA | 0.0530 | 0.2031 | 0.2089 | 0.1879 | 0.1697 | 0.1889 | NA | 0.5383 | 0.2863 | 0.1545 | 0.8782 | 0.4759 | 0.4377 | 0.4126 | 0.5069 | 0.3328 | 0.5754 | 0.6809 | 0.4696 | 0.5770 | 1.3100 | 1.3037 | 1.3068 | 2.0093 | 2.1089 | 2.0028 | 0.3806 | 0.3456 | 0.3857 |
| Aminoadipic acid | 0.9239 | 0.8522 | 0.9043 | 0.7734 | 0.8367 | 0.8769 | 1.5709 | 1.4313 | 1.3877 | 1.1345 | 1.1118 | 1.0616 | 0.8732 | 0.9055 | 0.9053 | 1.0922 | 1.0399 | 1.0045 | 0.9722 | 0.9419 | 0.8950 | 1.0394 | 1.0215 | 1.0081 | 0.7792 | 0.8118 | 0.8020 | 0.9125 | 0.9089 | 0.8992 | 1.0168 | 1.1429 | 1.1573 | 0.7272 | 0.7309 | 0.7209 | 1.1667 | 1.1238 | 1.0244 | 1.0624 | 1.1754 | 1.1707 | 0.9403 | 0.9460 | 0.9244 | 0.9820 | 0.9667 | 1.0174 | 1.1074 | 1.1148 | 1.1135 | 0.6144 | 0.6155 | 1.0358 | 1.0626 | 1.1842 | 1.0958 | 1.0672 | 1.0159 | 1.0226 | 1.1847 | 1.5100 | 1.6093 | 1.6918 | 1.0271 | 0.9807 | 0.8161 | 0.9639 | 0.9725 | 0.9932 | 1.2030 | 1.2741 | 1.2269 |
| AMP | 0.6856 | 0.6722 | 0.6537 | 1.2933 | 1.3075 | 1.3345 | 1.3789 | 1.3811 | 1.3786 | 0.6746 | 0.6450 | 0.6263 | 1.2639 | 1.2309 | 1.2409 | 1.2205 | 1.2478 | 1.4481 | 0.8269 | 0.7837 | 0.7696 | 1.6102 | 1.4361 | 1.4460 | 0.7895 | 0.7564 | 0.7285 | 1.5641 | 1.4923 | 1.5324 | 1.4218 | 1.4013 | 1.4778 | 0.8985 | 0.9042 | 0.9319 | 0.9426 | 0.9424 | 1.1149 | 2.1704 | 1.6289 | 1.6486 | 0.2016 | 0.2038 | 0.2051 | 0.5885 | 0.5779 | 0.5953 | 0.6996 | 0.6924 | 0.6977 | 0.4177 | 0.4986 | 1.0023 | 1.0359 | NA | NA | NA | 0.0045 | 0.0056 | 0.0052 | 0.7603 | 0.6942 | 0.7462 | 0.6846 | 0.6684 | 0.6691 | 2.1001 | 2.0891 | 2.0813 | 1.3917 | 0.9327 | 1.6345 |
| Aspartic acid | 1.0674 | 1.0152 | 1.0468 | 1.2031 | 1.1385 | 1.2052 | 0.8923 | 0.9150 | 0.9445 | 1.2116 | 1.2112 | 0.7901 | 1.3065 | 1.2560 | 1.2403 | 0.8324 | 0.8387 | 0.8494 | 1.2848 | 1.2292 | 1.1730 | 0.8573 | 0.9512 | 1.0626 | 1.0693 | 1.0321 | 1.0167 | 1.5550 | 1.6102 | 1.6393 | 0.7976 | 0.7856 | 0.8205 | 1.0676 | 1.0397 | 1.0731 | 1.3980 | 1.3946 | 1.3307 | 0.8966 | 0.8799 | 0.8860 | 1.1362 | 1.1312 | 1.1263 | 1.1184 | 1.0946 | 1.1838 | 0.9613 | 0.9385 | 0.9947 | 0.6415 | 0.7798 | 1.2246 | 0.7069 | 1.2915 | 1.2364 | 1.1846 | 0.6583 | 0.4245 | 0.4299 | 0.3807 | 0.3947 | 0.3980 | 0.4128 | 0.5500 | 0.4789 | 1.2950 | 1.2957 | 1.2898 | 1.1041 | 1.1745 | 1.1609 |
| Benzoic acid | 0.2822 | 0.3304 | 0.3476 | 2.0151 | 2.1067 | 2.0681 | 0.1350 | 0.1371 | 0.1314 | 0.3628 | 0.3766 | 0.3723 | 2.0954 | 2.0169 | 2.0534 | 0.1294 | 0.1444 | 0.1079 | 0.3355 | 0.3345 | 0.3534 | NA | NA | NA | 0.2689 | 0.2633 | 0.2426 | 1.9475 | 1.9760 | 2.2172 | 0.2503 | 0.2644 | 0.2726 | 0.2865 | 0.3534 | 0.2739 | 2.2456 | 2.2839 | 2.1838 | NA | NA | NA | 0.2862 | 0.2902 | 0.2880 | 1.7551 | 1.7595 | 1.7978 | NA | NA | NA | 0.6234 | 0.2724 | 1.9503 | 0.1542 | 0.3681 | 0.3002 | 0.2812 | 2.0802 | 2.0461 | 2.1082 | 0.2646 | 0.3040 | 0.3316 | 0.3096 | 0.2930 | 0.2703 | 2.0707 | 2.0554 | 2.0905 | NA | NA | NA |
| Butyric acid | 0.0474 | 0.0464 | 0.0464 | 0.0831 | 0.0838 | 0.0858 | 2.8493 | 2.7045 | 2.8324 | 0.0494 | 0.0467 | 0.0470 | 0.5817 | 0.5755 | 0.5630 | 2.7363 | 2.7226 | 2.8416 | 0.8662 | 0.8538 | 0.8501 | 2.9995 | 2.3123 | 2.9354 | 0.6846 | 0.6740 | 0.6504 | 0.6601 | 0.6732 | 0.7759 | 3.1885 | 3.1362 | 3.1467 | 0.0483 | 0.0458 | 0.0490 | 0.0787 | 0.0799 | 0.0794 | 2.8475 | 2.7845 | 2.8461 | 1.1498 | 1.1469 | 1.1495 | 0.7631 | 0.7386 | 0.7726 | 3.0552 | 3.0381 | 3.1423 | 0.5620 | 0.0391 | 0.0773 | 2.1417 | 0.0434 | 0.0413 | 0.0398 | 0.0787 | 0.0808 | 0.5849 | 1.0316 | 0.5258 | 0.5573 | 0.0495 | 0.0470 | 0.0454 | 0.2249 | 0.2259 | 0.2331 | 0.5215 | 0.5151 | 0.5257 |
| cis-Aconitic acid | 0.5644 | 0.5362 | 0.5548 | 5.0092 | 5.0613 | 5.0850 | 0.4089 | 0.4230 | 0.4270 | 0.0860 | 0.0847 | 0.0854 | 0.9249 | 0.9119 | 0.8966 | 0.2829 | 0.2989 | 0.2956 | 0.1928 | 0.1897 | 0.1907 | 0.4093 | 0.2794 | 0.4160 | 0.0159 | 0.0112 | 0.0122 | 0.5801 | 0.5540 | 0.0248 | 0.2728 | 0.2693 | 0.2673 | 0.2010 | 0.1986 | 0.1974 | 4.4560 | 4.5000 | 4.4111 | 0.7273 | 0.7009 | 0.7094 | 0.3193 | 0.3088 | 0.3151 | 3.8928 | 3.8237 | 3.9621 | 0.5563 | 0.5721 | 0.5788 | 1.0140 | 0.1702 | 2.1905 | 0.2499 | 0.1728 | 0.1588 | 0.1630 | 1.1483 | 0.7270 | 0.7902 | 0.0821 | 0.0885 | 0.0815 | 0.3056 | 0.2863 | 0.2938 | 3.1266 | 3.0164 | 3.0346 | 0.3572 | 0.3474 | 0.3462 |
| Citric acid/Isocitric acid | 0.3247 | 0.3218 | 0.3303 | 3.1657 | 3.1761 | 3.2205 | 0.4172 | 0.4315 | 0.4445 | 0.0691 | 0.0684 | 0.0717 | 0.8499 | 0.8232 | 0.8101 | 0.3059 | 0.3226 | 0.3192 | 0.2598 | 0.2602 | 0.2571 | 0.5234 | 0.3237 | 0.5226 | 0.0060 | 0.0023 | 0.0022 | 0.9342 | 0.8848 | 0.0212 | 0.3408 | 0.3440 | 0.3396 | 0.2229 | 0.2195 | 0.2200 | 3.6139 | 3.6533 | 3.5279 | 0.6317 | 0.6109 | 0.6013 | 0.2403 | 0.2317 | 0.2319 | 3.3728 | 3.3635 | 3.4348 | 0.5449 | 0.5595 | 0.5452 | 1.0734 | 0.2360 | 3.7535 | 0.3362 | 0.2348 | 0.2165 | 0.2234 | 1.8638 | 1.1735 | 1.2753 | 0.0925 | 0.0963 | 0.0908 | 0.2132 | 0.2033 | 0.2083 | 3.4644 | 3.4389 | 3.3664 | 0.4579 | 0.4489 | 0.4498 |
| CMP | 0.4389 | 0.4055 | 0.4136 | 0.9914 | 0.9847 | 1.0130 | 1.7368 | 1.6672 | 1.6258 | 0.4117 | 0.3586 | 0.3951 | 1.1648 | 1.0989 | 1.1171 | 1.6295 | 1.6905 | 1.7012 | 0.4843 | 0.4176 | 0.4463 | 1.6051 | 1.4013 | 1.6751 | 0.5050 | 0.5195 | 0.5038 | 1.2127 | 1.1313 | 1.2377 | 1.7259 | 1.7107 | 1.6409 | 0.5050 | 0.4890 | 0.5168 | 1.1481 | 1.1437 | 1.1319 | 2.0899 | 2.0828 | 2.1668 | 0.6375 | 0.6383 | 0.6928 | 1.1413 | 1.1124 | 1.1513 | 1.6513 | 1.5695 | 1.7126 | 0.5661 | 0.2892 | 0.8889 | 1.1990 | 0.3611 | 0.3369 | 0.3188 | 0.8510 | 0.5444 | 0.5719 | 0.5866 | 0.9599 | 1.0142 | 0.4747 | 0.4671 | 0.4685 | 1.5466 | 1.5686 | 1.5355 | 1.2833 | 1.4285 | 1.3413 |
| Cystathionine | 0.4964 | 0.4805 | 0.4763 | 0.8435 | 0.8110 | 0.8629 | 2.2762 | 2.0996 | 2.1313 | 0.6267 | 0.6229 | 0.6032 | 0.8340 | 0.8000 | 0.7985 | 1.4134 | 1.3978 | 1.4614 | 0.4730 | 0.4634 | 0.4450 | 1.2789 | 1.5103 | 1.6067 | 0.5004 | 0.4894 | 0.4676 | 1.0691 | 1.0343 | 1.0173 | 1.6693 | 1.7022 | 1.8017 | 0.4199 | 0.4031 | 0.4004 | 0.8674 | 0.8630 | 0.8757 | 1.1478 | 1.1167 | 1.1578 | 0.4305 | 0.4307 | 0.2730 | 0.7788 | 0.7806 | 0.7877 | 1.3914 | 1.3938 | 1.4533 | 0.6145 | 0.3454 | 0.8793 | 1.7794 | 0.7457 | 0.6814 | 0.6789 | 0.8891 | 0.8934 | 0.7840 | 1.6149 | 2.5309 | 1.6283 | 0.3879 | 0.5992 | 0.5480 | 0.8553 | 0.8460 | 0.8062 | 1.8354 | 1.8458 | 1.8827 |
| Cytidine | 0.4210 | 0.3437 | 0.3471 | 0.7636 | 0.7573 | 0.5557 | 1.6234 | 1.5173 | 1.5355 | 0.1410 | 0.1646 | 0.1386 | 0.6799 | 0.6964 | 0.6632 | 2.0374 | 2.1032 | 2.1371 | NA | NA | NA | 2.1399 | 1.5100 | 2.1752 | 0.3186 | 0.4822 | 0.4756 | 0.8427 | 0.8058 | 0.9527 | 1.5391 | 1.5433 | 1.5186 | NA | NA | NA | 0.1811 | 0.1803 | 0.1927 | 1.9832 | 3.5273 | 1.8729 | 0.2333 | 0.2307 | 0.2636 | 1.5157 | 1.5047 | 1.5451 | 2.4032 | 2.3368 | 2.3693 | 0.3962 | NA | 0.3983 | 1.7028 | 1.2033 | 0.9835 | 0.9266 | 0.3561 | 0.2778 | 0.2320 | 0.6444 | 0.5170 | 0.5620 | 0.1235 | 0.1482 | 0.1807 | 0.8744 | 0.8724 | 0.8159 | 0.7010 | 0.6859 | 0.7083 |
| dTMP | 0.8647 | 0.8284 | 0.8635 | 1.7643 | 1.7469 | 1.8283 | 0.5823 | 0.5924 | 0.5864 | 0.8832 | 0.8650 | 0.7872 | 2.2528 | 2.1463 | 2.1832 | 1.0406 | 1.0618 | 1.1593 | 0.5311 | 0.5381 | 0.5160 | 0.5278 | 0.4011 | 0.5464 | 0.7434 | 0.8421 | 0.8126 | 1.1997 | 1.1144 | 0.7280 | 0.7470 | 0.6277 | 0.7365 | 1.1358 | 0.9862 | 0.9125 | 2.2330 | 2.2146 | 2.2823 | 0.9295 | 0.9284 | 0.9411 | NA | NA | NA | 0.3908 | 0.3593 | 0.4822 | 1.0836 | 1.0575 | 1.0438 | 0.4980 | 0.3596 | 1.6302 | 0.4873 | NA | NA | NA | NA | NA | 0.2614 | 0.7096 | 0.6355 | 0.7206 | 0.4688 | 0.5039 | 0.5034 | 2.1147 | 2.0351 | 1.9934 | 0.2264 | 0.2724 | 0.2484 |
| Erythronic acid/Threonic acid | 0.4173 | 0.4073 | 0.4071 | 1.0601 | 1.0255 | 1.0549 | 2.2657 | 2.1959 | 2.2887 | 0.3999 | 0.4204 | 0.4012 | 0.9402 | 0.9279 | 0.9188 | 2.1394 | 2.2181 | 2.2117 | 0.5891 | 0.5774 | 0.5558 | 2.2044 | 2.2095 | 2.0538 | 0.3729 | 0.3608 | 0.3626 | 1.1736 | 1.1674 | 1.2853 | 1.9762 | 1.9921 | 2.0837 | 0.3823 | 0.3973 | 0.4219 | 0.5562 | 0.5483 | 0.5515 | 0.7193 | 0.7099 | 0.7125 | 0.3053 | 0.3076 | 0.3179 | 1.0556 | 1.0648 | 1.0561 | 1.9785 | 2.0411 | 2.0793 | 0.7761 | 0.3520 | 1.0733 | 1.8357 | 0.3748 | 0.3631 | 0.3726 | 1.0667 | 1.0360 | 0.8075 | 1.5856 | 2.0407 | 2.1696 | 0.4136 | 0.4108 | 0.4220 | 0.7179 | 0.7910 | 0.7438 | 1.8094 | 1.7995 | 1.8267 |
| Fructose/Glucose/Galactose | 0.8494 | 0.9095 | 0.8348 | 0.4529 | 0.4525 | 0.4635 | 1.3333 | 1.3029 | 1.3389 | 0.5568 | 0.5407 | 0.5355 | 0.4960 | 0.4878 | 0.5014 | 1.2841 | 1.2369 | 1.3019 | 0.6931 | 0.7066 | 0.7006 | 1.7316 | 1.5307 | 1.9024 | 0.6486 | 0.6633 | 0.6401 | 0.4908 | 0.4671 | 0.0346 | 1.3596 | 1.2462 | 1.3018 | 0.9650 | 0.9660 | 0.9462 | 0.5275 | 0.5318 | 0.4962 | 1.1948 | 1.1685 | 1.1858 | 1.5550 | 1.5587 | 1.5247 | 1.2539 | 1.2170 | 1.2773 | 1.5874 | 1.6053 | 1.6060 | 0.6652 | 1.8914 | 1.4426 | 1.5624 | 0.5156 | 0.5101 | 0.5026 | 0.0499 | 0.0465 | 0.0485 | 0.6332 | 0.6029 | 0.6608 | 1.0878 | 1.0880 | 1.0475 | 0.2489 | 0.2547 | 0.2376 | 1.3535 | 1.3495 | 1.3667 |
| Fumaric acid/Maleic acid | 1.4001 | 1.4440 | 1.3445 | 1.8988 | 1.9231 | 1.8645 | 0.2119 | 0.2223 | 0.2162 | 0.5730 | 0.5696 | 0.5905 | 1.6581 | 1.6274 | 1.6349 | 0.2938 | 0.3166 | 0.2966 | 4.2091 | 4.4392 | 4.4767 | 0.2804 | 0.3467 | 0.2501 | 0.9904 | 0.9627 | 0.9599 | 1.5777 | 1.5907 | 1.5102 | 0.2631 | 0.3164 | 0.2784 | 0.8528 | 0.9270 | 1.0363 | 1.5739 | 1.5975 | 1.6105 | 0.2803 | 0.2811 | 0.2877 | 1.0797 | 1.0741 | 1.0661 | 2.3429 | 2.3703 | 2.3897 | 0.3063 | 0.3037 | 0.2762 | 0.5372 | 0.9727 | 1.6444 | 0.1715 | 0.2483 | 0.2537 | 0.2439 | 1.0452 | 0.7147 | 0.7124 | 0.0483 | 0.0337 | 0.0494 | 0.3589 | 0.3194 | 0.3656 | 1.7450 | 1.7874 | 1.8301 | 0.0675 | 0.0671 | 0.0683 |
| GDP | 0.6269 | 0.6594 | 0.6321 | 0.7917 | 0.8987 | 0.8996 | 0.6955 | 0.6786 | 0.4481 | 0.4163 | 0.3738 | 0.3039 | 0.7379 | 0.7528 | 0.6550 | 0.5060 | 0.5500 | 0.6592 | 2.5705 | 2.2744 | 2.3480 | 2.6713 | 2.7681 | 2.2504 | 0.6080 | 0.5960 | 0.5991 | 0.6407 | 0.6850 | 0.7795 | 0.4274 | 0.5365 | 0.6374 | 1.5389 | 1.7478 | 1.7705 | 1.1102 | 1.1094 | 1.0543 | 2.2183 | 2.2782 | 2.1660 | NA | NA | NA | 0.1913 | NA | 0.1101 | NA | NA | 0.0764 | 0.5516 | 0.0921 | NA | 0.5809 | 0.1803 | 0.0835 | 0.0738 | NA | 0.0536 | 1.1819 | 0.6959 | 0.5315 | 0.7941 | 1.1407 | 1.0961 | 1.1158 | 3.4181 | 3.5151 | 3.5885 | 0.2960 | 0.2455 | 0.3008 |
| Gentisic acid | 0.6929 | 0.6778 | 0.6638 | 1.1888 | 1.2283 | 1.2006 | 0.9296 | 0.9403 | 0.9165 | 0.5693 | 0.5603 | 0.5534 | 1.6033 | 1.6014 | 1.5973 | 0.8784 | 0.9366 | 0.9374 | 0.7290 | 0.7520 | 0.7430 | 0.8361 | 0.8058 | 0.8268 | 0.6629 | 0.6953 | 0.6810 | 1.3003 | 1.3123 | 1.4339 | 0.7096 | 0.7243 | 0.7794 | 0.5475 | 0.5867 | 0.6445 | 1.5402 | 1.5073 | 1.4832 | 0.8981 | 0.8574 | 0.8458 | 1.8592 | 1.7401 | 1.7786 | 1.3389 | 1.3917 | 1.3432 | 0.8718 | 0.8731 | 0.8629 | 0.9654 | 0.4349 | 1.3132 | 1.0095 | 0.4574 | 0.4345 | 0.4345 | 1.3228 | 1.3624 | 1.7809 | 1.1156 | 1.2249 | 1.3406 | 0.5019 | 0.4865 | 0.4864 | 1.4341 | 1.4510 | 1.4421 | 0.7758 | 0.8009 | 0.8093 |
| Glucosan/3-Hydroxymethylglutaric acid | 1.3132 | 1.2663 | 1.2476 | 2.4419 | 2.6549 | 2.4635 | 0.0240 | 0.0333 | 0.0272 | 0.5459 | 0.5386 | 0.5367 | 2.4701 | 2.4113 | 2.3532 | 0.0286 | 0.0280 | 0.0300 | 1.0452 | 1.0472 | 1.0085 | 0.0411 | 0.0495 | 0.0377 | 2.0754 | 2.0568 | 2.0108 | 2.2412 | 2.2439 | 2.1188 | 0.0275 | 0.0459 | 0.0292 | 0.6710 | 0.7728 | 0.8601 | 2.8901 | 2.9173 | 2.8253 | 0.0362 | 0.0418 | 0.0401 | 0.0889 | 0.0909 | 0.0896 | 0.2495 | 0.2399 | 0.2502 | 0.1197 | 0.1079 | 0.0953 | 0.1613 | 1.0712 | 2.7445 | 0.0288 | 0.1224 | 0.1188 | 0.1225 | 2.5349 | 2.3738 | 2.4159 | 0.0105 | 0.0094 | 0.0118 | 0.3484 | 0.3662 | 0.4633 | 2.7828 | 2.7471 | 2.6983 | 0.0079 | 0.0062 | 0.0065 |
| Glutamic acid | 1.1862 | 1.1264 | 1.1254 | 1.6321 | 1.5814 | 1.6471 | 0.7762 | 0.7924 | 0.8097 | 1.1095 | 1.1131 | 0.7341 | 1.8681 | 1.7964 | 1.7534 | 0.7446 | 0.7466 | 0.7283 | 0.8278 | 1.1686 | 1.1277 | 0.5681 | 0.5570 | 0.7888 | 0.0885 | 0.0860 | 0.0869 | 0.2403 | 0.2422 | 0.0017 | 0.2308 | 0.2220 | 0.2200 | 0.9176 | 0.9906 | 0.9820 | 1.7026 | 1.7323 | 1.6816 | 0.7769 | 0.7705 | 0.7910 | 0.9310 | 1.1207 | 0.7428 | 1.4301 | 1.3945 | 1.4621 | 0.7178 | 0.5847 | 0.7505 | 0.5695 | 0.7640 | 1.4600 | 0.7983 | 1.0599 | 0.9940 | 0.9505 | 1.7144 | 1.9652 | 2.0441 | 0.8528 | 1.5576 | 0.8729 | 0.7408 | 1.1805 | 1.1037 | 1.5875 | 1.6331 | 1.6021 | 0.9668 | 0.9963 | 0.9814 |
| glutathione reduced | 0.1007 | 0.1117 | 0.0961 | 0.3981 | 0.4756 | 0.3571 | 0.0361 | 0.0399 | 0.0369 | 1.0083 | 1.0118 | 1.0283 | 1.1433 | 0.9506 | 0.9924 | 0.1198 | 0.1241 | 0.1253 | 1.9564 | 1.8295 | 1.8392 | 0.0811 | 0.0700 | 0.0831 | 0.1934 | 0.1787 | 0.2241 | 0.4418 | 0.4965 | NA | 0.0828 | 0.0734 | 0.0869 | 1.3567 | 1.3741 | 1.3645 | 2.8544 | 2.8575 | 2.9010 | 0.8412 | 0.8289 | 0.8237 | 0.9444 | 1.0574 | 0.8401 | 0.9923 | 0.9312 | 0.8708 | 0.0624 | 0.0610 | 0.0744 | 0.5474 | 0.0367 | 2.4031 | 0.0584 | 0.2355 | 0.2131 | 0.2162 | 4.2955 | 4.6310 | 3.9546 | 0.7334 | 0.0632 | 0.0898 | 0.9245 | 1.0023 | 1.0047 | 3.2587 | 3.2052 | 2.9380 | 0.0791 | 0.0956 | 0.0814 |
| Glyceric acid | 0.1437 | 0.2043 | 0.1419 | 0.3810 | 0.3737 | 0.3829 | 0.0519 | 0.0576 | 0.0473 | 0.0967 | 0.0961 | 0.0883 | 0.5137 | 0.5129 | 0.5002 | 0.0798 | 0.0805 | 0.0802 | 0.6474 | 0.6100 | 0.5680 | 2.5102 | 2.4738 | 2.4331 | 0.4150 | 0.4056 | 0.4027 | 0.8777 | 0.9746 | 0.6787 | 1.6025 | 1.5917 | 1.6079 | 0.5284 | 0.5448 | 0.5687 | 1.0635 | 1.0577 | 1.0711 | 1.8397 | 1.7966 | 1.8383 | 0.4173 | 0.4208 | 0.4332 | 0.9518 | 0.9313 | 0.9587 | 1.0571 | 1.0804 | 1.5335 | 0.8781 | 0.5294 | 1.6506 | 2.2722 | 0.5258 | 0.4948 | 0.5097 | 1.7525 | 1.6590 | 1.6908 | 3.6969 | 3.3581 | 3.8049 | 0.1377 | 0.1339 | 0.1426 | 0.1998 | 0.2141 | 0.2102 | 2.5511 | 2.5531 | 2.5412 |
| Glycocholate-d4 [iSTD] | 1.3911 | 1.4126 | 1.4849 | 0.8681 | 0.8806 | 0.8349 | 0.9231 | 0.9677 | 0.9529 | 1.1594 | 1.0810 | 1.0721 | 0.7492 | 0.7723 | 0.8057 | 0.9937 | 1.0102 | 0.9768 | 1.1681 | 1.2227 | 1.1539 | 0.8844 | 1.0204 | 0.9238 | 1.3386 | 1.4145 | 1.4023 | 0.9487 | 1.0302 | 1.1501 | 1.0114 | 0.9186 | 0.9784 | 1.2377 | 1.2127 | 1.1111 | 0.9487 | 0.9519 | 0.9040 | 0.9830 | 0.9255 | 0.9324 | 1.1052 | 1.1014 | 1.0926 | 0.7934 | 0.8053 | 0.8145 | 1.0150 | 0.9941 | 0.9406 | 1.5450 | 1.3317 | 0.8224 | 0.9632 | 0.8996 | 0.8484 | 0.8480 | 0.6357 | 0.6233 | 0.7156 | 0.8549 | 0.7877 | 0.7935 | 0.8886 | 0.8824 | 0.9099 | 0.7256 | 0.7222 | 0.7201 | 0.8425 | 0.8526 | 0.8297 |
| Glycocholic acid | 1.0564 | 1.0954 | 0.9960 | NA | NA | NA | NA | NA | NA | 0.8100 | 0.8048 | 0.7235 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.9167 | 1.0015 | 1.0741 | NA | NA | NA | NA | NA | NA | 0.8112 | 0.8597 | 1.2775 | NA | NA | NA | NA | NA | NA | 1.2108 | 1.1161 | 1.1205 | NA | NA | NA | NA | NA | NA | 0.2522 | 1.5184 | NA | NA | 0.9090 | 0.8098 | 0.7029 | NA | NA | NA | NA | NA | NA | 0.5383 | 0.4259 | 0.4825 | NA | NA | NA | NA | NA | NA |
| Guanine | 0.1400 | 0.1400 | 0.1536 | NA | NA | NA | 0.3872 | 0.3556 | 0.3894 | 0.3257 | 0.3174 | 0.3119 | 0.0614 | 0.0611 | 0.0576 | 0.3771 | 0.3730 | 0.3838 | 0.8059 | 0.7243 | 0.7040 | 0.5674 | 0.4671 | 0.6170 | 0.9890 | 0.8691 | 0.8609 | 2.4502 | 2.2536 | 2.9463 | 1.3451 | 1.3629 | 1.4457 | 0.7277 | 0.7402 | 0.7509 | 1.7729 | 1.7665 | 1.7622 | 0.7163 | 0.6812 | 0.7234 | 0.2383 | 0.2504 | 0.2349 | 0.6253 | 0.6494 | 0.6307 | 0.3761 | 0.3768 | 0.3948 | 0.3873 | 0.4244 | 0.5776 | 0.4347 | 0.5853 | 0.5419 | 0.5276 | 3.8243 | 2.7163 | 2.6922 | 2.4918 | 3.6814 | 4.5964 | 0.4389 | 0.4455 | 0.4253 | 0.7830 | 0.7900 | 0.7388 | 2.5486 | 2.4886 | 2.5414 |
| Guanosine | 0.3177 | 0.3152 | 0.3061 | 0.9438 | 0.9208 | 0.9632 | 1.7674 | 1.6054 | 1.6885 | 0.1315 | 0.1256 | 0.1213 | 0.7064 | 0.7105 | 0.7093 | 1.5149 | 0.9882 | 1.5357 | 0.0632 | 0.0609 | 0.0507 | 1.0255 | 0.7587 | 1.0532 | 0.2080 | 0.2000 | 0.1947 | 1.2505 | 1.3807 | 1.1346 | 1.3394 | 1.3410 | 1.3466 | 0.7355 | 0.7469 | 0.7380 | 1.5523 | 1.5489 | 1.5579 | 1.3625 | 1.3419 | 1.3455 | 0.9552 | 0.9310 | 0.9224 | 3.3625 | 3.4265 | 3.4233 | 3.0377 | 2.9387 | 3.0686 | 0.5757 | 0.2896 | 1.3264 | 1.4204 | 0.1977 | 0.1618 | 0.1807 | 0.8349 | 0.6529 | 0.3923 | 0.3214 | 0.3529 | 0.3987 | 0.3923 | 0.4256 | 0.3747 | 1.1330 | 1.7557 | 1.0814 | 0.6070 | 0.6367 | 0.6165 |
| Hexose diphosphate | 1.0195 | 1.0806 | 0.9260 | 0.7989 | 0.7772 | 0.8259 | 1.8418 | 1.8654 | 1.9679 | 0.8483 | 0.9009 | 0.9227 | 0.4545 | 0.5236 | 0.4914 | 2.6997 | 2.6718 | 2.7252 | 0.2378 | 0.2547 | 0.2390 | 2.5088 | 2.6066 | 2.1753 | 0.2770 | 0.2462 | 0.2384 | 0.2218 | 0.2679 | 0.2089 | 1.1168 | 1.1473 | 1.2468 | 1.1035 | 0.8757 | 0.9465 | 0.1394 | 0.1706 | 0.1846 | 3.7997 | 5.3170 | 5.4008 | 0.3738 | 0.3541 | 0.3200 | 0.1897 | 0.2396 | 0.1784 | 0.3295 | 0.2998 | 0.3463 | 0.3820 | NA | NA | 0.3480 | 0.9930 | 0.9617 | 1.0033 | 0.2871 | 0.3009 | 0.2484 | 2.0485 | 2.3991 | 2.6654 | 1.4591 | 1.4977 | 1.4620 | 0.5524 | 0.5860 | 0.4758 | 0.1676 | 0.2663 | 0.2827 |
| Hexose monophosphate | 0.7661 | 0.7451 | 0.7109 | 0.6508 | 0.6354 | 0.6610 | 0.8752 | 0.8091 | 0.8647 | 0.5322 | 0.5326 | 0.5337 | 0.7241 | 0.6891 | 0.6725 | 0.9285 | 0.9272 | 0.9405 | 1.2047 | 1.2353 | 1.2529 | 1.4083 | 1.4513 | 1.1900 | 0.6856 | 0.6255 | 0.5983 | 1.0929 | 1.0843 | 1.1319 | 0.8588 | 0.8395 | 0.8897 | 0.5802 | 0.5648 | 0.5752 | 1.2546 | 1.2312 | 1.2636 | 3.8038 | 3.7256 | 3.9105 | 0.8240 | 0.8266 | 0.8090 | 0.9220 | 0.9100 | 0.9147 | 0.7929 | 0.7899 | 0.8223 | 0.7178 | 0.2555 | 0.6735 | 0.4894 | 1.7243 | 1.5604 | 1.5204 | 1.4556 | 1.1961 | 1.1296 | 1.0656 | 1.2303 | 1.3806 | 1.2683 | 1.2348 | 1.1769 | 1.2199 | 1.1954 | 1.1872 | 1.0821 | 1.0721 | 1.0743 |
| Hippuric acid | 0.9741 | 1.1102 | 0.9559 | 0.5609 | 0.5756 | 0.5959 | 0.9079 | 0.9234 | 0.9287 | 0.1203 | 0.1177 | 0.0927 | 0.4732 | 0.4906 | 0.4976 | 0.7961 | 0.7671 | 0.7819 | 0.7235 | 0.7039 | 0.7189 | 1.3002 | 1.1554 | 1.3408 | 1.0569 | 1.0140 | 1.0255 | 0.7306 | 0.8611 | 0.5779 | 1.0075 | 0.9666 | 0.9518 | 0.6925 | 0.6713 | 0.6366 | 1.3592 | 1.3378 | 1.3358 | 1.4175 | 1.3966 | 1.4590 | 1.0367 | 0.9711 | 1.0501 | 1.1362 | 1.0983 | 1.1558 | 1.1652 | 1.1450 | 1.2550 | 0.7298 | 1.1939 | 1.1810 | 1.2034 | 1.1550 | 1.0555 | 0.9969 | 0.8098 | 0.8315 | 0.8333 | 1.1293 | 0.9060 | 0.9745 | 1.0324 | 0.9862 | 0.8918 | 0.9045 | 0.8907 | 0.8768 | 1.2225 | 1.2046 | 1.2322 |
| Homovanillic acid | 0.6780 | 0.6590 | 0.6435 | 1.7740 | 1.7311 | 1.7864 | 0.4978 | 0.4574 | 0.4465 | 0.4117 | 0.4159 | 0.4032 | 1.7387 | 1.7269 | 1.6947 | 0.2728 | 0.2908 | 0.1980 | 0.4498 | 0.4450 | 0.4359 | 0.0831 | 0.0865 | 0.0840 | 0.8059 | 0.8213 | 0.7755 | 1.8983 | 1.8060 | 1.8601 | 1.0895 | 1.0631 | 1.0265 | 0.3499 | 0.3717 | 0.3926 | 1.5706 | 1.5884 | 1.5957 | 0.0906 | 0.0872 | 0.0885 | 0.6431 | 0.6697 | 0.6415 | 1.5727 | 1.5458 | 1.5729 | 0.1119 | 0.1140 | 0.1191 | 0.8484 | 0.3763 | 1.4978 | 0.4561 | 0.4789 | 0.4275 | 0.4168 | 1.9281 | 2.0754 | 2.5412 | 4.2269 | 1.4267 | 1.3863 | 0.8622 | 0.7986 | 0.8143 | 2.4570 | 2.5295 | 2.4797 | 0.4339 | 0.4212 | 0.4301 |
| Hypoxanthine | 0.3424 | 0.3586 | 0.3651 | 0.9410 | 0.9194 | 0.9589 | 0.7565 | 0.6158 | 0.5428 | 0.4615 | 0.4272 | 0.4437 | 1.1986 | 1.1799 | 1.1696 | 0.6109 | 0.6221 | 0.6527 | 0.3417 | 0.3279 | 0.3349 | 0.5284 | 0.4586 | 0.6030 | 0.4350 | 0.4238 | 0.4225 | 1.5306 | 1.4287 | 1.8388 | 0.9818 | 1.0153 | 1.1155 | 0.5359 | 0.5610 | 0.5739 | 1.0385 | 1.0342 | 1.0451 | 0.6175 | 0.5949 | 0.6090 | 1.3146 | 1.3077 | 1.2415 | 2.2329 | 2.1934 | 2.2682 | 1.7516 | 1.7292 | 1.8386 | 0.5899 | 0.4114 | 0.4311 | 0.7338 | 0.9946 | 0.9326 | 0.8915 | 2.6994 | 1.9957 | 1.8331 | 2.3063 | 3.8160 | 3.5732 | 0.6526 | 0.5828 | 0.5580 | 0.9165 | 0.8682 | 0.8706 | 2.2372 | 2.1488 | 2.2214 |
| IMP | NA | NA | NA | NA | NA | NA | 0.7632 | 0.8275 | 0.7775 | NA | NA | NA | NA | NA | NA | 0.8325 | 0.7563 | 0.7723 | NA | NA | NA | 0.9842 | 1.0299 | 0.9918 | NA | NA | NA | NA | NA | NA | 0.9853 | 1.0122 | 1.0650 | NA | NA | NA | NA | NA | NA | 1.5765 | 1.4847 | 1.6076 | NA | NA | NA | NA | NA | NA | 0.7491 | 0.7511 | 0.8673 | NA | NA | NA | 0.7762 | NA | NA | NA | NA | NA | NA | 0.7421 | 0.7541 | 0.8877 | NA | NA | NA | NA | NA | NA | 0.9107 | 0.8809 | 0.9158 |
| Indolelactic acid | 0.4630 | 0.4453 | 0.4630 | 1.1600 | 1.1488 | 1.1970 | 0.8866 | 0.8997 | 0.8436 | 0.3327 | 0.3155 | 0.3156 | 3.2266 | 3.1380 | 3.0518 | 0.2827 | 0.1686 | 0.2745 | 0.3302 | 0.3246 | 0.3235 | 0.0427 | 0.0372 | 0.0370 | 1.2088 | 1.1929 | 1.1510 | 1.0970 | 1.0795 | 1.0551 | 1.1253 | 1.1259 | 1.1086 | 0.2728 | 0.2829 | 0.2919 | 0.9290 | 0.9412 | 0.9259 | 0.0896 | 0.0868 | 0.0890 | 1.0291 | 1.0184 | 1.0432 | 0.9409 | 0.9407 | 0.9472 | 0.2379 | 0.4026 | 0.5554 | 0.5749 | 0.2687 | 0.9029 | 2.3104 | 0.3261 | 0.2895 | 0.2914 | 1.0706 | 1.1800 | 2.3619 | 10.7803 | 1.2358 | 1.0823 | 0.6411 | 0.6049 | 0.6118 | 1.9442 | 1.9505 | 1.9475 | 0.5995 | 0.5828 | 0.6087 |
| Inosine | 0.7255 | 0.7107 | 0.7261 | 1.0339 | 1.0332 | 1.0726 | 0.5250 | 0.4949 | 0.4898 | 0.1765 | 0.1788 | 0.2676 | 0.7127 | 0.7183 | 0.4881 | 0.7030 | 0.4564 | 0.6970 | 0.0126 | 0.0357 | 0.0129 | 0.3656 | 0.3041 | 0.3975 | 0.2581 | 0.2324 | 0.2266 | 0.7654 | 0.6870 | 0.5052 | 0.5437 | 0.5131 | 0.5529 | 0.8109 | 0.7449 | 0.6955 | 5.5978 | 5.6048 | 5.5535 | 3.6118 | 3.4591 | 3.4225 | 0.4981 | 0.4896 | 0.4852 | 1.9412 | 1.8764 | 1.9261 | 2.0733 | 2.0386 | 2.1368 | 0.8521 | 0.1846 | 0.6030 | 0.5400 | 0.0035 | 0.0036 | 0.0038 | 1.3262 | 0.7216 | 0.6196 | 1.1325 | 1.1326 | 1.7644 | 0.2031 | 0.3359 | 0.2660 | 1.2127 | 1.1868 | 1.1645 | 0.7872 | 0.5308 | 0.5344 |
| Inosine-15N4 [iSTD] | 1.0184 | 1.0100 | 1.0452 | 0.7929 | 0.8308 | 0.7856 | 1.1341 | 1.1511 | 1.1525 | 0.8186 | 0.8111 | 0.8358 | 0.8015 | 0.8345 | 0.8099 | 1.2231 | 1.2777 | 1.1948 | 0.7147 | 0.7363 | 0.7730 | 1.0257 | 1.1161 | 1.0288 | 1.2041 | 1.1761 | 1.2286 | 0.8264 | 0.7907 | 0.8855 | 1.2961 | 1.1621 | 1.2383 | 1.0145 | 0.9438 | 0.8819 | 1.0149 | 1.0711 | 1.0200 | 1.2367 | 1.2169 | 1.2254 | 0.9213 | 0.9344 | 0.8902 | 0.7984 | 0.8119 | 0.7801 | 1.2411 | 1.2472 | 1.1882 | 1.5424 | 0.9738 | 0.8234 | 1.1601 | 0.8137 | 0.8841 | 0.9300 | 0.7384 | 0.7495 | 0.8993 | 1.1047 | 1.1412 | 1.0748 | 0.7507 | 0.8658 | 0.7587 | 0.9316 | 0.9460 | 0.9424 | 1.1121 | 1.1309 | 1.1165 |
| Isovaleric acid/Valeric acid | 0.1630 | 0.1589 | 0.1590 | 0.1879 | 0.1869 | 0.1927 | 2.9978 | 2.8965 | 2.9816 | 0.1635 | 0.1579 | 0.1559 | 1.2160 | 1.1962 | 1.1428 | 2.9540 | 2.9647 | 3.0790 | 0.1803 | 0.1773 | 0.1762 | 3.0829 | 2.3367 | 3.1579 | 0.2208 | 0.2181 | 0.2088 | 0.1793 | 0.1762 | 0.1666 | 3.0719 | 2.8805 | 3.0105 | 0.1514 | 0.1505 | 0.1524 | 0.1885 | 0.1886 | 0.1855 | 3.0316 | 2.9015 | 2.9533 | 0.2243 | 0.2207 | 0.2170 | 0.1717 | 0.1683 | 0.1748 | 2.9071 | 2.8841 | 3.0534 | 0.5936 | 0.1414 | 0.1827 | 2.3116 | 0.1531 | 0.1471 | 0.1407 | 0.1956 | 0.2029 | 1.8793 | 1.2829 | 0.6426 | 0.6566 | 0.1641 | 0.1629 | 0.1528 | 0.4644 | 0.4674 | 0.4802 | 0.5628 | 0.5581 | 0.5651 |
| Itaconic acid | 2.3893 | 2.4805 | 1.9385 | 0.4118 | 0.3214 | 0.3898 | NA | NA | NA | 0.6841 | 0.7081 | 0.6968 | 0.3712 | 0.3749 | 0.3542 | 0.2182 | 0.2317 | 0.2445 | 1.3127 | 1.3307 | 1.3052 | 0.1642 | 0.1394 | 0.1486 | 4.2100 | 4.2680 | 3.5914 | 0.4222 | 0.4001 | 0.3187 | 0.2174 | 0.1663 | 0.2281 | 0.8822 | 1.0346 | 1.2333 | 0.4857 | 0.4980 | 0.5821 | 0.1685 | 0.1789 | 0.1686 | 0.9592 | 0.9572 | 0.9486 | 0.7029 | 0.8563 | 0.7287 | NA | 0.1884 | 0.1535 | 0.2114 | 2.1984 | 0.4880 | 0.1622 | 0.8732 | 0.7740 | 0.7120 | 0.6125 | 0.6700 | 0.7912 | NA | NA | NA | 1.0227 | 1.0177 | 0.9896 | 0.4820 | 0.5026 | 0.5311 | NA | NA | NA |
| Lactic acid | 0.1658 | 0.1598 | 0.1637 | 0.1935 | 0.1932 | 0.1972 | 0.2910 | 0.2855 | 0.2871 | 1.4193 | 1.4389 | 1.4287 | 0.6255 | 0.6068 | 0.5950 | 0.2837 | 0.2873 | 0.2915 | 1.6378 | 1.5802 | 1.5990 | 0.6705 | 0.6649 | 0.5933 | 1.3030 | 1.1920 | 1.1840 | 0.7571 | 0.6484 | 0.9140 | 0.7487 | 0.7476 | 0.7677 | 0.3052 | 0.3140 | 0.3366 | 0.2042 | 0.2052 | 0.2038 | 0.2836 | 0.2798 | 0.2894 | 0.3467 | 0.3439 | 0.3693 | 0.1838 | 0.1824 | 0.1833 | 0.6299 | 0.6468 | 0.6781 | 0.8178 | 0.1637 | 0.1886 | 0.5215 | 3.1828 | 2.9176 | 2.7827 | 2.1163 | 2.0901 | 1.7856 | 4.0893 | 5.1241 | 5.2844 | 1.9883 | 2.0219 | 2.0213 | 2.2830 | 2.3040 | 2.2831 | 2.0263 | 2.0048 | 2.0280 |
| Malic acid | 1.3227 | 1.3653 | 1.2870 | 1.8335 | 1.8842 | 1.7973 | 0.2361 | 0.2455 | 0.2392 | 0.5530 | 0.5672 | 0.5664 | 1.6717 | 1.6231 | 1.6295 | 0.3453 | 0.3628 | 0.3492 | 4.2189 | 4.3495 | 4.3914 | 0.2958 | 0.3566 | 0.2716 | 0.9715 | 0.9247 | 0.9258 | 1.6534 | 1.6699 | 1.5758 | 0.3174 | 0.3382 | 0.3379 | 0.8129 | 0.8824 | 1.0251 | 1.6341 | 1.6472 | 1.6637 | 0.3087 | 0.3141 | 0.3197 | 1.0461 | 1.0671 | 1.0754 | 2.4220 | 2.4210 | 2.4448 | 0.3145 | 0.3113 | 0.2877 | 0.5598 | 0.9056 | 1.6854 | 0.1922 | 0.2684 | 0.2741 | 0.2624 | 1.0729 | 0.7137 | 0.7073 | 0.0353 | 0.0337 | 0.0348 | 0.3649 | 0.3255 | 0.3688 | 1.8187 | 1.8700 | 1.9270 | 0.0731 | 0.0732 | 0.0729 |
| Malonic acid | 0.2777 | 0.2754 | 0.2694 | 2.3799 | 2.4149 | 2.4000 | 0.0073 | 0.0072 | 0.0052 | 0.1907 | 0.1944 | 0.1887 | 2.8652 | 2.8340 | 2.7932 | 0.0176 | 0.0210 | 0.0199 | 0.9432 | 1.0898 | 1.0680 | 0.0083 | 0.0126 | 0.0104 | 0.4524 | 0.4527 | 0.4404 | 2.3249 | 2.1975 | 2.3115 | 0.0084 | 0.0101 | 0.0101 | 0.2010 | 0.2178 | 0.2527 | 1.1953 | 1.2156 | 1.2054 | 0.0143 | 0.0142 | 0.0151 | 0.2795 | 0.2845 | 0.2965 | 2.5284 | 2.5334 | 2.5648 | 0.0175 | 0.0113 | 0.0094 | 0.1882 | 0.2421 | 2.4715 | 0.0071 | 0.0722 | 0.0697 | 0.0680 | 1.6084 | 1.2230 | 1.3571 | NA | NA | NA | 0.1286 | 0.1339 | 0.1610 | 2.2002 | 2.3424 | 2.3702 | NA | NA | NA |
| Mesaconic acid | 0.7604 | 0.7630 | 0.6646 | 1.0187 | 1.0078 | 1.0351 | 0.0548 | 0.0445 | 0.0596 | 0.3191 | 0.3022 | 0.3199 | 1.0614 | 1.0024 | 0.9772 | 0.1012 | 0.1508 | 0.0909 | 0.7690 | 0.7635 | 0.7153 | 0.0612 | 0.0779 | 0.0545 | 3.7850 | 3.8777 | 3.5220 | 1.1861 | 1.1533 | 1.1330 | 0.0845 | 0.0813 | 0.0855 | 0.4303 | 0.4962 | 0.5519 | 1.0106 | 1.0296 | 1.1319 | 0.0729 | 0.0650 | 0.0789 | 3.5700 | 3.3141 | 3.3765 | 1.6175 | 1.6460 | 1.6036 | 0.0790 | 0.0796 | 0.0630 | 0.2128 | 0.7692 | 1.0157 | 0.0538 | 0.2987 | 0.2859 | 0.2623 | 0.9836 | 0.8594 | 0.8472 | NA | NA | NA | 0.2697 | 0.3251 | 0.2241 | 1.2500 | 1.2159 | 1.2086 | NA | NA | NA |
| Myo-inositol | 1.0894 | 1.0847 | 1.0557 | 0.3529 | 0.3443 | 0.3587 | 1.3802 | 1.3152 | 1.3350 | 1.2042 | 1.1631 | 1.1570 | 0.4021 | 0.4015 | 0.3977 | 1.2606 | 1.2866 | 1.2880 | 1.4032 | 1.3905 | 1.3518 | 1.5090 | 1.3333 | 1.5450 | 1.2260 | 1.1795 | 1.1859 | 0.3554 | 0.3445 | 0.2608 | 1.3728 | 1.3654 | 1.4239 | 1.3860 | 1.3661 | 1.3581 | 0.3110 | 0.3191 | 0.3174 | 1.3150 | 1.2773 | 1.2771 | 1.3603 | 1.3294 | 1.3581 | 0.5501 | 0.5315 | 0.5726 | 1.3730 | 1.3613 | 1.4334 | 0.6304 | 1.3635 | 0.5011 | 1.3713 | 1.2371 | 1.1195 | 1.1092 | 0.2695 | 0.2666 | 0.3629 | 0.9296 | 0.8418 | 0.7232 | 1.4753 | 1.4789 | 1.3887 | 0.3126 | 0.3268 | 0.3100 | 1.1620 | 1.1518 | 1.1661 |
| Ne-Ne dimethyllysine | 0.4291 | 0.4322 | 0.3996 | 0.5932 | 0.6226 | 0.6614 | 1.3727 | 1.3132 | 1.4016 | 0.9597 | 0.9987 | 0.9253 | 0.9302 | 0.8550 | 0.8737 | 2.2275 | 2.1911 | 2.2060 | 0.8328 | 0.8721 | 0.7237 | 1.5666 | 1.4090 | 1.6910 | 0.4647 | 0.4239 | 0.4296 | 0.5186 | 0.5404 | 0.4198 | 2.0074 | 1.9039 | 1.9229 | 0.5748 | 0.5348 | 0.5169 | 0.7501 | 0.8764 | 0.8362 | 1.8211 | 1.7749 | 1.8165 | 1.0882 | 1.0991 | 1.1250 | 0.6435 | 0.5543 | 0.5591 | 1.4592 | 1.4535 | 1.6461 | 0.8151 | 0.3435 | 0.6475 | 1.2373 | 0.4191 | 0.3396 | 0.3658 | 0.5678 | 0.6465 | 0.8066 | 1.7705 | 1.7784 | 1.7492 | 0.5120 | 0.4971 | 0.4798 | 0.6933 | 0.6233 | 0.6592 | 2.0195 | 2.0622 | 2.0735 |
| Nicotinic acid | 1.9290 | 1.8980 | 1.9403 | 0.5321 | 0.5269 | 0.5358 | 0.7452 | 0.7718 | 0.8047 | 2.0434 | 1.8991 | 1.9211 | 0.5377 | 0.5224 | 0.5181 | 0.7453 | 0.7471 | 0.7575 | 1.6553 | 1.6458 | 1.6532 | 0.5933 | 0.5919 | 0.6357 | 1.7099 | 1.6537 | 1.6478 | 0.5727 | 0.5637 | 0.5478 | 0.9940 | 1.0131 | 1.0597 | 2.2571 | 2.1144 | 1.9414 | 0.1647 | 0.1712 | 0.1659 | 0.0803 | 0.0774 | 0.0743 | 1.8026 | 1.7242 | 1.7249 | 0.5053 | 0.4969 | 0.4926 | 0.7063 | 0.7141 | 0.7355 | 0.8707 | 1.6064 | 0.2088 | 0.4718 | 1.8331 | 1.7303 | 1.6907 | 0.5325 | 0.5529 | 0.5063 | 0.8168 | 0.8057 | 0.8456 | 1.7983 | 1.8094 | 1.6172 | 0.5350 | 0.5346 | 0.5216 | 0.4651 | 0.4617 | 0.4566 |
| Norepinephrine | 2.9604 | 2.9243 | 2.8840 | 0.0339 | 0.0366 | 0.0378 | 0.1169 | 0.1296 | 0.1232 | 2.7857 | 2.7280 | 2.7186 | 0.0365 | 0.0344 | 0.0324 | 0.1170 | 0.1266 | 0.1232 | 2.9515 | 2.9354 | 2.9337 | 0.0563 | 0.0533 | 0.0551 | 2.8528 | 2.7445 | 2.7008 | 0.0329 | 0.0336 | 0.0334 | 0.1193 | 0.1238 | 0.1291 | 2.7549 | 2.7380 | 2.7618 | 0.0309 | 0.0291 | 0.0289 | 0.1281 | 0.1296 | 0.1346 | 2.6877 | 2.6606 | 2.6716 | 0.0194 | 0.0201 | 0.0186 | 0.0516 | 0.0513 | 0.0541 | 0.8527 | 2.4664 | 0.0218 | 0.0906 | 3.0791 | 2.8590 | 2.7829 | 0.0315 | 0.0290 | 0.0323 | 0.1824 | 0.1863 | 0.1956 | 2.7879 | 2.7519 | 2.6557 | 0.0307 | 0.0314 | 0.0297 | 0.1055 | 0.1031 | 0.1065 |
| Orotic acid | 0.1386 | 0.0956 | 0.1077 | 0.2327 | 0.1871 | 0.2287 | 1.7802 | 1.3607 | 1.3085 | NA | NA | NA | NA | 0.1789 | NA | 0.5582 | 0.4611 | 0.4619 | 0.1897 | 0.2275 | 0.2192 | 2.1925 | 1.8355 | 1.6189 | 0.1864 | 0.1576 | 0.1507 | 0.2900 | 0.2977 | 0.2615 | 2.5109 | 2.4624 | 2.3001 | 0.0539 | 0.1062 | 0.1048 | 0.3049 | 0.2580 | 0.3070 | 1.8852 | 1.6578 | 1.4147 | NA | NA | NA | 0.1659 | 0.1701 | 0.1475 | 1.1904 | 1.2643 | 1.1021 | 0.9154 | NA | 0.1646 | 0.6994 | 0.0786 | 0.0649 | 0.0539 | 0.4878 | 0.4772 | 0.5522 | 3.0604 | 2.1638 | 2.0897 | NA | NA | NA | NA | NA | NA | 4.1605 | 4.1588 | 3.9769 |
| Oxalic acid | 0.8797 | 0.8786 | 0.9302 | 1.5444 | 1.5247 | 1.5465 | 0.0977 | 0.1034 | 0.1032 | 1.3435 | 1.3859 | 1.3363 | 1.8261 | 1.6432 | 1.5396 | 0.1599 | 0.1670 | 0.1707 | 1.0589 | 1.0410 | 1.0057 | 0.1074 | 0.0881 | 0.1092 | 0.8410 | 0.8123 | 0.8029 | 1.5636 | 1.4976 | 1.5508 | 0.1604 | 0.1383 | 0.1581 | 1.1018 | 1.0514 | 1.0220 | 1.8148 | 1.8353 | 1.7947 | 0.1197 | 0.1260 | 0.1261 | 1.2677 | 1.2555 | 1.2942 | 1.6041 | 1.5935 | 1.6907 | 0.1050 | 0.1041 | 0.1127 | 2.0429 | 0.9816 | 1.8474 | 0.0983 | 2.0014 | 2.0580 | 2.0375 | 1.6675 | 1.6534 | 1.6730 | 0.0863 | 0.0857 | 0.0950 | 1.5396 | 1.5154 | 1.5535 | 1.6778 | 1.7284 | 1.6422 | 0.0917 | 0.0921 | 0.0940 |
| Oxidized glutathione | 0.6510 | 0.5983 | 0.5962 | 0.4270 | 0.3578 | 0.5542 | NA | NA | NA | 0.6467 | 0.5524 | 0.6122 | 2.1408 | 2.0633 | 2.0653 | 0.1428 | NA | 0.1295 | 1.0954 | 1.0606 | 1.0327 | 0.3041 | 0.3379 | 0.3068 | 0.1650 | 0.2401 | 0.1132 | 1.2207 | 1.1264 | NA | NA | NA | NA | 1.1764 | 1.0947 | 1.0584 | 1.6754 | 1.6763 | 1.8616 | 0.9650 | 0.9287 | 0.9445 | 2.0201 | 1.9203 | 2.0822 | 1.8909 | 1.7997 | 1.8418 | 0.2782 | 0.2860 | 0.2541 | 0.2220 | 0.6990 | 1.3209 | 0.4463 | 0.4975 | 0.3711 | 0.3615 | 1.0469 | 0.9716 | 1.2353 | 0.5656 | 0.4097 | 0.4299 | 1.3286 | 1.1726 | 1.2191 | 1.6483 | 1.6871 | 1.6424 | 0.2536 | 0.2888 | 0.2612 |
| Oxoglutaric acid | 2.2677 | 2.3195 | 2.3283 | 0.9223 | 0.9041 | 0.9345 | NA | NA | NA | 1.6221 | 1.6278 | 1.5733 | 0.7424 | 0.7308 | 0.7372 | NA | NA | NA | 1.3367 | 1.3214 | 1.3636 | NA | NA | NA | 0.8700 | 0.8735 | 0.8478 | NA | NA | NA | NA | NA | NA | 0.7634 | 0.7753 | 0.7841 | 0.8889 | 0.8779 | 0.8766 | NA | NA | NA | 1.0198 | 0.9689 | 0.9350 | 0.9675 | 0.9671 | 0.9647 | NA | NA | NA | 0.6870 | 0.4348 | 0.9793 | NA | 1.4444 | 1.3607 | 1.3611 | 0.9989 | 0.7203 | 1.0818 | NA | NA | NA | 0.5306 | 0.4786 | 0.5144 | 0.4214 | 0.4959 | 0.4231 | NA | NA | NA |
| Pantothenic acid | 0.2225 | 0.2269 | 0.2215 | 1.7842 | 1.7788 | 1.7855 | 0.9966 | 1.0030 | 1.0160 | 0.2250 | 0.2062 | 0.1853 | 1.3233 | 1.3336 | 1.3498 | 0.9038 | 0.9110 | 0.8968 | 0.3051 | 0.2991 | 0.2797 | 0.8675 | 0.8748 | 0.9819 | 0.4884 | 0.4672 | 0.4572 | 2.2918 | 2.4610 | 2.5379 | 1.2909 | 1.2103 | 1.3175 | 0.6057 | 0.5896 | 0.5371 | 1.8726 | 1.8219 | 1.7938 | 1.2257 | 1.2082 | 1.2304 | 0.4485 | 0.4237 | 0.4208 | 1.5258 | 1.5004 | 1.5946 | 1.0183 | 1.0005 | 1.0340 | 0.7913 | 0.6389 | 1.5998 | 1.1605 | 0.6520 | 0.5092 | 0.2691 | 1.2542 | 1.2678 | 1.0758 | 0.9549 | 0.8675 | 0.9790 | 0.3388 | 0.3543 | 0.3059 | 1.0868 | 1.0663 | 1.0448 | 1.1724 | 1.1770 | 1.1557 |
| Pentose 5-phosphate | 0.4191 | 0.3969 | 0.3907 | 1.5603 | 1.5742 | 1.5974 | 0.3551 | 0.3373 | 0.3998 | 0.3261 | 0.3155 | 0.2976 | 1.2853 | 1.2919 | 1.2403 | 0.5301 | 0.5372 | 0.5299 | 0.1468 | 0.1475 | 0.1464 | 2.0276 | 2.9116 | 3.5322 | 0.2075 | 0.3011 | 0.2853 | 1.3462 | 1.5420 | 0.6535 | 1.0092 | 1.0660 | 1.1218 | 0.4353 | 0.4387 | 0.4480 | 1.9294 | 1.9159 | 1.9753 | 3.7089 | 3.7060 | 3.8178 | 0.2738 | 0.2719 | 0.2546 | 2.5321 | 2.5795 | 2.5423 | 1.0799 | 1.0625 | 1.1214 | 0.8108 | 0.2033 | 0.1003 | 0.2161 | 0.1241 | 0.1098 | 0.1060 | 0.9547 | 0.5954 | 0.9952 | 1.6866 | 1.5919 | 1.6847 | 0.3416 | 0.3466 | 0.3218 | 1.7754 | 1.8327 | 1.7133 | 2.7210 | 2.6913 | 2.7484 |
| Phenylacetic acid | 1.2415 | 1.2027 | 1.1895 | 1.5532 | 1.5506 | 1.5117 | 0.5421 | 0.5318 | 0.5470 | 1.1849 | 1.2054 | 1.2443 | 1.4141 | 1.3505 | 1.3563 | 0.6354 | 0.6646 | 0.6955 | 0.7410 | 0.7470 | 0.7303 | NA | NA | NA | 0.7270 | 0.6948 | 0.7051 | 1.1102 | 1.1422 | 1.0486 | NA | NA | NA | 1.1402 | 1.1487 | 1.2268 | 1.3816 | 1.3483 | 1.3849 | 0.6535 | 0.4237 | 0.4592 | 1.0078 | 1.0735 | 1.0480 | 1.2729 | 1.2964 | 1.3189 | NA | NA | NA | 0.7097 | 1.0631 | 1.2559 | NA | 0.5415 | 0.5252 | 0.5499 | 0.8483 | 0.8389 | 0.8336 | 0.1670 | NA | NA | 0.8065 | 0.8116 | 0.7619 | 0.7437 | 0.6959 | 0.7253 | NA | NA | NA |
| Phosphoenolpyruvic acid | 2.6166 | 2.4714 | 2.9400 | 1.2494 | 1.3386 | 1.2710 | 0.7287 | 0.6100 | 0.6203 | 1.1250 | 1.9376 | 1.1846 | 1.8172 | 1.6697 | 1.6630 | 1.0794 | 1.0448 | 1.0201 | 1.4431 | 0.7776 | 0.6271 | 0.0644 | 0.1054 | 0.0704 | 0.8472 | 0.9433 | 0.9599 | 2.8514 | 3.5456 | 3.8086 | 0.3562 | 0.3361 | 0.3858 | 1.2158 | 1.0460 | 0.8644 | 0.4894 | 0.4087 | 0.4228 | 0.6317 | 0.5656 | 0.6026 | 0.2328 | 0.4271 | 0.5147 | 0.5981 | 0.5104 | 0.5470 | NA | NA | NA | 0.2272 | NA | NA | 0.0992 | 1.0395 | 0.9332 | 1.0265 | 0.3622 | 0.3448 | 0.1977 | 0.1591 | 0.0937 | 0.1040 | 0.8983 | 0.5629 | 0.6897 | 0.8165 | 0.5750 | 0.8364 | 0.0896 | 0.1089 | NA |
| Propionic acid | 0.0423 | 0.0409 | 0.0427 | 0.0575 | 0.0582 | 0.0613 | 3.7162 | 3.6007 | 3.6751 | 0.0425 | 0.0404 | 0.0423 | 0.0810 | 0.0802 | 0.0794 | 3.5865 | 3.5197 | 3.7237 | 0.0433 | 0.0446 | 0.0441 | 3.5884 | 2.6403 | 3.6461 | 0.0379 | 0.0378 | 0.0380 | 0.0529 | 0.0523 | 0.0492 | 3.6525 | 3.5924 | 3.5464 | 0.0482 | 0.0488 | 0.0501 | 0.0667 | 0.0681 | 0.0661 | 3.7206 | 3.5934 | 3.6971 | 0.0652 | 0.0630 | 0.0614 | 0.0798 | 0.0796 | 0.0820 | 3.4857 | 3.4634 | 3.6094 | 0.5149 | 0.0463 | 0.0675 | 2.7995 | 0.0340 | 0.0345 | 0.0368 | 0.0657 | 0.1352 | 0.1523 | 0.4801 | 0.5273 | 0.5460 | 0.0411 | 0.0399 | 0.0416 | 0.0549 | 0.0573 | 0.0565 | 0.6027 | 0.5879 | 0.6061 |
| Pseudouridine | 0.8212 | 0.8349 | 0.7759 | 0.9630 | 0.9409 | 0.9112 | 1.2514 | 1.3238 | 1.4072 | 0.8878 | 0.8536 | 0.8297 | 0.5990 | 0.6067 | 0.6546 | 1.2911 | 1.3582 | 1.3654 | 0.7514 | 0.7698 | 0.7603 | 1.6195 | 1.4611 | 1.7094 | 0.5232 | 0.5149 | 0.5201 | 0.7159 | 0.7267 | 0.5872 | 1.4603 | 1.4687 | 1.5049 | 0.8898 | 0.8440 | 0.8582 | 0.7900 | 0.7902 | 0.7444 | 1.4574 | 1.4274 | 1.4096 | 0.3546 | 0.3551 | 0.3517 | 0.8671 | 0.8048 | 0.8802 | 1.3465 | 1.3189 | 0.9936 | 0.5875 | 0.8102 | 0.8790 | 1.3124 | 0.9840 | 0.8808 | 0.8333 | 0.2855 | 0.1013 | 0.2004 | 1.6397 | 1.0062 | 1.6895 | 1.5746 | 1.5015 | 1.4423 | 2.0686 | 1.4055 | 1.8871 | 1.4095 | 1.7782 | 1.7148 |
| Quinic acid | 0.2312 | 0.2343 | 0.2413 | 0.7886 | 0.8023 | 0.8022 | 2.6561 | 2.6044 | 2.6532 | 0.2136 | 0.2279 | 0.2688 | 0.8576 | 0.8099 | 0.8377 | 2.5995 | 2.7426 | 2.7513 | 0.1520 | 0.1485 | 0.1579 | 1.4565 | 1.4891 | 1.5254 | 0.1069 | 0.1514 | 0.1408 | 0.5452 | 0.6274 | 0.5783 | 1.3978 | 1.3981 | 1.4253 | 0.2080 | 0.2129 | 0.2377 | 0.7853 | 0.7879 | 0.7927 | 2.3625 | 2.2522 | 2.1878 | 0.2284 | 0.2411 | 0.2319 | 0.8206 | 0.8270 | 0.8754 | 2.3138 | 2.4111 | 2.4847 | 0.7446 | 0.1965 | 0.7277 | 2.2674 | 0.2726 | 0.2817 | 0.2761 | 0.7970 | 0.7266 | 0.7453 | 2.9444 | 2.7772 | 2.9035 | 0.2444 | 0.2395 | 0.2481 | 0.8316 | 0.8801 | 0.8690 | 2.1345 | 2.1838 | 2.1723 |
| Ranitidine | 0.3618 | 0.3525 | 0.3529 | 1.9743 | 1.9829 | 2.0186 | 0.9061 | 0.8812 | 0.9167 | 0.3705 | 0.3543 | 0.3458 | 2.0600 | 1.9705 | 1.9859 | 0.8708 | 0.8692 | 0.8706 | 0.3676 | 0.3573 | 0.3451 | 0.9064 | 0.7576 | 0.9173 | 0.3405 | 0.3427 | 0.3070 | 1.9818 | 1.9836 | 1.8749 | 0.8322 | 0.8104 | 0.8662 | 0.3517 | 0.3402 | 0.3584 | 2.0260 | 2.0679 | 2.0190 | 0.8783 | 0.8620 | 0.8780 | 0.3106 | 0.3183 | 0.3298 | 1.9092 | 1.8685 | 1.9648 | 0.8011 | 0.7975 | 0.8683 | 0.7345 | 0.3133 | 1.9298 | 0.8442 | 0.3920 | 0.3296 | 0.3161 | 2.0490 | 2.0147 | 1.9805 | 0.7439 | 0.7574 | 0.7318 | 0.3445 | 0.3377 | 0.3361 | 1.9377 | 1.9299 | 1.8762 | 0.6904 | 0.6892 | 0.6903 |
| Sebacic acid | 0.9121 | 0.8688 | 0.8411 | 1.8819 | 1.9783 | 1.9950 | 0.0023 | 0.0052 | 0.0049 | 0.6315 | 0.6010 | 0.5904 | 1.8722 | 1.8160 | 1.7813 | 0.0060 | 0.0109 | 0.0097 | 0.8414 | 0.8402 | 0.8155 | 0.0085 | 0.0045 | 0.0031 | 0.7900 | 0.7652 | 0.7400 | 1.8331 | 1.8231 | 1.6661 | 0.0088 | 0.0079 | 0.0137 | 0.6695 | 0.6108 | 0.7175 | 2.0919 | 2.1023 | 2.0739 | 0.0010 | 0.0098 | 0.0099 | 0.7709 | 0.7717 | 0.7682 | 2.2897 | 2.1988 | 2.3129 | 0.0092 | 0.0095 | 0.0140 | 0.1656 | 0.7157 | 2.0432 | 0.0043 | 0.3526 | 0.3138 | 0.3139 | 1.8085 | 1.6474 | 1.5584 | 0.0109 | 0.0165 | 0.0168 | 0.4819 | 0.4906 | 0.5255 | 1.9172 | 1.9382 | 1.8582 | 0.0070 | 0.0089 | 0.0096 |
| sn-Glycero-3-phosphate | 0.7505 | 0.7347 | 0.7139 | 0.8483 | 0.8241 | 0.8753 | 0.9145 | 0.9352 | 0.8257 | 0.6694 | 0.6553 | 0.6364 | 0.6383 | 0.6183 | 0.6134 | 1.1940 | 1.1822 | 1.2142 | 1.1791 | 1.1134 | 1.1118 | 0.5649 | 0.5149 | 0.5372 | 1.6263 | 1.4130 | 1.3511 | 2.4966 | 2.8414 | 3.1575 | 1.2922 | 1.3109 | 1.3433 | 0.8368 | 0.8112 | 0.8414 | 1.7153 | 1.7011 | 1.7625 | 2.0912 | 2.0756 | 2.2291 | 0.6009 | 0.5034 | 0.5881 | 0.6416 | 0.6300 | 0.6335 | 0.2868 | 0.2831 | 0.2954 | 1.0125 | 0.5010 | 0.5730 | 0.2142 | 0.7775 | 0.4828 | 0.6743 | 3.2782 | 2.2775 | 2.3049 | 1.3787 | 1.5307 | 1.8478 | 0.7282 | 0.7002 | 0.6941 | 0.8926 | 0.8772 | 0.8478 | 0.6885 | 0.6686 | 0.7077 |
| Sorbitol | 0.8975 | 0.8894 | 0.8824 | 1.9306 | 1.9352 | 1.9352 | 1.8068 | 1.7613 | 1.8538 | 1.0127 | 1.0183 | 1.0204 | 0.9843 | 0.9701 | 1.0184 | 1.7430 | 1.8190 | 1.8355 | 0.8258 | 0.8271 | 0.8128 | 0.6958 | 0.6561 | 0.6781 | 0.5426 | 0.5226 | 0.5119 | 1.2446 | 1.3047 | 1.5759 | 1.2060 | 1.2391 | 1.2732 | 0.6375 | 0.7034 | 0.7080 | 1.5382 | 1.5476 | 1.5329 | 1.7786 | 1.7891 | 1.8293 | 0.5271 | 0.5307 | 0.5643 | 0.7567 | 0.7211 | 0.7702 | 0.7621 | 0.7574 | 0.8004 | 0.3909 | 0.3415 | 0.7498 | 0.7569 | 1.1330 | 1.1035 | 1.0791 | 0.8805 | 0.7266 | 0.7566 | 1.0119 | 0.9775 | 1.0065 | 0.4983 | 0.4930 | 0.4900 | 1.1961 | 1.2079 | 1.1653 | 1.1984 | 1.1816 | 1.1945 |
| Succinic acid | 0.9721 | 0.9420 | 0.9255 | 1.6304 | 1.6649 | 1.6409 | 0.1587 | 0.1675 | 0.1628 | 0.7784 | 0.7798 | 0.7526 | 1.7133 | 1.7013 | 1.6381 | 0.2091 | 0.2317 | 0.2178 | 0.8645 | 0.8485 | 0.8356 | 0.1902 | 0.1923 | 0.1840 | 0.8991 | 0.8683 | 0.8565 | 1.5806 | 1.5663 | 1.4873 | 0.2045 | 0.2073 | 0.2096 | 0.7450 | 0.7719 | 0.8184 | 1.6717 | 1.7013 | 1.7091 | 0.1928 | 0.1911 | 0.1917 | 0.2986 | 0.2973 | 0.2846 | 1.0406 | 1.0485 | 1.0550 | 0.1867 | 0.1841 | 0.1771 | 1.3377 | 0.9652 | 1.6239 | 0.4812 | 0.7542 | 0.7330 | 0.7291 | 5.0420 | 6.5403 | 6.2878 | 0.6176 | 0.6269 | 0.6580 | 0.7062 | 0.7147 | 0.7512 | 1.7044 | 1.7443 | 1.7303 | 0.0675 | 0.0680 | 0.0679 |
| Succinyladenosine | 1.5197 | 1.4955 | 1.4652 | 1.5189 | 1.3824 | 1.4887 | 0.4300 | 0.3662 | 0.4018 | 1.3024 | 1.3230 | 1.2909 | 1.2944 | 1.2260 | 1.0175 | 0.3965 | 0.4239 | 0.4011 | 0.4496 | 0.4283 | 0.4178 | 0.2808 | 0.1966 | 0.2517 | 0.1891 | 0.1748 | 0.1663 | 1.4049 | 1.4505 | NA | 0.4724 | 0.4031 | 0.4293 | 1.2582 | 1.3272 | 1.3270 | 1.9336 | 1.8785 | 1.9582 | 0.3130 | 0.3056 | 0.2990 | 1.3801 | 1.4218 | 1.3107 | 2.8636 | 2.6636 | 2.7192 | 0.3441 | 0.3299 | 0.3164 | 0.5183 | 1.3208 | 2.2993 | 0.3069 | 0.9471 | 0.8571 | 0.8334 | 1.8276 | 1.7419 | 2.9923 | 0.2302 | 0.2420 | 0.2343 | 0.1529 | NA | 0.1119 | NA | NA | NA | 0.1739 | 0.1691 | 0.1791 |
| Sucrose/Lactose/Trehalose | 0.9203 | 0.8822 | 0.8619 | 0.0161 | 0.0163 | 0.0201 | 1.2387 | 1.1906 | 1.2314 | 1.1735 | 1.1410 | 1.1233 | 0.0204 | 0.0194 | 0.0197 | 1.1805 | 1.1964 | 1.2317 | 1.3598 | 1.3484 | 1.2998 | 1.7873 | 1.6163 | 1.8585 | 1.2627 | 1.2124 | 1.1969 | 0.2529 | 0.2770 | 0.2781 | 1.8549 | 1.8328 | 1.9101 | 1.4987 | 1.4752 | 1.4488 | 0.2419 | 0.2398 | 0.2422 | 1.8151 | 1.7833 | 1.7858 | 1.2172 | 1.1931 | 1.2219 | 0.1898 | 0.1853 | 0.1956 | 1.3778 | 1.3788 | 1.4206 | 0.6524 | 1.3440 | 0.2290 | 1.6215 | 1.3801 | 1.2643 | 1.2404 | 0.1575 | 0.1100 | 0.1077 | 0.9815 | 1.1098 | 1.1168 | 1.3812 | 1.3790 | 1.3143 | 0.0215 | 0.0227 | 0.0217 | 1.7588 | 1.7551 | 1.7720 |
| Tetrahydroharman-3-carboxylic acid | 0.7562 | 0.7687 | 0.7162 | 0.2616 | 0.3419 | 0.2778 | 1.9895 | 2.0899 | 2.1152 | 0.8162 | 0.8084 | 0.8062 | NA | 0.2798 | 0.2457 | 1.8274 | 1.9606 | 1.7591 | 0.7344 | 0.7505 | 0.6910 | 1.7862 | 1.4210 | 1.7813 | 0.7546 | 0.7504 | 0.7359 | NA | 0.2453 | 0.2056 | 1.9271 | 2.4800 | 2.0421 | 0.6824 | 0.6967 | 0.7250 | 0.2638 | 0.2670 | 0.2848 | 2.8100 | 2.5378 | 2.7082 | 0.7307 | 0.7346 | 0.7026 | 0.2374 | 0.2495 | 0.2382 | 1.9752 | 1.9888 | 1.9787 | 0.5091 | 0.7255 | 0.2771 | 1.3340 | 1.0386 | 0.9288 | 0.8897 | 0.2671 | NA | 0.2553 | 0.4144 | 0.4454 | 0.5122 | 0.8368 | 0.8707 | 0.8636 | 0.2776 | 0.2605 | 0.2837 | 0.5697 | 0.5430 | 0.5934 |
| Threitol | 1.1054 | 1.0823 | 1.0556 | 1.9358 | 1.9893 | 1.9425 | 0.6869 | 0.7016 | 0.7335 | 0.8892 | 0.8581 | 0.8765 | 1.9005 | 1.8334 | 1.8005 | 0.7591 | 0.7906 | 0.7865 | 0.8798 | 0.8771 | 0.8803 | 0.3643 | 0.3464 | 0.3222 | 0.8708 | 0.8506 | 0.8168 | 1.5944 | 1.3334 | 1.5646 | 0.5261 | 0.5296 | 0.5630 | 0.6730 | 0.6665 | 0.6768 | 1.3420 | 1.3532 | 1.3572 | 0.4495 | 0.4717 | 0.4626 | 0.8409 | 0.8524 | 0.8512 | 2.5635 | 2.4353 | 2.6037 | 0.6979 | 0.7217 | 0.7462 | 0.7247 | 0.6229 | 1.0037 | 0.4539 | 0.8427 | 0.8121 | 0.7547 | 1.6868 | 2.2330 | 2.4237 | 0.9314 | 0.9177 | 0.9998 | 0.7358 | 0.7162 | 0.6933 | 1.4550 | 1.4745 | 1.4627 | 0.5055 | 0.4834 | 0.5177 |
| Thymine | 1.2495 | 1.2120 | 1.2016 | 1.6200 | 1.5917 | 1.6408 | 0.4602 | 0.4652 | 0.4789 | 1.2012 | 1.1712 | 1.1030 | 1.4254 | 1.4027 | 1.3970 | 0.4832 | 0.4943 | 0.5060 | 1.2026 | 1.1778 | 1.1462 | 0.4101 | 0.3762 | 0.4428 | 1.0879 | 1.0273 | 1.0037 | 1.5479 | 1.5385 | 1.4723 | 0.4842 | 0.4725 | 0.5045 | 1.1571 | 1.1582 | 1.1553 | 1.5744 | 1.5817 | 1.5761 | 0.6773 | 0.6406 | 0.6901 | 0.9439 | 0.9305 | 0.9263 | 1.4355 | 1.4128 | 1.4417 | 0.3734 | 0.3685 | 0.3882 | 0.6317 | 1.0606 | 1.4726 | 0.3852 | 1.4231 | 1.2664 | 1.2225 | 1.5210 | 1.4197 | 1.3618 | 0.3245 | 0.5154 | 0.3353 | 1.2623 | 1.2428 | 1.2079 | 1.3576 | 1.3744 | 1.3447 | 0.5545 | 0.5414 | 0.5308 |
| Thymine-d4 [iSTD] | 1.0371 | 1.0484 | 1.0791 | 0.7201 | 0.7255 | 0.7104 | 1.1602 | 1.1556 | 1.1681 | 1.0013 | 1.0173 | 0.7537 | 0.6835 | 0.6982 | 0.6835 | 1.1928 | 1.2340 | 1.1575 | 1.0487 | 1.0773 | 1.0636 | 1.1830 | 1.2870 | 1.1716 | 1.0401 | 1.0340 | 1.0295 | 0.7343 | 0.7502 | 0.7852 | 1.1736 | 1.0880 | 1.0615 | 1.0037 | 1.0160 | 1.0169 | 0.7495 | 0.7706 | 0.7677 | 1.2068 | 1.1453 | 1.1834 | 0.9067 | 0.9161 | 0.9096 | 0.7131 | 0.7307 | 0.7111 | 1.2625 | 1.2426 | 1.2248 | 1.4258 | 1.0588 | 0.7265 | 1.3150 | 1.0037 | 1.0058 | 1.0110 | 0.7157 | 0.7003 | 0.7308 | 0.9503 | 1.4324 | 0.9104 | 0.9968 | 1.0020 | 1.0163 | 0.7500 | 0.7624 | 0.7643 | 1.2512 | 1.2721 | 1.1459 |
| Uracil | 0.8492 | 0.8245 | 0.8258 | 1.3778 | 1.3826 | 1.3587 | 1.2995 | 1.2855 | 1.3481 | 0.4067 | 0.3813 | 0.3598 | 1.1042 | 1.0654 | 1.0435 | 1.1456 | 1.1733 | 1.1874 | 0.5228 | 0.5035 | 0.4681 | 0.9641 | 0.8806 | 1.0512 | 1.0068 | 0.9324 | 0.9059 | 1.5122 | 1.4586 | 1.6016 | 1.5762 | 1.5686 | 1.6633 | 0.8289 | 0.8325 | 0.8629 | 1.6976 | 1.7164 | 1.7347 | 0.9462 | 0.9313 | 0.9755 | 0.5187 | 0.5163 | 0.5212 | 1.3631 | 1.3318 | 1.3969 | 1.0617 | 1.0748 | 1.1179 | 0.6090 | 0.6908 | 1.0039 | 0.7238 | 0.3456 | 0.3142 | 0.3169 | 1.3538 | 0.8508 | 0.8290 | 0.9494 | 0.8342 | 0.8903 | 0.9356 | 0.9036 | 0.8582 | 1.1817 | 1.2074 | 1.1469 | 1.6255 | 1.5950 | 1.6250 |
| Uric acid | 0.1131 | 0.0738 | 0.0673 | 0.2474 | 0.2423 | 0.2504 | 1.1722 | 1.0634 | 1.3224 | 1.0810 | 1.6127 | 1.5772 | 0.2274 | 0.2153 | 0.2345 | 0.1905 | 0.1997 | 0.2207 | 2.3189 | 2.1990 | 2.1059 | 0.4897 | 0.4555 | 0.5081 | 0.8776 | 0.8824 | 0.8748 | 1.5790 | 1.6690 | 1.7261 | 0.3384 | 0.3543 | 0.3630 | 0.8496 | 0.6399 | 0.5959 | 0.6577 | 0.6689 | 0.5725 | 0.1311 | 0.1523 | 0.1651 | 0.8423 | 0.7833 | 0.8335 | 1.9562 | 1.8579 | 2.0068 | 0.1352 | 0.1372 | 0.1375 | 0.8014 | 1.4066 | 1.7751 | 0.8513 | 3.0412 | 2.8104 | 2.8046 | 1.1082 | 1.0439 | 1.1939 | 0.3336 | 0.3847 | 0.3690 | 3.0977 | 2.7420 | 2.2330 | 1.0001 | 1.0628 | 1.0359 | 0.6323 | 0.6821 | 0.6802 |
| Uridine | 0.4019 | 0.4058 | 0.3947 | 0.0408 | 0.0409 | 0.0460 | 1.2661 | 1.2734 | 1.2584 | 0.4064 | 0.3903 | 0.3787 | 1.6067 | 1.6776 | 1.1169 | 2.3504 | 2.3721 | 2.4398 | 0.1664 | 0.1520 | 0.1072 | 2.2614 | 1.6671 | 1.4685 | 0.6446 | 0.6372 | 0.6191 | 1.4868 | 1.5024 | 0.6315 | 1.7234 | 1.6909 | 1.7419 | 0.1535 | 0.1641 | 0.1687 | 0.5684 | 0.5435 | 0.5262 | 1.0383 | 1.0081 | 1.0220 | 0.1527 | 0.1562 | 0.1515 | 1.0832 | 1.0741 | 1.1048 | 1.4894 | 1.4958 | 1.5221 | 0.5776 | 0.7354 | 2.8390 | 2.4993 | 0.2702 | 0.2459 | 0.2491 | 0.2175 | 0.1200 | 0.1185 | 0.1724 | 0.1504 | 0.1644 | 0.3260 | 0.3470 | 0.3041 | 1.4238 | 1.5519 | 1.4494 | 1.3545 | 1.4027 | 1.3970 |
| Xanthine | 0.3114 | 0.2567 | 0.2659 | 1.0579 | 1.0073 | 1.1338 | 0.6801 | 0.8084 | 0.8461 | 0.4020 | 0.4339 | 0.4066 | 1.6700 | 1.5924 | 1.5736 | 0.1648 | 0.1537 | 0.1260 | 0.1428 | 0.1479 | 0.1466 | 0.6143 | 0.8389 | 0.6949 | 0.3138 | 0.3079 | 0.3027 | 1.2627 | 1.2903 | 1.0503 | 0.5390 | 0.5003 | 0.4869 | 0.1131 | 0.1086 | 0.1083 | 1.3410 | 1.3795 | 1.3512 | 0.4811 | 0.5087 | 0.4808 | 1.3569 | 1.3601 | 1.3432 | 4.0404 | 4.0030 | 4.1523 | 2.1226 | 2.0977 | 2.0518 | 1.3721 | 0.2444 | 1.6010 | 1.2424 | 0.6034 | 0.5826 | 0.5974 | 1.4153 | 0.4946 | 0.6011 | 0.8115 | 1.0628 | 0.7795 | 0.2624 | 0.5832 | 0.5640 | 2.0335 | 2.0516 | 2.0370 | 1.2022 | 1.2382 | 1.1922 |
Factors:
| F1 | Species:Clostridium bolteae | Media:CHG | Replicate:R1 |
| F2 | Species:Clostridium bolteae | Media:CHG | Replicate:R2 |
| F3 | Species:Clostridium bolteae | Media:CHG | Replicate:R3 |
| F4 | Species:Clostridium bolteae | Media:Gifu | Replicate:R1 |
| F5 | Species:Clostridium bolteae | Media:Gifu | Replicate:R2 |
| F6 | Species:Clostridium bolteae | Media:Gifu | Replicate:R3 |
| F7 | Species:Clostridium bolteae | Media:Mega | Replicate:R1 |
| F8 | Species:Clostridium bolteae | Media:Mega | Replicate:R2 |
| F9 | Species:Clostridium bolteae | Media:Mega | Replicate:R3 |
| F10 | Species:Clostridium clostridioforme | Media:CHG | Replicate:R1 |
| F11 | Species:Clostridium clostridioforme | Media:CHG | Replicate:R2 |
| F12 | Species:Clostridium clostridioforme | Media:CHG | Replicate:R3 |
| F13 | Species:Clostridium clostridioforme | Media:Gifu | Replicate:R1 |
| F14 | Species:Clostridium clostridioforme | Media:Gifu | Replicate:R2 |
| F15 | Species:Clostridium clostridioforme | Media:Gifu | Replicate:R3 |
| F16 | Species:Clostridium clostridioforme | Media:Mega | Replicate:R1 |
| F17 | Species:Clostridium clostridioforme | Media:Mega | Replicate:R2 |
| F18 | Species:Clostridium clostridioforme | Media:Mega | Replicate:R3 |
| F19 | Species:Clostridium innocuum | Media:CHG | Replicate:R1 |
| F20 | Species:Clostridium innocuum | Media:CHG | Replicate:R2 |
| F21 | Species:Clostridium innocuum | Media:CHG | Replicate:R3 |
| F22 | Species:Clostridium innocuum | Media:Mega | Replicate:R1 |
| F23 | Species:Clostridium innocuum | Media:Mega | Replicate:R2 |
| F24 | Species:Clostridium innocuum | Media:Mega | Replicate:R3 |
| F25 | Species:Clostridium symbiosum | Media:CHG | Replicate:R1 |
| F26 | Species:Clostridium symbiosum | Media:CHG | Replicate:R2 |
| F27 | Species:Clostridium symbiosum | Media:CHG | Replicate:R3 |
| F28 | Species:Clostridium symbiosum | Media:Gifu | Replicate:R1 |
| F29 | Species:Clostridium symbiosum | Media:Gifu | Replicate:R2 |
| F30 | Species:Clostridium symbiosum | Media:Gifu | Replicate:R3 |
| F31 | Species:Clostridium symbiosum | Media:Mega | Replicate:R1 |
| F32 | Species:Clostridium symbiosum | Media:Mega | Replicate:R2 |
| F33 | Species:Clostridium symbiosum | Media:Mega | Replicate:R3 |
| F34 | Species:Dorea longicatena | Media:CHG | Replicate:R1 |
| F35 | Species:Dorea longicatena | Media:CHG | Replicate:R2 |
| F36 | Species:Dorea longicatena | Media:CHG | Replicate:R3 |
| F37 | Species:Dorea longicatena | Media:Gifu | Replicate:R1 |
| F38 | Species:Dorea longicatena | Media:Gifu | Replicate:R2 |
| F39 | Species:Dorea longicatena | Media:Gifu | Replicate:R3 |
| F40 | Species:Dorea longicatena | Media:Mega | Replicate:R1 |
| F41 | Species:Dorea longicatena | Media:Mega | Replicate:R2 |
| F42 | Species:Dorea longicatena | Media:Mega | Replicate:R3 |
| F43 | Species:Flavonifractor plautii | Media:CHG | Replicate:R1 |
| F44 | Species:Flavonifractor plautii | Media:CHG | Replicate:R2 |
| F45 | Species:Flavonifractor plautii | Media:CHG | Replicate:R3 |
| F46 | Species:Flavonifractor plautii | Media:Gifu | Replicate:R1 |
| F47 | Species:Flavonifractor plautii | Media:Gifu | Replicate:R2 |
| F48 | Species:Flavonifractor plautii | Media:Gifu | Replicate:R3 |
| F49 | Species:Flavonifractor plautii | Media:Mega | Replicate:R1 |
| F50 | Species:Flavonifractor plautii | Media:Mega | Replicate:R2 |
| F51 | Species:Flavonifractor plautii | Media:Mega | Replicate:R3 |
| F52 | Species:- | Media:- | Replicate:- |
| F53 | Species:None | Media:Media control CHG | Replicate:CHG |
| F54 | Species:None | Media:Media control Gifu | Replicate:Gifu |
| F55 | Species:None | Media:Media control Mega | Replicate:Mega |
| F56 | Species:Streptococcus parasanguinis | Media:CHG | Replicate:R1 |
| F57 | Species:Streptococcus parasanguinis | Media:CHG | Replicate:R2 |
| F58 | Species:Streptococcus parasanguinis | Media:CHG | Replicate:R3 |
| F59 | Species:Streptococcus parasanguinis | Media:Gifu | Replicate:R1 |
| F60 | Species:Streptococcus parasanguinis | Media:Gifu | Replicate:R2 |
| F61 | Species:Streptococcus parasanguinis | Media:Gifu | Replicate:R3 |
| F62 | Species:Streptococcus parasanguinis | Media:Mega | Replicate:R1 |
| F63 | Species:Streptococcus parasanguinis | Media:Mega | Replicate:R2 |
| F64 | Species:Streptococcus parasanguinis | Media:Mega | Replicate:R3 |
| F65 | Species:Turicibacter sanguinis | Media:CHG | Replicate:R1 |
| F66 | Species:Turicibacter sanguinis | Media:CHG | Replicate:R2 |
| F67 | Species:Turicibacter sanguinis | Media:CHG | Replicate:R3 |
| F68 | Species:Turicibacter sanguinis | Media:Gifu | Replicate:R1 |
| F69 | Species:Turicibacter sanguinis | Media:Gifu | Replicate:R2 |
| F70 | Species:Turicibacter sanguinis | Media:Gifu | Replicate:R3 |
| F71 | Species:Turicibacter sanguinis | Media:Mega | Replicate:R1 |
| F72 | Species:Turicibacter sanguinis | Media:Mega | Replicate:R2 |
| F73 | Species:Turicibacter sanguinis | Media:Mega | Replicate:R3 |