Data for (Study ST003954)
(Analysis AN006499)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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1,3,7-Trimethyluric-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 | 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 |
| 1-Methylhistidine | 1.0474 | 1.0301 | 0.8593 | 0.8975 | 1.6154 | 0.9002 | 1.0353 | 0.9606 | 0.5367 | 1.0450 | 1.1582 | 0.7696 | 0.9062 | 1.3664 | 0.9004 | 0.5583 | 1.3339 | 1.0614 | 0.9329 | 1.0624 | 0.9566 | 0.3977 | 0.8736 | 0.9757 | 1.2603 | 1.3234 | 0.9128 | 0.6709 | 1.0843 | 0.8646 | 0.6745 | 0.8070 | 0.8005 | 0.7247 | 0.9550 | 1.2902 | 1.1250 | 1.3197 | 1.1607 | 1.2429 | 0.8093 | 0.6967 | 1.5409 | 0.7073 | 0.9869 | 1.4406 | 1.5153 | 1.2467 | 0.5666 | 1.0270 | 1.3998 | 0.6563 | 1.0632 | 0.5688 | 0.6267 | 0.7987 | 0.9264 | 1.4929 | 0.9248 | 1.1036 | 1.2249 | 0.8530 |
| 2-Aminobutyric-acid | 1.1367 | 0.9091 | 0.9604 | 0.5498 | 1.1890 | 1.1512 | 1.6449 | 0.8120 | 0.4130 | 0.5510 | 1.4729 | 1.3296 | 0.5399 | 1.1183 | 0.9206 | 0.9217 | 0.9239 | 0.6885 | 1.3798 | 0.7776 | 0.6680 | 1.1629 | 1.1966 | 0.8421 | 1.4210 | 1.4064 | 0.7880 | 0.7077 | 0.9119 | 1.4463 | 0.9230 | 0.6824 | 1.2724 | 0.9976 | 0.9440 | 1.9113 | 1.1122 | 1.6386 | 0.8663 | 0.8699 | 0.6302 | 0.6851 | 0.9689 | 0.7608 | 1.3450 | 0.8921 | 0.6334 | 0.6740 | 1.2893 | 0.7895 | 0.9640 | 0.7826 | 0.9008 | 0.8540 | 0.7645 | 1.5562 | 0.8099 | 1.0959 | 0.7499 | 0.4084 | 0.7936 | 1.2628 |
| 3-Aminoisobutanoic-Acid | 0.8130 | 0.9906 | 0.9047 | 0.8743 | 1.5274 | 1.1148 | 1.3087 | 1.0141 | 1.3006 | 0.9783 | 1.1012 | 0.7738 | 0.6009 | 0.9369 | 0.8241 | 0.8865 | 1.0296 | 0.9738 | 0.8245 | 1.3647 | 1.0797 | 0.8314 | 0.7913 | 1.0848 | 1.3245 | 1.2593 | 1.2395 | 1.4792 | 0.9684 | 1.2125 | 1.3018 | 0.5342 | 0.8179 | 1.0021 | 1.5005 | 1.5183 | 0.9079 | 1.0523 | 1.7147 | 0.9850 | 0.7248 | 1.0433 | 0.7976 | 1.5631 | 1.0305 | 1.2735 | 1.1791 | 1.2420 | 0.5683 | 0.7035 | 0.9320 | 0.4398 | 0.9131 | 0.8970 | 1.1771 | 0.8055 | 0.9101 | 0.9919 | 0.8536 | 0.6201 | 1.3439 | 0.9248 |
| 3-Chloro-L-Tyrosine | 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 | 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 |
| 3-Hydroxyhippuric-Acid | 0.9409 | 5.7723 | 2.6276 | 0.4683 | 1.7855 | 0.6739 | 0.0742 | 0.1173 | 0.4818 | 2.4204 | 2.1954 | 0.8280 | 1.5201 | 0.4311 | 0.6969 | 0.0783 | 0.5515 | 0.4840 | 0.1550 | 0.3431 | 1.9719 | 1.0461 | 0.8824 | 0.7402 | 0.6716 | 3.9836 | 2.5284 | 0.1794 | 0.5877 | 0.0909 | 0.3778 | 0.5206 | 0.2330 | 0.6937 | 0.6900 | 0.1426 | 0.1570 | 0.3717 | 1.7575 | 0.8327 | 0.4808 | 0.8077 | 4.8022 | 1.1107 | 0.5743 | 0.3407 | 0.3536 | 1.3018 | 0.2953 | 0.3411 | 1.5227 | 0.3107 | 0.0981 | 0.3699 | 0.1874 | 1.8316 | 1.3679 | 0.8172 | 0.3691 | 1.6587 | 2.2273 | 0.2586 |
| 3-Iodo-L-Tyrosine | 0.3891 | 0.3529 | 0.0369 | 0.0484 | 0.2083 | 1.0803 | 0.4694 | 0.3084 | 4.6532 | 1.1492 | 0.2332 | 0.8501 | 0.2397 | 0.1276 | 0.7489 | 0.6091 | 0.0091 | 2.9916 | 0.3123 | 1.0783 | 1.3101 | 13.5439 | 0.0101 | 1.5266 | 0.7533 | 0.3908 | 0.4293 | 0.3354 | 1.8091 | 0.6576 | 0.5105 | NA | 0.1365 | NA | 0.7283 | NA | 0.3767 | 0.4134 | 2.1359 | 0.1045 | 0.1723 | 1.6530 | 0.0527 | 2.3959 | 1.5281 | 2.2132 | 2.0859 | 1.0400 | 0.1545 | 1.0515 | NA | 0.0087 | 0.3564 | 1.3130 | 2.5510 | NA | 0.1170 | 0.4456 | NA | NA | 0.3919 | 0.0667 |
| 3-N-Methyl-L-Histidine | 1.3079 | 0.4795 | 0.1606 | 0.2231 | 0.9445 | 0.6700 | 3.3607 | 0.6347 | 0.2824 | 0.2457 | 1.5121 | 1.4246 | 0.9250 | 4.1046 | 1.2002 | 0.0904 | 2.1809 | 0.1133 | 1.3360 | 0.6112 | 0.9163 | 1.0961 | 0.1518 | 0.9751 | 0.6970 | 2.1115 | 1.0133 | 0.4101 | 0.5111 | 0.7458 | 0.3058 | 0.5601 | 0.4740 | 0.1891 | 0.2839 | 1.6556 | 3.5996 | 1.7944 | 0.6218 | 1.7735 | 0.3359 | 0.3046 | 1.6166 | 0.1962 | 0.1436 | 0.5366 | 1.6987 | 1.2360 | 0.7689 | 0.2467 | 1.2267 | 0.1240 | 0.8584 | 0.2435 | 0.1046 | 1.7527 | 0.3737 | 0.4736 | 0.8220 | 0.2635 | 3.6861 | 0.5227 |
| 4-Acetamidobutyric-Acid | 0.7228 | 0.6059 | 1.5033 | 1.7092 | 1.2042 | 0.5380 | 2.0841 | 0.4468 | 1.3841 | 1.3835 | 0.4967 | 0.3908 | 0.7454 | 0.9151 | 0.5895 | 0.7979 | 1.5494 | 1.9129 | 1.0143 | 1.4372 | 1.5434 | 1.2596 | 0.6044 | 1.0715 | 0.8430 | 0.7455 | 0.7009 | 1.5789 | 0.9132 | 0.8528 | 0.7301 | 1.1707 | 0.4523 | 1.1807 | 1.0739 | 0.7143 | 0.6812 | 0.0853 | 2.2183 | 0.6600 | 0.8640 | 1.0469 | 1.6967 | 1.6987 | 1.4620 | 1.3476 | 1.3017 | 1.2859 | 0.6659 | 0.7835 | 0.7669 | 0.5753 | 0.8432 | 1.1186 | 1.4028 | 1.1579 | 0.7647 | 1.0050 | NA | 0.7735 | 1.9197 | 0.5026 |
| 5-Aminovaleric-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 | 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 |
| 5-Hydroxylysine | 0.9778 | 0.9696 | 0.9709 | 0.9689 | 1.0237 | 0.9760 | 0.9777 | 1.0043 | 0.9320 | 1.1429 | 0.9692 | 0.9428 | 0.9815 | 0.9878 | 0.9665 | 0.9604 | 1.1114 | 1.2015 | 0.9479 | 1.0360 | 0.9747 | 1.2264 | 0.9669 | 0.9617 | 0.9592 | 0.9712 | 0.9627 | 1.0091 | 0.9510 | 0.9736 | 0.9499 | 0.9699 | 0.9529 | 0.9759 | 0.9810 | 0.9933 | 0.9666 | 0.9896 | 0.9911 | 0.9920 | 1.0445 | 0.9569 | 1.0374 | 1.0533 | 1.0442 | 0.9727 | 1.0056 | 1.5914 | 0.9463 | 1.0579 | 1.0053 | 0.9745 | 0.9577 | 1.0211 | 0.9449 | 0.9697 | 0.9659 | 0.9525 | 0.9864 | 0.9568 | 1.0206 | 0.9666 |
| 5-Hydroxy-Tryptamine | 1.0583 | 0.7967 | 0.5701 | 0.5375 | 1.3663 | 1.5641 | 4.7494 | 1.1649 | 0.7034 | 1.1091 | 0.8491 | 0.4158 | 0.6234 | 1.3998 | 0.1785 | 1.2746 | 1.1397 | 0.5802 | 1.1822 | 0.6764 | 1.0462 | 1.3235 | 0.4693 | 0.4822 | 1.0237 | 0.9615 | 1.5290 | 1.4503 | 0.6210 | 0.6626 | 1.4149 | 0.9974 | 1.9897 | 0.7074 | 0.7318 | 0.9754 | 0.8947 | 0.5590 | 0.6990 | 0.7672 | 1.4352 | 1.7403 | 0.5321 | 0.5128 | 0.4825 | 0.5367 | 0.8251 | 0.3689 | 0.8742 | 1.0461 | 0.5067 | 1.9062 | 1.1041 | 0.6447 | 0.5634 | 0.6200 | 0.9184 | 0.7386 | 0.7213 | 1.2719 | 0.9156 | 1.9651 |
| (5-L-Glutamyl)-L-Alanine | 0.7861 | 0.8707 | 0.8637 | 0.9545 | 1.6543 | 1.3988 | 0.9297 | 0.7423 | 0.4197 | 0.4171 | 0.8677 | 0.4209 | 1.0204 | 0.6377 | 0.8140 | 0.6663 | 1.1835 | 1.9173 | 1.4961 | 0.7239 | 1.0025 | 0.6193 | 0.9561 | 0.9100 | 1.0016 | 1.3699 | 1.2152 | 1.7274 | 1.1149 | 1.2720 | 0.7313 | 1.1800 | 0.8354 | 1.1958 | 1.4918 | 1.1016 | 1.2606 | 1.0729 | 1.5551 | 1.1257 | 0.6096 | 0.5676 | 0.5542 | 1.6982 | 1.1734 | 1.3637 | 0.9205 | 1.5069 | 1.0400 | 1.1719 | 0.8685 | 0.7993 | 1.1803 | 0.8064 | 0.9644 | 0.9097 | 1.4112 | 0.9379 | 0.9532 | 0.7758 | 1.3241 | 0.8647 |
| 6-Aminocaproic-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 | 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 |
| Ala | 0.8797 | 1.1315 | 0.8364 | 0.9990 | 1.5012 | 1.4607 | 1.0858 | 0.8520 | 0.7256 | 0.9525 | 0.8366 | 0.4416 | 0.8905 | 0.7222 | 0.6560 | 0.8345 | 1.2856 | 1.5564 | 1.0834 | 0.9122 | 1.1718 | 1.2715 | 0.9332 | 0.8227 | 0.8986 | 1.0824 | 0.9452 | 1.5007 | 1.0584 | 1.2445 | 0.7781 | 1.1522 | 0.8509 | 1.0492 | 1.2243 | 0.9749 | 1.1452 | 0.8474 | 1.3740 | 0.9473 | 0.7785 | 0.7934 | 0.6361 | 1.2781 | 1.2372 | 1.2055 | 0.7687 | 1.3074 | 1.0852 | 0.9740 | 0.8322 | 0.7849 | 1.0561 | 1.1441 | 0.9988 | 1.0472 | 1.2803 | 0.8898 | 1.0910 | 0.8585 | 1.2532 | 0.8667 |
| Anserine | 0.8948 | NA | NA | NA | NA | NA | NA | NA | NA | 0.9077 | 0.8920 | NA | NA | NA | NA | NA | 1.0609 | NA | 0.8947 | 0.9006 | 0.8937 | NA | NA | NA | NA | NA | 0.9163 | 1.3754 | NA | 0.8987 | NA | 0.8844 | NA | NA | 0.9406 | NA | NA | NA | 1.0049 | 0.9233 | 0.9380 | 0.9344 | 0.9445 | NA | 0.8992 | NA | 1.0666 | NA | NA | 1.1612 | NA | NA | NA | NA | NA | NA | NA | 0.9088 | 0.9154 | 1.9327 | 0.9111 | NA |
| Arg | 1.2490 | 1.2226 | 1.0637 | 0.8620 | 1.5989 | 1.5037 | 0.9769 | 1.1203 | 0.3401 | 0.8053 | 0.9831 | 0.6859 | 1.2221 | 0.9191 | 1.2085 | 0.9777 | 0.9897 | 1.0553 | 0.7686 | 0.5195 | 1.1212 | 0.4323 | 1.1105 | 1.0125 | 1.1668 | 1.1746 | 0.7352 | 0.7493 | 1.1347 | 0.8527 | 0.9987 | 1.0338 | 0.9140 | 1.1800 | 0.9600 | 0.9907 | 0.7935 | 1.0881 | 0.8072 | 1.1776 | 1.1926 | 0.9898 | 0.6882 | 0.5811 | 0.7508 | 0.6469 | 0.8675 | 1.0422 | 0.8371 | 0.9990 | 0.9126 | 0.8945 | 1.2327 | 0.7588 | 0.7997 | 0.7832 | 1.0321 | 0.8962 | 1.2150 | 1.0293 | 1.1318 | 0.9730 |
| Asn | 1.0133 | 1.6653 | 1.0382 | 1.1851 | 1.1217 | 0.9097 | 1.1978 | 0.9211 | 0.7701 | 1.1382 | 0.8968 | 0.6922 | 0.8599 | 0.9800 | 1.0446 | 0.8040 | 0.7379 | 0.9848 | 0.8263 | 1.0035 | 1.3922 | 0.9659 | 0.9728 | 0.9406 | 1.0227 | 0.9928 | 0.9780 | 1.1639 | 1.0389 | 1.0619 | 0.8735 | 0.9201 | 0.9844 | 0.9629 | 0.8859 | 0.8883 | 0.9323 | 1.1405 | 0.9512 | 1.0757 | 0.7464 | 0.7838 | 0.9363 | 1.0266 | 1.0425 | 0.9091 | 1.1525 | 1.0593 | 0.9266 | 1.0349 | 0.9661 | 0.8307 | 0.9363 | 1.1873 | 1.0562 | 0.8500 | 0.9568 | 1.1134 | 1.5404 | 0.9178 | 0.9547 | 1.0169 |
| Asp | 1.1445 | 0.5376 | 0.8200 | 1.5649 | 1.7964 | 0.5357 | 0.9659 | 0.9859 | 0.6060 | 2.8442 | 0.6288 | 0.9155 | 1.3900 | 0.7877 | 0.5321 | 0.3498 | 0.8464 | 1.2325 | 1.1193 | 0.8960 | 1.1159 | 0.5101 | 0.9336 | 0.8331 | 1.1966 | 0.9574 | 0.5429 | 0.5170 | 0.6264 | 1.0618 | 0.5102 | 0.5635 | 0.7618 | 0.9901 | 0.6545 | 1.2954 | 0.7537 | 1.0880 | 0.6139 | 1.5433 | 0.3114 | 0.4746 | 0.7569 | 1.4586 | 0.7979 | 0.9990 | 1.5317 | 1.9992 | 0.6081 | 0.5243 | 1.1249 | 0.9753 | 0.5492 | 1.5733 | 1.8424 | 1.3742 | 1.2055 | 0.9098 | 1.0604 | 1.1901 | 1.0408 | 0.8228 |
| Asp-Phe | 0.3947 | 0.6574 | 0.3617 | 1.9263 | 3.0019 | 0.2577 | 1.1449 | 1.3251 | 0.7042 | 1.5657 | 0.5282 | 0.7998 | 2.4792 | 1.0831 | 0.4380 | 0.1458 | 0.5317 | 1.7668 | 1.4820 | 0.9765 | 1.0744 | 0.2900 | 1.1476 | 0.9496 | 1.0607 | 1.2474 | 0.2290 | 0.3700 | 0.4301 | 1.0553 | 0.2893 | 0.6652 | 0.4403 | 0.5540 | 0.4020 | 1.7477 | 0.5498 | 2.4569 | 0.5453 | 2.8331 | 0.1354 | 0.4335 | 1.2280 | 2.2420 | 0.9551 | 1.9502 | 1.7918 | 1.8558 | 0.2792 | 0.3704 | 1.4516 | 1.1287 | 0.2971 | 2.5382 | 2.5704 | 1.7014 | 1.1259 | 0.5808 | 1.1068 | 1.0042 | 2.3265 | 0.4657 |
| Beta-Alanine | 0.7432 | 0.4878 | 0.8713 | 0.7979 | 0.5569 | 0.4262 | 1.1097 | 0.4441 | 0.3771 | 1.6198 | 0.4338 | 0.1212 | 0.7802 | 0.5674 | 0.5105 | 0.2026 | 1.3121 | 1.3182 | 1.1870 | 2.5173 | 1.2024 | 2.9553 | 0.8443 | 0.6331 | 0.9254 | 0.9528 | 0.7495 | 3.5823 | 0.6425 | 0.6497 | 0.3794 | 0.6056 | 0.5659 | 0.4561 | 1.1787 | 1.2056 | 1.1318 | 1.3644 | 2.3548 | 1.5805 | 0.6170 | 0.5984 | 1.6182 | 1.8310 | 1.2115 | 1.6117 | 2.7601 | 2.4671 | 0.4750 | 1.6286 | 0.3349 | 0.4170 | 0.9386 | 1.0182 | 0.4746 | 0.6472 | 0.4719 | 1.4357 | 0.7187 | 0.6736 | 1.3761 | 0.6423 |
| Creatine | 0.7635 | 1.4149 | 0.5210 | 0.6684 | 2.0454 | 1.1746 | 1.4725 | 0.9306 | 0.8049 | 1.0200 | 1.1783 | 0.6651 | 0.8130 | 1.1721 | 0.6253 | 0.8631 | 1.5495 | 1.8760 | 0.9076 | 0.9467 | 1.3200 | 1.2638 | 1.0517 | 0.8736 | 1.5846 | 0.8730 | 0.7317 | 0.9671 | 0.7753 | 1.6092 | 1.3056 | 1.0218 | 1.0181 | 1.2637 | 0.9708 | 1.2806 | 0.9234 | 1.1508 | 0.6790 | 0.7579 | 0.6328 | 0.9226 | 0.6403 | 1.1157 | 0.9536 | 0.9948 | 0.8666 | 1.0322 | 1.1482 | 0.6819 | 1.0077 | 0.7208 | 0.6315 | 1.3274 | 0.9926 | 1.2916 | 1.3169 | 0.7014 | 1.1763 | 0.7297 | 1.3595 | 1.0496 |
| Creatine-Phosphate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.0717 | NA | NA | NA | 3.5281 | 0.3924 | NA | NA | NA | 0.6730 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.7462 | NA | 0.5886 | 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 |
| Cys | 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 | 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 |
| D-Alanyl-D-Alanine | 1.0863 | NA | 0.6447 | 1.0365 | NA | NA | NA | NA | NA | 1.3738 | NA | NA | NA | NA | NA | NA | NA | 1.1053 | NA | 0.6409 | NA | NA | NA | NA | NA | NA | 0.7029 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0407 | NA | 0.9026 | NA | NA | 1.4462 | NA | NA | NA | NA | NA | NA | 1.1350 | NA | NA | NA | NA | NA | NA | 1.0834 | NA | NA | 0.9392 | NA | NA | 0.6898 |
| D-Homocysteine | 0.9554 | 1.1355 | 0.9614 | 0.8087 | 0.9243 | 1.1783 | 1.3077 | 0.7951 | 1.7088 | 0.9605 | 1.0990 | 1.0528 | 0.7652 | 0.6006 | 1.1994 | 0.7292 | 0.8291 | 0.8006 | 0.6922 | 0.8238 | 0.7082 | 0.9579 | 0.7449 | 0.7706 | 1.0463 | 0.8527 | 0.6835 | 1.5369 | 1.0915 | 0.9081 | 1.0201 | 1.0244 | 1.2347 | 1.0325 | 1.4579 | 1.0823 | 1.1473 | 1.3267 | 1.1829 | 0.7858 | 0.8449 | 0.7179 | 0.9668 | 0.7466 | 1.6715 | 0.9687 | 1.1765 | 1.1852 | 0.9637 | 1.4882 | 1.6741 | 0.6509 | 0.8091 | 0.8712 | 1.1180 | 0.8424 | 0.9304 | 0.9501 | 0.7587 | 1.0883 | 0.8329 | 1.2227 |
| Ethanolamine | 1.0898 | 0.8177 | 0.8596 | 0.8569 | 1.2970 | 1.1153 | 1.0344 | 1.0613 | 0.9504 | 1.2039 | 0.9320 | 0.8238 | 1.0563 | 0.9177 | 0.9671 | 0.7902 | 0.8095 | 1.0219 | 1.0431 | 0.9573 | 0.9728 | 1.0804 | 1.0661 | 0.9812 | 1.1175 | 0.9340 | 0.8165 | 0.9543 | 0.8228 | 1.2671 | 0.7403 | 0.8326 | 0.9493 | 0.9539 | 1.0563 | 1.1199 | 0.9040 | 1.0563 | 0.9931 | 1.0468 | 0.7502 | 0.8456 | 0.9291 | 1.3246 | 1.0222 | 1.2183 | 1.2152 | 1.4764 | 0.6222 | 0.9167 | 0.8899 | 1.0880 | 0.8503 | 1.2170 | 1.2172 | 1.0830 | 0.9356 | 1.0822 | 0.6482 | 0.8201 | 0.8684 | 0.9005 |
| Gln | 0.9981 | 1.0448 | 0.9991 | 1.0175 | 1.1310 | 1.1933 | 0.9903 | 1.0871 | 0.9662 | 0.8395 | 0.9519 | 0.8893 | 1.0011 | 0.8895 | 1.1355 | 1.1575 | 0.8999 | 1.0325 | 0.8629 | 0.8619 | 1.0472 | 0.6400 | 1.0515 | 1.1131 | 1.1588 | 1.0508 | 1.0826 | 1.0632 | 0.9565 | 1.0636 | 1.0777 | 1.0392 | 1.0031 | 1.0310 | 1.0251 | 0.8611 | 1.0097 | 1.0604 | 0.9790 | 1.0431 | 1.0208 | 1.0629 | 0.9629 | 0.9659 | 0.9974 | 0.8748 | 0.9148 | 0.9585 | 0.9459 | 1.0980 | 0.8748 | 0.9287 | 1.2126 | 0.7872 | 1.0465 | 0.9471 | 0.9982 | 1.1271 | 1.0181 | 0.9583 | 1.0129 | 0.9983 |
| Glu | 1.0188 | 0.5740 | 0.9320 | 1.1927 | 2.4697 | 0.6855 | 0.6096 | 0.9804 | 0.5268 | 2.2425 | 0.6576 | 0.5426 | 1.3573 | 0.5628 | 0.4727 | 0.3564 | 1.2574 | 1.5703 | 1.3094 | 1.0047 | 1.0867 | 0.4436 | 0.9883 | 0.9707 | 0.9848 | 1.1610 | 0.5084 | 0.4717 | 0.9312 | 0.8592 | 0.4752 | 0.8616 | 0.6797 | 0.7007 | 0.9957 | 1.6086 | 0.8320 | 1.5320 | 0.5100 | 1.4625 | 0.3101 | 0.3528 | 0.6225 | 1.3700 | 0.8128 | 1.4926 | 1.6509 | 2.4282 | 0.9665 | 0.5136 | 1.5015 | 1.0976 | 0.5847 | 1.5905 | 1.6001 | 1.2183 | 1.0514 | 0.9880 | 0.5623 | 0.8791 | 1.1699 | 0.6803 |
| Glutathione-Oxidized | 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 | 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 |
| Gly | 1.0867 | 0.8749 | 0.9335 | 1.1026 | 0.9842 | 0.9563 | 1.0788 | 1.1929 | 1.4938 | 1.2182 | 1.7166 | 0.7860 | 1.0990 | 0.8321 | 0.9802 | 0.8109 | 0.7525 | 0.9987 | 0.7752 | 1.0469 | 1.4983 | 1.1572 | 0.8220 | 0.8406 | 0.9207 | 0.7991 | 1.0276 | 1.1013 | 0.9538 | 1.4031 | 0.8905 | 0.8130 | 0.9972 | 1.1688 | 0.7064 | 0.7951 | 0.8626 | 0.7562 | 1.0710 | 0.9803 | 0.9021 | 0.9290 | 0.9724 | 1.1110 | 0.9501 | 0.6623 | 0.9594 | 1.1529 | 0.8755 | 1.0836 | 0.8228 | 0.6176 | 0.7386 | 1.0233 | 0.9180 | 1.3050 | 1.1125 | 0.8506 | 1.1724 | 0.9050 | 0.8314 | 1.0391 |
| Glycyl-L-Proline | 1.0443 | 0.8435 | 0.9370 | 0.9598 | 1.1436 | 0.9782 | 0.9592 | 0.9682 | 0.9373 | 0.8811 | 0.9108 | 0.8646 | 1.0105 | 0.8794 | 0.8650 | 1.0064 | 0.9854 | 1.2970 | 1.0744 | 1.0681 | 0.9777 | NA | 0.8257 | 0.9206 | 0.9736 | 1.0514 | 0.9504 | 1.0652 | 0.8972 | 1.0113 | 0.8485 | 1.3415 | 0.8825 | 0.8704 | 1.3783 | 0.8683 | 0.9998 | 0.9067 | 1.6399 | 0.9401 | 0.9496 | 0.8884 | 0.9421 | 1.1531 | 0.9981 | 0.9939 | 1.2678 | 1.0477 | 0.8872 | 0.9354 | 0.8991 | 1.0406 | 0.9671 | 0.9630 | 0.9378 | 1.0380 | 0.8604 | 0.9475 | 0.9458 | 0.8531 | 1.0517 | 1.1594 |
| glycylphenylalanine | 1.0920 | 0.7112 | 0.4615 | 1.3415 | 1.6837 | 0.6210 | 0.8119 | 1.1492 | 1.2434 | 2.8311 | 0.9286 | 0.6974 | 1.2300 | 1.1308 | 1.3699 | 0.5110 | 0.9079 | 1.0787 | 0.6709 | 0.9378 | 1.2911 | 0.6647 | 0.8367 | 1.1390 | 0.6099 | 0.8080 | 0.3758 | 0.4360 | 0.6260 | 1.0274 | 0.5675 | 1.2949 | 0.8158 | 0.5121 | 0.3635 | 1.1522 | 0.4911 | 1.4254 | 0.5673 | 1.0841 | 0.4121 | 1.2129 | 1.0449 | 1.7073 | 1.2461 | 1.0602 | 1.2582 | 0.8753 | 0.8665 | 0.5193 | 1.1267 | 1.1114 | 0.4869 | 1.6940 | 2.0259 | 1.1089 | 0.7266 | 0.5362 | 1.3630 | 1.5354 | 0.8142 | 0.9427 |
| Guanidinoethyl-Sulfonate | 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 | 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 |
| His | 1.0294 | 0.9454 | 0.9492 | 1.3556 | 1.2248 | 1.2376 | 1.1414 | 0.9751 | 0.5430 | 1.2292 | 0.8375 | 0.7499 | 0.9716 | 0.8588 | 1.0077 | 1.0429 | 0.9271 | 0.8665 | 0.9089 | 1.0252 | 1.0107 | 0.4802 | 1.0357 | 1.0941 | 1.0892 | 0.9406 | 1.0295 | 1.0396 | 1.0041 | 1.1250 | 0.9627 | 1.1967 | 0.9759 | 0.9699 | 0.9298 | 0.8585 | 0.9262 | 1.2031 | 0.9580 | 1.0080 | 0.8339 | 1.0508 | 0.8787 | 0.9105 | 0.9563 | 0.8876 | 1.0177 | 1.0040 | 0.9446 | 0.9919 | 0.8928 | 1.1445 | 1.1848 | 0.8471 | 1.0034 | 1.1928 | 0.9108 | 1.2123 | 1.1314 | 0.9906 | 1.0229 | 1.0618 |
| Homo-Arg | 1.2492 | 1.0970 | 1.1781 | 0.9660 | 1.2502 | 1.5390 | 0.9983 | 1.0095 | 0.4483 | 0.8232 | 0.7759 | 0.6292 | 0.8120 | 1.1974 | 0.9668 | 1.0723 | 1.1428 | 1.0610 | 0.8258 | 0.7551 | 0.7862 | 0.5332 | 1.2856 | 0.9766 | 0.9998 | 1.0186 | 0.9329 | 0.6189 | 1.1512 | 0.6625 | 1.0579 | 0.7392 | 0.7812 | 0.8172 | 0.9158 | 0.8609 | 1.1388 | 1.9092 | 0.7823 | 1.1951 | 1.1448 | 0.5277 | 0.6747 | 0.8545 | 0.8597 | 1.4212 | 0.8248 | 1.1602 | 0.8106 | 0.9880 | 1.0581 | 1.1167 | 1.5110 | 0.7757 | 0.5964 | 0.6411 | 0.8038 | 1.2770 | 1.1569 | 0.7476 | 0.9512 | 0.8956 |
| Homoserine | 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 | 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 |
| Ile | 1.0217 | 1.1451 | 0.6838 | 0.5969 | 1.4865 | 1.0908 | 0.7749 | 0.8691 | 0.7028 | 1.1203 | 0.8823 | 0.7445 | 0.6187 | 0.8476 | 0.7215 | 0.7198 | 0.7134 | 1.8912 | 0.8293 | 0.9951 | 0.7916 | 1.6866 | 0.9172 | 0.9288 | 1.0484 | 1.5435 | 0.6944 | 0.9690 | 1.3878 | 0.9713 | 0.6214 | 1.1473 | 1.1936 | 0.6370 | 1.1659 | 1.1220 | 1.0502 | 1.0058 | 1.3135 | 1.2888 | 0.7056 | 0.7829 | 1.1991 | 0.7886 | 1.3733 | 1.5855 | 1.3318 | 1.5700 | 0.7888 | 0.8695 | 0.7326 | 0.7228 | 0.7432 | 1.0159 | 0.7755 | 0.9646 | 0.6200 | 1.1134 | 1.0217 | 0.8018 | 1.0805 | 1.2783 |
| Kynurenic-Acid | NA | 0.9078 | NA | NA | 0.4316 | NA | NA | NA | NA | NA | NA | 0.5904 | NA | NA | NA | NA | NA | 0.3383 | 0.1631 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.1610 | NA | NA | NA | 4.5125 | NA | NA | NA | NA | NA | NA | 0.9850 | 2.3305 | 0.1045 | NA | NA | 1.1019 | NA | NA | NA | NA | NA | NA | 0.3735 | NA | NA | NA | NA |
| kynurenine | 0.9470 | 1.1669 | 1.0784 | 1.1495 | 1.5474 | 0.8118 | 0.9218 | 0.5834 | 1.2487 | 0.7908 | 0.8069 | 0.6793 | 1.1047 | 1.2348 | 0.8453 | 0.6401 | 1.1191 | 1.0202 | 0.8355 | 0.8927 | 1.1972 | 1.3094 | 1.0344 | 1.3286 | 1.0380 | 1.3207 | 1.1786 | 0.8949 | 0.9802 | 0.9013 | 0.7309 | 0.6912 | 0.7018 | 0.8275 | 1.4708 | 1.2856 | 0.9969 | 1.0908 | 1.1858 | 1.3549 | 1.0122 | 0.8959 | 0.8125 | 1.2585 | 1.1870 | 1.4741 | 0.7047 | 1.3296 | 0.7289 | 0.9295 | 0.9892 | 0.7937 | 0.9075 | 0.9112 | 0.9114 | 0.7852 | 1.0319 | 1.2912 | 0.9727 | 0.6970 | 1.2111 | 0.6984 |
| L-Carnosine | 1.0056 | 1.0152 | 1.0249 | 1.0077 | 1.0452 | 1.0079 | 1.0212 | 1.0210 | NA | 0.9968 | 0.9845 | 0.9755 | 0.9739 | 0.9845 | 0.9841 | 0.9815 | 1.0122 | 1.0128 | 0.9871 | 0.9636 | 0.9557 | NA | 0.9855 | 0.9972 | 0.9940 | 1.0298 | 0.9830 | 0.9922 | 0.9924 | 1.0198 | 0.9884 | 0.9986 | 0.9896 | 0.9811 | 0.9898 | 0.9913 | 0.9887 | 1.0372 | 1.0489 | 1.0298 | 1.0174 | 0.9662 | 0.9565 | 0.9896 | 0.9947 | 0.9844 | 0.9994 | 1.0027 | 0.9706 | 1.0033 | 1.0232 | 1.0190 | 1.0155 | 0.9722 | NA | 1.0115 | 0.9909 | 1.0198 | 0.9924 | 0.9978 | 0.9990 | 1.0254 |
| L-Citrulline | 0.8864 | 1.0389 | 0.9643 | 1.5150 | 1.6027 | 1.2802 | 0.7937 | 0.9464 | 1.1770 | 0.8062 | 1.0540 | 0.9114 | 0.6731 | 1.5186 | 1.0678 | 0.9913 | 0.9923 | 1.2645 | 0.6711 | 0.9323 | 1.6352 | 0.4498 | 0.6734 | 0.9017 | 1.3144 | 0.7570 | 0.9407 | 0.8528 | 1.1359 | 0.9809 | 0.9235 | 0.7454 | 1.0684 | 1.4460 | 1.2290 | 0.8004 | 1.0578 | 0.8117 | 1.0864 | 0.8905 | 1.3787 | 1.1267 | 0.8987 | 0.7727 | 1.3389 | 1.4014 | 0.8368 | 0.8224 | 1.0910 | 1.0053 | 1.4178 | 0.6118 | 1.1786 | 0.8165 | 0.9068 | 1.0325 | 0.7542 | 1.1073 | 0.8351 | 0.8065 | 1.0785 | 1.0161 |
| L-Cystathionine | 0.8943 | 1.4856 | 1.6697 | 0.6606 | 1.4984 | 0.4436 | 0.2746 | 0.2780 | 0.3464 | 0.6112 | 0.9887 | 0.1677 | 0.9903 | 1.8194 | 0.8973 | 0.1536 | 1.3962 | 2.0294 | 0.2814 | 0.9676 | 0.2782 | 1.3092 | 0.8305 | 0.7121 | 0.4376 | 1.8461 | 0.9066 | 0.3975 | 0.8985 | 0.7380 | 0.2499 | 1.2720 | 0.6230 | 0.4889 | 1.5382 | 0.4965 | 0.8984 | 0.6023 | 1.0281 | 2.1086 | 0.9161 | NA | 2.3892 | 0.6031 | 2.7869 | 2.3443 | 1.1874 | 4.4555 | 0.0587 | 1.0236 | 0.7204 | 0.2291 | 0.3957 | 0.6583 | 0.6836 | 0.0617 | 1.3375 | 2.1153 | 1.8173 | 0.9021 | 1.1257 | 0.6255 |
| Leu | 0.9942 | 0.9409 | 0.7799 | 0.6706 | 1.6254 | 1.1939 | 0.9638 | 0.9053 | 0.6719 | 0.9994 | 0.8184 | 0.8137 | 0.7852 | 0.9321 | 0.8364 | 0.8516 | 0.6801 | 1.7366 | 0.8292 | 0.9840 | 0.7400 | 1.4318 | 1.0567 | 1.0002 | 1.1244 | 1.4770 | 0.7166 | 0.9615 | 1.2240 | 0.8867 | 0.6935 | 1.2314 | 1.0468 | 0.7724 | 1.0738 | 1.1234 | 0.9742 | 1.1838 | 1.1320 | 1.2062 | 0.6761 | 0.7657 | 1.1097 | 0.9615 | 1.2612 | 1.4288 | 1.2437 | 1.8551 | 0.7451 | 0.7857 | 0.8455 | 0.8777 | 0.8157 | 1.0572 | 0.9620 | 1.0975 | 0.6483 | 1.1747 | 0.9126 | 0.6751 | 1.0211 | 1.0636 |
| L-Homocitrulline | 0.9367 | 1.4617 | 0.6022 | 1.3966 | 1.3058 | 0.7815 | 1.4111 | 0.9970 | 0.7122 | 1.0330 | 0.9404 | 0.9573 | 0.5286 | 2.1957 | 0.7641 | 0.5270 | 1.4479 | 0.3477 | 0.7716 | 1.0290 | 0.8758 | 0.2313 | 0.7882 | 0.9645 | 1.2307 | 1.1001 | 1.1955 | 0.4846 | 0.9967 | 0.7223 | 0.5341 | 0.5756 | 0.9511 | 0.7853 | 0.7363 | 0.8120 | 1.9231 | 0.7926 | 0.6334 | 1.1296 | 1.3230 | 0.3771 | 1.4709 | 2.2748 | 1.0861 | 0.7700 | 1.4497 | 3.9544 | 0.5075 | 0.8253 | 1.0820 | 0.8274 | 0.8509 | 0.4322 | 0.6335 | 0.5592 | 1.2240 | 1.5315 | 0.8359 | 0.8333 | 1.0836 | 1.0279 |
| L-Homocystine | 3.1710 | NA | 0.6643 | NA | 0.5756 | NA | NA | NA | NA | NA | 0.4061 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.4601 | 0.4207 | 0.7174 | NA | 0.6925 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.3735 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.3480 | NA | NA | NA |
| L-Ornithine | 0.6441 | 1.2634 | 1.1312 | 1.4369 | 1.4202 | 0.9654 | 1.1765 | 1.0555 | 0.4271 | 1.1202 | 0.8069 | 0.6030 | 0.9779 | 0.8372 | 0.8111 | 0.6618 | 0.8783 | 1.4414 | 1.9090 | 0.8495 | 1.1012 | 0.4133 | 0.8734 | 1.1826 | 1.1440 | 1.3325 | 0.7115 | 0.9123 | 1.0870 | 1.2320 | 0.9486 | 0.5834 | 1.0152 | 0.9730 | 1.3209 | 1.0439 | 0.7941 | 1.4447 | 0.9386 | 1.1857 | 0.9428 | 0.8233 | 0.8803 | 1.2279 | 1.6519 | 1.4913 | 1.2241 | 1.8576 | 0.6720 | 0.8965 | 1.5980 | 0.6796 | 0.9733 | 1.2740 | 0.7011 | 1.5149 | 1.2844 | 1.2723 | 1.1071 | 0.7600 | 0.7446 | 0.9718 |
| L-Pipecolic-Acid | 0.8148 | 0.8066 | 1.1055 | 0.7342 | 0.8850 | 1.1694 | 0.8427 | 0.4521 | 1.1893 | 0.8678 | 0.7873 | 0.8281 | 0.9443 | 1.1101 | 0.6842 | 0.6016 | 1.2222 | 0.8508 | 0.9690 | 0.9791 | 1.4179 | 1.6092 | 0.7172 | 0.8511 | 1.9609 | 0.9217 | 0.9783 | 0.7489 | 0.9348 | 0.7857 | 1.7703 | 1.7075 | 0.6221 | 0.7057 | 0.9379 | 1.2134 | 1.4003 | 0.9410 | 1.0584 | 0.5453 | 0.4973 | 0.6860 | 0.9663 | 1.1369 | 1.0827 | 3.2248 | 1.8447 | 0.6953 | 0.7044 | 1.0256 | 1.2111 | 0.7266 | 0.5423 | 1.0985 | 2.0387 | 1.0187 | 1.8141 | 0.7970 | 0.5281 | 0.5995 | 1.1585 | 0.5983 |
| L-Theanine | 0.3344 | NA | 0.5021 | NA | 0.4562 | NA | 2.3295 | NA | NA | NA | NA | NA | NA | NA | 1.7174 | NA | 2.4342 | NA | NA | NA | 3.0358 | NA | NA | NA | 0.3528 | 0.3311 | NA | NA | NA | NA | NA | 0.3212 | 0.2802 | NA | NA | NA | NA | NA | 3.1755 | NA | NA | NA | 0.7228 | 1.4484 | NA | 0.3501 | NA | 0.4361 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.2399 | NA | 0.2731 | NA | 0.2593 |
| L-tyrosine-methyl-ester | 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 | 1.0000 | 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 |
| Lys | 0.9384 | 1.2172 | 1.1694 | 0.8312 | 1.2677 | 0.9972 | 1.3656 | 0.8143 | 0.4081 | 0.7695 | 0.8892 | 0.6712 | 1.0344 | 1.0350 | 1.0842 | 0.8951 | 0.8415 | 1.1942 | 0.9820 | 0.8272 | 0.9005 | 0.7387 | 1.1565 | 1.1011 | 1.1287 | 1.3403 | 0.8230 | 0.5809 | 1.2288 | 1.0746 | 1.0306 | 1.0692 | 0.9283 | 0.9998 | 1.0405 | 1.1783 | 0.9370 | 1.2385 | 0.7798 | 1.1315 | 0.6108 | 0.6762 | 0.9860 | 0.9598 | 1.1757 | 1.0871 | 1.1873 | 1.5812 | 0.9040 | 0.9217 | 1.2239 | 0.8605 | 0.7964 | 1.0507 | 1.1246 | 1.1535 | 1.0157 | 1.4826 | 1.2268 | 0.7935 | 1.1220 | 0.9755 |
| Met | 1.0318 | 1.2327 | 0.8192 | 0.5233 | 1.4162 | 0.9150 | 1.3618 | 0.9035 | 0.6371 | 0.6965 | 0.6495 | 0.5080 | 0.7716 | 1.0999 | 0.9406 | 0.7649 | 0.5943 | 1.5867 | 0.6108 | 0.9466 | 1.1411 | 2.1191 | 0.9963 | 0.9373 | 1.0276 | 1.3990 | 0.7996 | 1.0820 | 1.2879 | 1.0458 | 0.7151 | 1.1541 | 0.7630 | 0.8686 | 1.1788 | 0.9041 | 1.0057 | 1.3309 | 1.1748 | 1.1122 | 0.7642 | 0.8603 | 0.7157 | 0.8772 | 1.3900 | 1.3280 | 1.4069 | 1.2359 | 0.8212 | 1.0051 | 0.7683 | 0.9506 | 0.8920 | 1.0422 | 1.0300 | 0.7367 | 0.7014 | 1.1018 | 1.4488 | 0.7285 | 1.1206 | 0.7357 |
| Methionine-Sulfoxide | 0.8210 | 1.1927 | 1.0129 | 0.9397 | 1.0704 | 0.7163 | 0.8875 | 0.8732 | 0.7600 | 1.0249 | 0.9973 | 0.7666 | 0.8655 | 1.0637 | 0.8222 | 0.6812 | 1.2760 | 1.4416 | 0.9579 | 0.9736 | 1.2210 | 1.1561 | 1.1170 | 1.0518 | 0.9742 | 1.1768 | 1.0429 | 1.0529 | 0.9953 | 0.9773 | 0.7736 | 0.9381 | 0.9911 | 0.9737 | 1.2810 | 0.7825 | 0.8654 | 1.0960 | 1.1575 | 0.9962 | 1.0037 | 1.1620 | 0.9283 | 1.4153 | 1.2851 | 1.2107 | 1.4441 | 1.3978 | 1.0881 | 1.0940 | 0.8520 | 0.8304 | 0.8360 | 1.0371 | 1.0653 | 0.9678 | 0.7638 | 0.8174 | 1.5520 | 0.9469 | 1.1750 | 0.9736 |
| N6-Acetyl-L-Lysine | 0.8900 | 0.9797 | 0.8283 | 0.9270 | 1.2306 | 0.8712 | 1.0806 | 0.8124 | 1.1844 | 1.1575 | 0.8912 | 0.6626 | 0.9434 | 1.0216 | 0.8217 | 0.7277 | 1.0931 | 1.4818 | 1.0885 | 1.0993 | 1.1223 | 1.5982 | 0.8182 | 1.0115 | 0.8431 | 1.1815 | 0.9331 | 1.1047 | 1.0466 | 0.9643 | 0.7574 | 0.8443 | 0.8525 | 0.8047 | 0.9976 | 1.0441 | 1.0254 | 0.8165 | 1.5198 | 0.9615 | 0.8928 | 1.1467 | 1.0460 | 1.2538 | 1.1527 | 1.5128 | 1.3725 | 1.4574 | 0.7811 | 0.9759 | 1.0923 | 0.7177 | 0.8761 | 1.0027 | 0.9781 | 0.8482 | 0.8406 | 1.0002 | 1.1506 | 0.7256 | 1.2494 | 0.8774 |
| N8-Acetylspermidine | 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 | 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 |
| N-Acetylaspartate | 1.0176 | 0.9342 | 1.0217 | 1.5666 | 1.0364 | 0.7152 | 1.3002 | 0.8317 | 1.1530 | 0.9632 | 1.2576 | 1.1869 | 0.9029 | 1.3081 | 1.0193 | 0.7891 | 0.6853 | 0.9625 | 0.5739 | 1.1248 | 1.4247 | 1.2531 | 0.6838 | 0.7958 | 0.8186 | 0.8685 | 1.1402 | 1.3845 | 0.9686 | 1.4621 | 1.0297 | 0.8185 | 1.0141 | 1.4756 | 1.3764 | 0.6769 | 0.7592 | 0.5659 | 0.6510 | 0.6633 | 1.0446 | 1.1644 | 1.0600 | 1.3059 | 1.0906 | 0.7913 | 1.5135 | 0.7331 | 0.8792 | 0.7976 | 1.1374 | 1.0007 | 0.7729 | 0.8944 | 1.2628 | 0.7834 | 1.0884 | 0.9361 | 0.7142 | 0.7784 | 1.0779 | 0.8344 |
| N-Acetyl-L-Tyrosine | 0.9912 | 1.5531 | 0.5425 | 0.3916 | 1.2370 | 1.4621 | 0.7970 | 1.0553 | 0.9040 | 0.6585 | 0.3085 | 0.8893 | 0.7515 | 0.5328 | 0.8531 | 0.6515 | 0.3552 | 1.7589 | 0.3142 | 1.2112 | 0.7975 | 1.9041 | 1.3073 | 1.2500 | 1.3117 | 1.8668 | 0.5542 | 1.1952 | 1.3501 | 0.6882 | 1.2395 | 1.0187 | 0.2792 | 0.6625 | 1.4151 | 1.2243 | 0.6819 | 0.8456 | 1.7853 | 1.2633 | 1.4462 | 1.0170 | 0.3701 | 1.1794 | 1.3250 | 1.7239 | 0.8910 | 0.9779 | 1.2647 | 0.8851 | 0.4940 | 1.6308 | 1.4206 | 1.5222 | 0.9926 | 0.8433 | 0.4662 | 1.1326 | 0.6225 | 0.4418 | 1.1352 | 0.4388 |
| N-Acetylneuraminic-Acid | 0.8361 | 0.7356 | 0.8280 | 1.0035 | 1.4780 | 0.7717 | 1.2634 | 0.9407 | 0.7760 | 1.4035 | 0.8741 | 0.8122 | 1.1475 | 0.9431 | 0.7745 | 0.8754 | 1.1151 | 1.0218 | 0.9294 | 0.7740 | 1.0861 | 0.5297 | 0.8257 | 0.8804 | 0.8623 | 0.9193 | 0.8657 | 0.8251 | 0.7899 | 1.0479 | 0.7202 | 0.8604 | 0.8244 | 0.9347 | 0.9867 | 0.9787 | 0.8317 | 0.9498 | 0.8387 | 0.9623 | 0.9841 | 0.6626 | 0.7188 | 1.8751 | 0.7623 | 1.0213 | 1.0584 | 1.1679 | 6.2262 | 0.7833 | 1.0897 | 0.9031 | 0.7098 | 0.8891 | 1.0099 | 1.0347 | 0.9455 | 1.0158 | 0.8545 | 0.7407 | 1.3204 | 0.8785 |
| N^-Formylkynurenine | 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 | 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 |
| N-Glycyl-L-Leucine | 0.1860 | 0.9200 | 0.5747 | 1.9697 | 1.7053 | NA | 1.0989 | 1.3108 | 0.4771 | 1.5671 | 0.4342 | 1.0532 | 0.9661 | 1.2891 | 0.0518 | 0.3193 | 1.0523 | 0.9789 | 0.9380 | 1.6459 | 2.1324 | 1.1337 | 0.9420 | 1.2515 | 1.4229 | 0.5572 | NA | 1.3282 | 0.0627 | 3.3688 | 0.2962 | 0.6669 | 1.3001 | 0.8083 | 0.4385 | 1.1766 | 0.0265 | 1.5915 | 1.3979 | 1.4905 | NA | 0.0449 | 1.2489 | 2.0642 | 1.3903 | 0.8039 | 2.0368 | 0.7666 | 0.6433 | 0.2559 | 0.8867 | 1.8501 | 0.1083 | 2.9362 | 1.5122 | 2.8108 | 1.0659 | 0.6340 | 1.4664 | 0.7331 | 0.8533 | 1.4696 |
| Nicotinuric-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 | 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 |
| N,N-Dimethylglycine | 0.9130 | 1.1247 | 0.8383 | 1.3396 | 1.2115 | 0.6216 | 0.8521 | 0.7426 | 0.6947 | 1.0803 | 0.6883 | 0.8756 | 0.9323 | 0.7224 | 1.0849 | 0.6946 | 1.2013 | 2.7098 | 0.9407 | 0.9277 | 0.7680 | 1.1420 | 0.8350 | 1.0222 | 1.0065 | 0.9279 | 0.8882 | 1.1009 | 1.5675 | 1.1256 | 0.6923 | 0.7697 | 0.8430 | 0.6779 | 1.3435 | 1.2252 | 0.7742 | 0.9341 | 0.9472 | 1.2745 | 1.8049 | 0.8727 | 0.9051 | 1.3588 | 1.5606 | 1.5922 | 0.9393 | 1.5017 | 0.7667 | 1.3604 | 0.8251 | 0.7862 | 1.1494 | 0.7832 | 0.8821 | 0.4973 | 0.7749 | 1.0675 | 0.8204 | 0.4712 | 1.1430 | 0.8594 |
| Nα-Acetyl-L-Arginine | 1.0315 | 2.1510 | 0.8081 | 1.2253 | 1.6165 | 1.2992 | 0.5463 | 0.9130 | 0.8363 | 1.0175 | 0.8614 | 0.5595 | 0.7279 | 1.2422 | 1.0299 | 0.6385 | 0.8206 | 1.1906 | 0.5136 | 0.6670 | 1.3290 | 0.4019 | 0.9646 | 0.9288 | 1.0350 | 0.9974 | 0.6869 | 0.7529 | 0.9959 | 0.7053 | 0.8621 | 1.0713 | 0.7734 | 1.1133 | 1.1411 | 1.0076 | 1.2707 | 1.3743 | 0.8059 | 1.2877 | 1.3324 | 0.8723 | 0.9988 | 0.4434 | 0.8122 | 1.1189 | 0.7893 | 0.7044 | 1.0823 | 1.0621 | 1.2601 | 0.7484 | 1.2819 | 0.9439 | 0.6522 | 0.8496 | 1.6153 | 0.9782 | 1.4060 | 1.2432 | 1.3217 | 0.9992 |
| Nα-Acetyl-L-glutamine | 0.7676 | 1.8778 | 0.6305 | 0.4593 | 0.7679 | 1.9468 | 0.1427 | 1.5615 | 2.1309 | 0.4669 | 0.8551 | 1.3413 | 0.6594 | 0.9628 | 1.9637 | 1.1775 | 0.8609 | 1.0298 | 0.3604 | 1.3159 | 1.0025 | 1.8458 | 1.2718 | 0.9231 | 2.0722 | 0.7678 | 0.5372 | 1.0593 | 0.9526 | 0.8609 | 1.5481 | 0.8728 | 0.6535 | 0.4490 | 1.0121 | 0.9388 | 1.3329 | 1.0616 | 1.9363 | 1.2154 | 1.0066 | 1.7739 | 0.4264 | 1.3992 | 0.5447 | 0.6951 | 0.5726 | 0.6774 | 0.6745 | 1.2289 | 0.3126 | 0.8632 | 1.6932 | 1.0402 | 2.1278 | 0.7486 | 0.4164 | 1.5127 | 0.3779 | 0.7574 | 0.7150 | 0.7033 |
| O-Phospho-L-Serine | 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 | 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 |
| P-Aminohippuric-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 | 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 |
| Phe | 0.9287 | 1.0605 | 0.7084 | 0.9463 | 1.4425 | 0.9452 | 1.0021 | 0.9179 | 1.0259 | 1.1716 | 0.7281 | 0.7977 | 0.8339 | 1.0023 | 0.8023 | 0.7277 | 0.9927 | 1.4616 | 0.8100 | 1.1877 | 1.1729 | 1.2642 | 0.9945 | 1.1148 | 1.0650 | 1.1647 | 0.8036 | 1.2304 | 1.1573 | 0.9671 | 0.7204 | 1.0716 | 0.6882 | 0.9295 | 0.9611 | 0.9715 | 0.8303 | 1.1461 | 1.0946 | 1.0159 | 0.8149 | 0.9750 | 0.9500 | 1.1375 | 1.4724 | 1.3940 | 1.2888 | 1.4390 | 0.8460 | 0.9182 | 0.9313 | 0.9471 | 0.8054 | 1.2798 | 1.1425 | 0.9898 | 0.8019 | 0.9959 | 1.0843 | 0.6530 | 1.1613 | 0.7572 |
| Phosphorylethanolamine | 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 | 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 |
| Pro | 0.9322 | 0.8597 | 0.6548 | 1.0354 | 1.4826 | 1.6751 | 0.7048 | 0.7465 | 0.7308 | 0.8588 | 1.2340 | 0.4309 | 0.8082 | 0.9098 | 0.6626 | 0.8140 | 0.7057 | 1.6991 | 1.5749 | 1.0780 | 1.1244 | 1.3043 | 0.8944 | 0.9336 | 0.8055 | 1.2135 | 0.9035 | 1.4540 | 1.0676 | 0.7832 | 0.6994 | 1.0132 | 1.0353 | 0.9612 | 1.1532 | 0.7584 | 1.0100 | 0.8523 | 1.5646 | 0.8871 | 0.8748 | 1.1093 | 0.7933 | 1.2209 | 1.8596 | 1.3228 | 0.7947 | 1.1991 | 1.1796 | 0.9303 | 0.7415 | 0.6748 | 0.8029 | 0.9426 | 0.9446 | 0.9206 | 1.2419 | 0.9300 | 0.7947 | 0.8784 | 1.4428 | 0.9951 |
| S-(5-Adenosyl)-L-Homocysteine | 1.3422 | 0.8485 | 0.9343 | 1.2217 | 1.4838 | 0.9270 | 0.9838 | 1.0331 | 0.7882 | 1.0680 | 0.9308 | 0.8151 | 0.8356 | 0.8824 | 0.8550 | 0.7970 | 0.9294 | 1.0499 | 0.8749 | 0.8758 | 0.8979 | 0.6986 | 0.9388 | 1.0116 | 1.0461 | 0.9534 | 0.9151 | 0.8030 | 1.0188 | 1.0338 | 0.8348 | 0.9311 | 0.9134 | 0.8270 | 0.9049 | 0.9091 | 0.8801 | 0.9514 | 0.8931 | 1.0901 | 0.8999 | 0.7264 | 0.8096 | 0.8750 | 0.9699 | 0.9909 | 1.0265 | 1.2249 | 0.7688 | 0.8130 | 1.2548 | 0.9477 | 1.0100 | 0.8996 | 0.8846 | 1.0173 | 1.0795 | 1.0894 | 0.9252 | 0.9417 | 0.9433 | 0.8931 |
| Sarcosine | 0.8663 | 1.1266 | 0.6532 | 0.8012 | 1.1888 | 0.6735 | 1.1837 | NA | NA | 1.0142 | 0.6546 | 0.9311 | 0.8613 | 1.1143 | 1.0180 | 0.9513 | 0.6686 | 1.4525 | 0.9872 | 0.8788 | NA | 1.6671 | 0.7092 | 0.7688 | 0.9101 | 1.0060 | 0.7904 | 0.9639 | 0.8948 | 0.9539 | 0.6647 | 0.8782 | 0.9770 | 0.8439 | 1.5189 | 1.0319 | 0.7587 | 1.1417 | 0.9958 | 1.3553 | 0.8546 | 0.8682 | 2.0006 | 1.3717 | 1.1533 | 1.3532 | 1.6533 | 1.4676 | 1.1675 | 1.6423 | 0.8361 | NA | 0.7475 | NA | 0.7909 | 0.8073 | 0.8669 | 1.1007 | 1.1280 | 0.4757 | 1.1155 | 0.9473 |
| Ser | 1.1441 | 0.8863 | 1.1476 | 0.8479 | 1.1909 | 0.6497 | 1.2938 | 1.3023 | 0.7692 | 1.0141 | 0.9845 | 0.9272 | 0.9282 | 0.7712 | 0.9905 | 1.0475 | 0.8072 | 1.0635 | 0.9339 | 0.9366 | 1.2513 | 1.2847 | 0.8953 | 1.0591 | 0.9309 | 0.8844 | 0.9128 | 1.3365 | 0.8013 | 1.1250 | 0.9313 | 0.7609 | 0.9553 | 0.8659 | 0.7435 | 0.8863 | 0.9136 | 1.0268 | 0.8390 | 0.9610 | 0.7831 | 1.0210 | 0.9151 | 1.0708 | 1.1698 | 0.7522 | 1.1357 | 1.0161 | 0.8378 | 0.8263 | 1.0893 | 0.7958 | 0.7219 | 1.1276 | 1.3381 | 1.0881 | 1.1046 | 0.7583 | 1.2574 | 0.9367 | 0.9420 | 1.0143 |
| S-Sulfo-L-Cysteine | 0.8241 | 1.0967 | 0.9840 | 1.0684 | 1.2359 | 0.8729 | 0.5548 | 0.6667 | 0.9849 | 1.0878 | 0.9219 | 1.3261 | 1.2521 | 1.0129 | 0.9054 | 0.9147 | 1.3456 | 0.6249 | 0.8046 | 0.8540 | 1.0489 | 1.0370 | 0.6426 | 0.7259 | 1.1878 | 1.2028 | 0.6221 | 0.6500 | 1.0226 | 0.7792 | 0.6840 | 0.7141 | 1.2510 | 1.1016 | 0.8486 | 1.0324 | 1.1723 | 0.6693 | 0.9338 | 0.9936 | 0.4668 | 0.7223 | 1.0328 | 1.1120 | 0.8077 | 1.1806 | 1.2407 | 4.3247 | 1.0746 | 1.1953 | 1.1872 | 0.9270 | 0.5940 | 1.9876 | 1.0774 | 1.8416 | 0.8123 | 1.1645 | 0.5417 | 0.5779 | 0.8523 | 1.2035 |
| Succinic-Acid | 0.9486 | 0.8225 | 1.7330 | 2.3743 | 0.6424 | 0.4206 | 1.5603 | 0.3921 | 0.3950 | 1.3198 | 0.8079 | 0.9944 | 1.6249 | 2.1219 | 0.8322 | 1.3605 | 2.0689 | 0.6034 | 1.3187 | 2.1494 | 0.6859 | 0.2888 | 0.6652 | 0.6470 | 0.6877 | 0.7040 | 1.2191 | 1.1313 | 0.7897 | 0.4123 | 0.7583 | 0.8819 | 1.1352 | 2.2424 | 1.1675 | 1.2541 | 0.8691 | 0.5595 | 1.0486 | 0.8958 | 0.7642 | 0.5426 | 2.0257 | 0.6921 | 0.9996 | 1.0654 | 1.5301 | 1.2780 | 0.9971 | 0.8686 | 0.7790 | 0.7158 | 0.8889 | 0.3630 | 0.4242 | 0.8442 | 1.1674 | 0.8121 | 0.5958 | 0.7074 | 0.6936 | 1.1739 |
| (S)-β-Aminoisobutyric-Acid | 0.9028 | 0.6713 | 0.9469 | 1.0910 | 1.4790 | 0.4983 | 2.0781 | 1.3491 | 0.6508 | 0.7139 | 1.5475 | 0.6986 | 0.6418 | 1.2502 | 0.4414 | 1.1382 | 1.3243 | 0.7820 | 0.5958 | 1.5098 | 1.0190 | 0.7225 | 0.7101 | 1.0864 | 1.1461 | NA | 1.4766 | 2.0105 | 0.9695 | 0.9371 | 1.1997 | 0.3148 | 0.7118 | 0.7705 | 2.3211 | 2.0179 | 0.6134 | 0.6963 | 1.9867 | 0.7881 | NA | 0.5514 | 0.8033 | 1.2578 | 1.3711 | 1.4819 | 1.1882 | 1.8787 | 0.3020 | 0.9557 | 0.7100 | 0.5554 | 0.7445 | 0.5030 | 0.9716 | 0.8110 | 0.8284 | 0.5180 | 1.1136 | 0.4188 | 1.2528 | 0.8488 |
| Thr | 1.0601 | 1.0644 | 1.1676 | 0.8778 | 1.1978 | 0.7924 | 0.9406 | 0.8630 | 0.6298 | 0.7367 | 0.9179 | 0.5040 | 0.7987 | 0.9376 | 1.2035 | 0.8918 | 0.6955 | 1.3155 | 0.9229 | 0.9334 | 1.3044 | 1.8490 | 1.0001 | 0.9506 | 0.8998 | 1.1978 | 0.9714 | 1.1355 | 0.9014 | 1.0072 | 0.8088 | 0.9563 | 0.9194 | 0.8495 | 0.8023 | 0.8349 | 1.2653 | 1.2433 | 0.9296 | 1.0274 | 0.9520 | 0.8059 | 0.8678 | 0.9067 | 1.0738 | 0.8570 | 1.0101 | 1.0309 | 1.1640 | 0.9123 | 1.0507 | 0.7548 | 1.0584 | 1.1184 | 0.8836 | 0.9297 | 1.1283 | 0.9358 | 1.7185 | 1.1524 | 0.8908 | 0.9519 |
| Trans-4-Hydroxy-L-Proline | 0.8257 | 1.1066 | 0.8502 | 0.4268 | 1.6867 | 0.9762 | 1.1962 | 1.7113 | 0.7640 | 1.2365 | 1.0896 | 0.6253 | 0.8514 | 1.9916 | 0.8073 | 0.4772 | 1.1135 | 1.9091 | 0.9842 | 1.4619 | 1.9666 | 1.6496 | 0.6206 | 0.7668 | 1.2505 | 1.6612 | 0.7137 | 0.7842 | 0.4702 | 0.7112 | 0.9709 | 0.7122 | 0.8256 | 0.6944 | 1.5557 | 1.1018 | 2.1950 | 0.7056 | 0.9617 | 1.0039 | 0.8534 | 0.5135 | 2.0275 | 1.4059 | 0.8815 | 0.7052 | 1.0047 | 1.4783 | 0.5117 | 0.7231 | 0.4968 | 0.5804 | 0.7174 | 0.8723 | 0.4794 | 1.3377 | 1.3346 | 0.9860 | 0.8090 | 0.4840 | 1.0904 | 0.8626 |
| Trimethylamine-N-Oxide | 0.7218 | 1.0554 | 0.4856 | 1.3756 | 3.2765 | 0.4899 | 0.9444 | 0.0196 | 0.8459 | 0.6278 | 1.6531 | 0.9486 | 0.9076 | 2.2351 | 1.0631 | 0.1737 | 1.9630 | 5.0645 | 0.9024 | 0.3376 | 1.0030 | 1.0021 | 0.6703 | 0.8357 | 1.5964 | 1.8823 | 1.1190 | 0.7248 | 1.2353 | 0.5157 | 2.5860 | 0.8459 | 1.4868 | 0.5600 | 0.5264 | 0.4342 | 0.5626 | 0.4111 | 0.7608 | 0.7428 | 0.5303 | 0.4360 | 0.9655 | 1.6665 | 0.5108 | 2.5352 | 0.3000 | 2.7059 | 1.3260 | 0.7787 | 1.1350 | 0.4666 | 0.0889 | 0.2737 | 0.3643 | 0.7035 | 0.4068 | 0.9714 | 0.7237 | 0.3168 | 1.1283 | 1.5779 |
| Trp | 0.9832 | 0.9913 | 0.8266 | 0.8346 | 1.2190 | 0.9563 | 1.0122 | 0.7979 | 0.9642 | 0.8609 | 0.7448 | 0.7260 | 0.8332 | 0.9972 | 0.9150 | 0.7913 | 0.8345 | 1.1192 | 0.7024 | 1.1327 | 1.1353 | 1.3188 | 1.0140 | 1.1363 | 1.0871 | 1.2834 | 1.1413 | 0.8692 | 1.2047 | 1.2043 | 0.8993 | 1.3957 | 1.0065 | 0.7775 | 1.2348 | 1.1177 | 1.0244 | 1.1234 | 1.0475 | 1.1095 | 0.9573 | 0.8636 | 0.8637 | 1.0017 | 1.1731 | 1.2656 | 1.2100 | 1.0496 | 1.0265 | 0.9755 | 0.7315 | 0.8679 | 0.9338 | 1.1146 | 0.8910 | 0.9122 | 0.8969 | 1.0879 | 1.0420 | 0.7405 | 1.1519 | 1.0210 |
| TRP-GLU | 1.3005 | NA | 0.3710 | 1.5888 | 1.4540 | 0.6889 | 0.8021 | 0.6805 | NA | 1.3799 | 0.3740 | 0.5847 | 2.5125 | 0.5181 | 0.5652 | 0.4705 | 0.5442 | 1.0553 | 0.7672 | 0.4582 | 1.3645 | NA | 0.8850 | 0.9335 | 0.8881 | NA | NA | 0.7318 | NA | 0.4774 | NA | NA | NA | 0.6809 | NA | 0.9557 | 0.3342 | 1.3782 | 1.0884 | 0.8272 | NA | NA | 0.8080 | 1.4231 | 0.7929 | 0.6463 | 1.9982 | 1.4717 | NA | 0.2918 | 1.4340 | NA | NA | 1.8210 | 1.2050 | 0.6859 | NA | NA | 0.7557 | 0.6015 | NA | NA |
| Tyr | 0.9339 | 0.9867 | 0.9273 | 0.8224 | 1.5389 | 1.0829 | 1.0686 | 0.8995 | 0.9242 | 0.8900 | 0.7084 | 0.6683 | 0.9726 | 0.8053 | 0.8296 | 0.7891 | 1.1405 | 1.2186 | 0.8071 | 1.2275 | 1.0841 | 1.5639 | 1.1117 | 1.0334 | 0.8979 | 1.3781 | 0.7137 | 1.1091 | 1.1152 | 0.9027 | 0.8422 | 0.9970 | 0.6167 | 1.0008 | 1.2133 | 1.0875 | 0.8075 | 1.1834 | 1.1888 | 1.0822 | 1.0194 | 0.7296 | 0.7167 | 0.9905 | 1.6548 | 1.4878 | 1.0760 | 1.4047 | 1.2282 | 0.8291 | 0.8139 | 1.1652 | 0.9966 | 1.2541 | 0.8599 | 0.9228 | 0.8014 | 0.9129 | 1.2647 | 0.6286 | 1.0552 | 0.6128 |
| Urea | 0.8082 | 1.2671 | 0.7385 | 1.1539 | 1.3816 | 0.9237 | 1.0862 | 0.7871 | 0.8630 | 0.9895 | 1.1315 | 1.3555 | 1.2008 | 1.7000 | 0.7796 | 0.9095 | 1.2988 | 0.9422 | 1.1647 | 1.4121 | 0.8529 | 1.2042 | 0.7309 | 1.1048 | 1.2022 | 1.0978 | 1.0248 | 1.0326 | 1.0130 | 1.2027 | 0.8836 | 0.8171 | 0.9712 | 1.0705 | 1.1294 | 1.0362 | 1.2907 | 1.0323 | 1.1101 | 0.9644 | 0.9527 | 0.9471 | 1.4507 | 1.0022 | 1.0731 | 1.1673 | 1.0109 | 1.0260 | 0.9853 | 1.0372 | 0.9622 | 0.9085 | 0.9539 | 0.6408 | 0.7088 | 0.8825 | 0.8347 | 1.2517 | 0.6611 | 0.5285 | 1.1078 | 0.9690 |
| Val | 0.9629 | 1.0574 | 0.7294 | 0.6817 | 1.4593 | 1.1667 | 0.8826 | 0.8979 | 0.8815 | 1.1414 | 0.8681 | 0.8031 | 0.7660 | 1.0907 | 0.7402 | 0.7782 | 0.8196 | 1.7170 | 0.8058 | 1.1399 | 0.7454 | 1.4657 | 1.1159 | 0.8982 | 1.1815 | 1.4618 | 0.7958 | 0.7907 | 1.1940 | 0.9155 | 0.7333 | 1.1476 | 1.2120 | 0.7596 | 1.2941 | 1.1060 | 1.0050 | 1.1594 | 1.0523 | 1.1904 | 0.7160 | 0.7006 | 1.1113 | 1.0514 | 1.1612 | 1.2611 | 1.1189 | 1.5436 | 0.8657 | 0.8216 | 0.7915 | 0.7723 | 0.8179 | 1.1381 | 0.9145 | 1.1832 | 0.6947 | 1.1560 | 0.9020 | 0.7685 | 1.0254 | 1.2042 |
| α-Aminoadipic-acid | 0.7535 | 0.8029 | 0.7037 | 0.6209 | 1.4283 | 0.8904 | 0.6813 | 0.5347 | 0.5891 | 1.2467 | 0.6592 | 0.6558 | 0.5302 | 0.9108 | 0.7730 | 0.4794 | 0.9733 | 2.6726 | 0.8495 | 0.9233 | 0.8528 | 1.6999 | 0.8569 | 0.9195 | 1.2741 | 1.5517 | 0.5634 | 0.4075 | 1.2299 | 0.7425 | 0.7698 | 0.6442 | 0.8135 | 0.6076 | 1.4961 | 1.8156 | 1.1048 | 1.6066 | 0.7664 | 1.6090 | 0.7866 | 0.5644 | 1.5421 | 1.1353 | 1.4822 | 2.8613 | 1.9103 | 2.5008 | 0.7315 | 1.0306 | 0.7710 | 0.8171 | 0.7930 | 1.0388 | 0.6621 | 0.9944 | 0.8134 | 1.2524 | 0.6399 | 0.4678 | 1.6340 | 0.7784 |
| γ-Aminobutyric-Acid | 0.4611 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.3767 | 1.2451 | NA | NA | NA | NA | NA | NA | NA | 2.9935 | 0.8088 | NA | NA | NA | NA | NA | NA | 0.5210 | NA | NA | 1.3048 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.5739 | NA | 0.7151 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| γ-Glutamate-Cysteine | 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 | 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 |
Factors:
| F1 | Sample source:serum | Group1:HC | Group2:1 |
| F2 | Sample source:serum | Group1:IBS-C-10 | Group2:1 |
| F3 | Sample source:serum | Group1:IBS-C-11 | Group2:1 |
| F4 | Sample source:serum | Group1:IBS-C-12 | Group2:1 |
| F5 | Sample source:serum | Group1:IBS-C-13 | Group2:1 |
| F6 | Sample source:serum | Group1:IBS-C-14 | Group2:1 |
| F7 | Sample source:serum | Group1:IBS-C-15 | Group2:1 |
| F8 | Sample source:serum | Group1:IBS-C-16 | Group2:1 |
| F9 | Sample source:serum | Group1:IBS-C-1 | Group2:1 |
| F10 | Sample source:serum | Group1:IBS-C-2 | Group2:1 |
| F11 | Sample source:serum | Group1:IBS-C-3 | Group2:1 |
| F12 | Sample source:serum | Group1:IBS-C-4 | Group2:1 |
| F13 | Sample source:serum | Group1:IBS-C-5 | Group2:1 |
| F14 | Sample source:serum | Group1:IBS-C-6 | Group2:1 |
| F15 | Sample source:serum | Group1:IBS-C-7 | Group2:1 |
| F16 | Sample source:serum | Group1:IBS-C-8 | Group2:1 |
| F17 | Sample source:serum | Group1:IBS-C-9 | Group2:1 |
| F18 | Sample source:serum | Group1:IBS-D-10 | Group2:1 |
| F19 | Sample source:serum | Group1:IBS-D-11 | Group2:1 |
| F20 | Sample source:serum | Group1:IBS-D-12 | Group2:1 |
| F21 | Sample source:serum | Group1:IBS-D-13 | Group2:1 |
| F22 | Sample source:serum | Group1:IBS-D-14 | Group2:1 |
| F23 | Sample source:serum | Group1:IBS-D-15 | Group2:1 |
| F24 | Sample source:serum | Group1:IBS-D-16 | Group2:1 |
| F25 | Sample source:serum | Group1:IBS-D-17 | Group2:1 |
| F26 | Sample source:serum | Group1:IBS-D-18 | Group2:1 |
| F27 | Sample source:serum | Group1:IBS-D-19 | Group2:1 |
| F28 | Sample source:serum | Group1:IBS-D-1 | Group2:1 |
| F29 | Sample source:serum | Group1:IBS-D-20 | Group2:1 |
| F30 | Sample source:serum | Group1:IBS-D-21 | Group2:1 |
| F31 | Sample source:serum | Group1:IBS-D-22 | Group2:1 |
| F32 | Sample source:serum | Group1:IBS-D-23 | Group2:1 |
| F33 | Sample source:serum | Group1:IBS-D-24 | Group2:1 |
| F34 | Sample source:serum | Group1:IBS-D-25 | Group2:1 |
| F35 | Sample source:serum | Group1:IBS-D-26 | Group2:1 |
| F36 | Sample source:serum | Group1:IBS-D-27 | Group2:1 |
| F37 | Sample source:serum | Group1:IBS-D-28 | Group2:1 |
| F38 | Sample source:serum | Group1:IBS-D-29 | Group2:1 |
| F39 | Sample source:serum | Group1:IBS-D-2 | Group2:1 |
| F40 | Sample source:serum | Group1:IBS-D-30 | Group2:1 |
| F41 | Sample source:serum | Group1:IBS-D-31 | Group2:1 |
| F42 | Sample source:serum | Group1:IBS-D-3 | Group2:1 |
| F43 | Sample source:serum | Group1:IBS-D-4 | Group2:1 |
| F44 | Sample source:serum | Group1:IBS-D-5 | Group2:1 |
| F45 | Sample source:serum | Group1:IBS-D-6 | Group2:1 |
| F46 | Sample source:serum | Group1:IBS-D-7 | Group2:1 |
| F47 | Sample source:serum | Group1:IBS-D-8 | Group2:1 |
| F48 | Sample source:serum | Group1:IBS-D-9 | Group2:1 |
| F49 | Sample source:serum | Group1:IBS-M-10 | Group2:1 |
| F50 | Sample source:serum | Group1:IBS-M-11 | Group2:1 |
| F51 | Sample source:serum | Group1:IBS-M-12 | Group2:1 |
| F52 | Sample source:serum | Group1:IBS-M-13 | Group2:1 |
| F53 | Sample source:serum | Group1:IBS-M-14 | Group2:1 |
| F54 | Sample source:serum | Group1:IBS-M-1 | Group2:1 |
| F55 | Sample source:serum | Group1:IBS-M-2 | Group2:1 |
| F56 | Sample source:serum | Group1:IBS-M-3 | Group2:1 |
| F57 | Sample source:serum | Group1:IBS-M-4 | Group2:1 |
| F58 | Sample source:serum | Group1:IBS-M-5 | Group2:1 |
| F59 | Sample source:serum | Group1:IBS-M-6 | Group2:1 |
| F60 | Sample source:serum | Group1:IBS-M-7 | Group2:1 |
| F61 | Sample source:serum | Group1:IBS-M-8 | Group2:1 |
| F62 | Sample source:serum | Group1:IBS-M-9 | Group2:1 |
