metabolite_name CD_0hr_2 CD_0hr_3 CD_0hr_4 CD_0hr_5 CD_0hr_6 CD_0hr_7 CD_0hr_8 CD_12hr_1 CD_12hr_2 CD_12hr_3 CD_12hr_4 CD_12hr_5 CD_12hr_6 CD_12hr_7 CD_12hr_8 CD_24hr_1 CD_24hr_2 CD_24hr_3 CD_24hr_4 CD_24hr_5 CD_24hr_6 CD_24hr_7 CD_24hr_8 CD_30hr_1 CD_30hr_2 CD_30hr_3 CD_30hr_4 CD_30hr_5 CD_30hr_6 CD_30hr_7 CD_30hr_8 1-methylguanidine 0.984 0.7894 0.8729 1.0914 0.9587 1.1796 0.9174 1.1733 0.8528 1.1133 1.1951 1.105 1.016 1.1896 0.9096 1.1861 0.9142 1.7122 1.4407 0.9336 1.5276 1.3811 1.5528 1.0567 0.6409 0.4843 0.7659 0.848 0.325 0.842 0.2742 1-methylhistidine 0.6802 1.0663 0.6056 0.7408 0.7449 1.2943 1.8532 0.5905 0.2591 0.3231 0.6509 0.4628 0.8822 0.2464 0.3561 0.5379 0.6286 0.8172 1.0606 2.0462 1.0823 1.7498 0.9394 1.8924 3.7912 6.0825 5.7926 6.1529 5.5603 2.3905 1.8029 1-methylimidazoleacetate 0.7762 1.0735 0.7472 1.004 0.9759 1.0262 1.483 1.1759 0.9652 0.7578 0.7461 0.921 1.2903 0.6031 0.7235 1.0693 1.0663 2.0031 1.6137 0.6636 1.0441 0.999 1.7082 2.6111 0.7757 0.8609 1.001 0.8172 0.4997 1.1094 0.4743 2-(4-hydroxyphenyl)propionate 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 0.0022 2-aminoadipate 0.9208 0.9956 0.9647 1.1309 0.9785 1.014 1.1091 1.0998 1.0666 1.081 1.0044 1.1071 1.1846 0.8745 0.994 1.1678 1.219 1.1651 1.1824 0.7754 1.0503 1.1294 1.0546 0.7327 0.702 0.4951 0.5876 0.6379 0.3619 0.79 0.1138 2-aminobutyrate 0.3195 0.2915 0.2353 0.2484 0.2253 0.2964 0.3544 0.5845 1.3611 0.377 0.4502 0.5363 0.8797 0.3545 0.5953 1.1203 0.7811 1.5406 0.6449 5.1024 1.8687 1.5844 1.6013 1.6637 8.1732 8.6769 10.6602 7.3967 7.6577 3.7448 1.3883 2-hydroxy-3-methylvalerate 0.9693 1.1767 1.0626 1.8218 1.5196 1.5976 2.6261 1.0119 1.1523 0.9881 0.966 1.3375 0.1954 0.8912 1.2112 0.3502 1.4914 2.3606 2.1394 0.905 3.6899 2.3916 3.2576 0.3596 0.6114 0.4959 0.4821 0.6802 0.3861 0.7256 0.0861 2-hydroxybutyrate/2-hydroxyisobutyrate 0.1271 0.1476 0.1271 0.1999 0.2413 0.1555 0.2871 0.3973 0.4828 0.3167 0.2725 0.4882 0.2543 0.2541 0.4265 2.6322 2.6624 4.1119 2.0935 4.5771 8.3494 3.9259 5.3595 1.8512 6.4224 5.657 6.3671 7.8832 3.5046 4.234 1 2-methylbutyrylcarnitine (C5) 0.8889 1.0215 1.0769 0.6598 0.3635 0.7444 0.8337 0.8804 0.8471 0.8343 1 0.5961 0.1347 0.6964 0.7471 0.1347 2.1798 1.2356 2.413 2.3739 0.9267 2.6995 1.7156 0.1947 2.8011 2.6866 3.4095 3.5684 3.9484 2.8395 2.2342 3-(4-hydroxyphenyl)lactate 0.6253 0.8955 1.0054 1.0715 0.7752 1.037 1.0753 0.5849 0.9035 0.7342 0.4104 1.1264 0.8451 0.9507 0.8003 1.4135 2.0834 2.1806 2.901 1.5539 2.9759 2.4981 3.2666 0.4865 1.3171 0.8713 0.9946 1.5671 0.3853 1.7266 0.1212 3-hydroxyisobutyrate 0.5175 0.621 0.5119 0.8659 0.9271 0.9522 1 1.1144 0.5018 0.8488 0.8504 0.8744 0.8393 0.2053 0.2053 1.1153 1.0844 2.0753 1.4909 3.657 2.5591 2.0757 2.6663 3.7021 1.2855 0.821 1.5796 1.1039 0.4372 1.0766 0.2053 3-methyl-2-oxobutyrate 0.2872 0.5675 0.19 0.3932 0.346 0.5822 0.5878 0.3341 0.4756 0.2858 0.2417 0.2633 0.9563 0.19 0.2844 1.4421 4.1749 5.6924 6.3737 1.2859 3.2661 9.0497 3.9708 2.9397 2.3336 1.9553 3.9944 1.6621 1.7318 1 0.3772 3-methyl-2-oxovalerate 0.1216 0.3484 0.28 0.19 0.1886 0.1874 0.3593 0.5211 0.2279 0.4636 0.1644 0.5871 0.0862 0.1323 0.4642 0.8717 1.6649 1.5581 3.5521 1.8561 1.1283 5.4447 2.264 2.731 2.4248 3.8796 2.8366 1.7727 2.1301 1.6894 1.3852 3-methylhistidine 0.8477 1.5991 0.6712 0.3592 0.9093 1 0.9245 0.9734 0.6022 0.4386 0.9775 0.6093 1.464 0.3968 0.5391 0.4874 0.7413 1.5134 1.1245 1.5861 1.3089 1.5764 1.2894 0.2144 3.637 3.8035 2.6776 3.6451 2.1584 2.3892 0.2144 3-sulfo-L-alanine 0.8507 0.7441 0.6554 1.15 0.99 1.2486 1.4058 1.1225 0.6305 0.7496 1.1446 0.9704 2.7611 0.9602 0.663 1.3241 1.4639 1.8864 1.6876 0.7937 2.3628 1.743 2.0602 1.01 0.5924 0.4257 0.2908 0.4218 0.2374 1.052 0.2366 4-acetamidobutanoate 0.7852 0.9291 0.6214 0.9297 0.7127 0.8542 1.1405 0.6988 0.6475 0.749 0.7941 0.7433 1.5693 0.5393 0.6042 2.7424 1.0484 1.1468 1.273 0.8925 1.2503 1.0136 1.2276 3.1915 1.0105 1.3458 1.1965 1.1903 0.9895 1.1655 0.9375 4-guanidinobutanoate 0.8964 0.9958 1.0486 1.2236 1.0031 1.2698 1.1026 0.8839 0.9564 1.1138 0.9662 0.9193 1.2344 0.8256 0.95 0.9227 0.9336 1.2613 1.0798 1.1782 1.3311 1.3838 1.1507 0.9572 0.9969 0.8949 1.0098 1.1694 0.9484 1.3184 0.1575 4-hydroxycinnamate 0.6654 1.255 0.9133 1.0764 1.4877 1.0301 1.4593 0.8944 0.879 0.908 1.7401 0.9259 0.7547 0.9523 1.0104 0.6447 0.8148 1.3321 1.3863 1.1407 1.5676 1.4245 1.469 0.5442 0.7521 1.0588 1.0251 0.9896 0.7698 0.9082 0.3133 4-hydroxycinnamate sulfate 0.9523 1.4933 1.1756 1.049 1.0368 1.2066 1.5394 1.3684 1.4738 1.3241 0.6113 1 1.5412 0.5761 1.2881 0.7956 1.11 1.6487 0.939 0.6188 0.7797 0.8446 1.4037 0.3848 0.7148 0.306 0.4411 0.5033 0.208 1.0377 0.1681 4-hydroxyglutamate 0.4803 0.4803 0.4803 0.4803 0.4803 0.5429 0.4803 1.1754 0.4803 0.4803 0.4803 0.9563 2.4636 0.6173 0.4803 1.2095 0.9929 1.3156 1.4276 0.8309 0.4978 1.4358 1.0071 1.5372 0.9623 0.5571 0.4803 0.8761 0.4803 1.2805 0.4803 4-hydroxyphenylacetate 0.1223 0.1223 0.1223 0.1223 0.1223 0.1223 0.1223 0.1223 0.1223 0.1223 0.1223 0.1223 0.1223 0.1223 0.1223 0.3083 1.3876 1.1186 2.0368 0.6779 1.1965 1.6137 1.7625 0.635 1.0273 0.8767 0.9727 1.2311 0.5206 2.1591 0.2249 4-hydroxyphenylpyruvate 0.1886 0.4956 0.341 0.2167 0.1908 0.2452 0.4443 0.3572 0.312 0.4333 0.2129 0.3506 0.4202 0.1785 0.3504 0.9214 2.3533 1.7162 5.1325 2.1858 1.0786 4.3884 1.9809 3.5441 3.0803 6.3838 3.9981 3.3302 2.4782 2.5287 3.0472 4-imidazoleacetate 0.3565 0.6007 0.4266 0.4174 0.423 0.6358 0.8553 0.5393 0.5225 0.4346 0.3079 0.4278 1.184 0.2726 0.423 2.5676 1.4879 1.4165 1.6961 1.0057 0.9943 1.0129 1.1112 59.1065 2.6886 1.7704 3.1866 2.6137 1.2694 7.9143 0.428 4-methyl-2-oxopentanoate 0.258 0.5033 0.3912 0.2027 0.2155 0.2159 0.5631 0.6362 0.337 0.6477 0.2792 0.6285 0.1003 0.2676 0.5659 0.9605 2.2587 1.7536 2.7177 2.1669 1.0395 5.1275 1.7464 2.3709 3.049 4.7559 3.1913 2.2193 2.6259 2.2782 2.2946 4-methylthio-2-oxobutanoate 0.3242 0.3242 0.3242 0.3242 0.3242 0.3242 0.3242 0.3242 0.3242 0.3242 0.3242 0.3242 0.3242 0.3242 0.3242 0.3242 1.1226 0.5506 1.5859 0.423 0.3887 3.8513 1 2.2785 1.274 2.0683 1.6664 0.8984 0.4033 0.5886 0.4694 5-aminovalerate 0.0121 0.0126 0.0167 0.0156 0.0158 0.0169 0.0211 0.4217 1.1938 0.3392 0.2382 0.6543 0.0557 0.4169 0.8062 1.7995 2.2202 2.2352 2.8658 2.0272 2.1646 2.3145 2.3384 2.0188 2.1383 1.804 2.0153 2.2299 1.3318 2.4499 0.7417 5-hydroxylysine 0.9666 0.6183 0.6708 1.1438 0.9407 0.9939 1.2555 0.6161 0.5067 0.6228 0.8815 0.8259 1.1018 1.4763 0.5825 2.8937 0.7961 1.0157 0.9794 1.3727 1.0061 1.132 1.1071 4.5888 2.6097 1.0461 0.9817 1.069 0.916 1.0241 0.5428 5-methylthioadenosine (MTA) 0.579 0.9994 0.6127 0.8882 0.8034 0.9197 1.0006 0.522 0.5672 0.7106 0.5755 0.8805 1.0626 0.6576 0.6654 1.5958 1.027 1.3228 1.0574 0.9561 1.5539 1.5771 1.3828 2.1474 1.2585 1.1188 1.5189 1.7392 0.8202 0.9677 1.216 5-oxoproline 0.5695 0.8188 0.7783 0.8255 0.7331 0.8645 1.0166 0.6073 0.3654 0.612 0.6864 0.4731 0.9834 0.4459 0.4037 1.4824 2.4099 1.9484 2.9949 1.3355 1.6537 2.3751 2.6594 1.2704 1.3723 1.2439 1.2549 1.4675 1.7683 2.1348 0.6923 alanine 0.529 0.8463 0.5011 0.5539 0.6505 0.8508 1.4047 0.4602 0.3468 0.2417 0.705 0.3537 1.1564 0.5736 0.2965 0.6958 1.0429 1.3399 1.3526 1.3805 1.2748 1.9825 1.0918 0.9571 1.7751 1.8871 1.987 1.8042 2.1293 1.0756 0.6099 alpha-hydroxyisocaproate 0.9247 1.097 0.8999 1.7292 1.6134 1.6358 2.5806 0.9895 1.1366 1.0105 0.9729 1.8044 0.137 1.6673 1.3906 0.5716 1.2865 1.8723 1.1612 0.9078 2.7737 2.1805 2.031 0.3505 0.8495 0.3891 0.5618 0.6781 0.2174 0.6181 0.0205 alpha-hydroxyisovalerate 0.6715 1.004 0.9039 1.2384 1.1237 1.1694 1.6098 0.876 1.1099 1.0516 0.6156 1.2628 0.5328 1.0221 1.1856 0.6322 1.2146 1.3683 1.5672 0.7925 2.9901 1.9876 2.2828 0.4702 0.6285 0.4951 0.4867 0.9132 0.3916 0.996 0.0732 arginine 0.9258 1.0482 0.851 0.8076 0.8279 1.0942 1.4315 0.8958 0.5814 0.6957 0.967 0.8687 0.029 0.7496 0.68 0.1833 1.033 1.1641 1.431 1.6967 1.0755 1.8614 1.0954 0.066 2.1152 2.3528 2.3391 2.1207 2.5563 1.5654 0.7602 argininosuccinate 1.0402 1.3045 1.033 1.1691 1.0817 1.0834 1.017 1.0159 0.8433 0.9841 0.976 1.1488 1.0493 0.9198 0.901 1.0671 1.0881 0.9294 1.1227 0.679 1.0253 1.1456 1.1283 0.3501 0.7027 0.6429 0.6397 0.6556 0.4924 0.9419 0.1119 asparagine 0.8347 1.3317 1.0743 0.9257 0.837 1.3515 2.0629 0.8716 0.4882 0.3859 1.3683 0.7343 0.4716 0.6252 0.4229 0.0934 0.8828 1.5895 1.915 1.6536 1.5306 2.1983 1.7316 0.0519 0.7075 1.6212 1.7398 1.6677 1.3865 1.3086 0.172 aspartate 0.7478 1.0726 1.0153 1.0103 0.8455 1.1182 1.4384 0.9277 0.8843 0.86 0.7903 0.4053 1.2516 0.5639 0.6982 0.2049 1.1535 1.283 1.433 1.0062 1.5019 1.6246 1.4735 0.9938 0.8079 0.9411 1.1373 1.2092 0.7543 0.9835 0.1669 beta-citrylglutamate 0.9021 1.164 1.3899 1.2205 1.1783 0.9295 1.2166 1.3151 0.9797 1.4497 1.3817 1.1598 0.8993 1.0096 1.2101 0.6672 1.4263 0.9993 1.5576 0.9037 0.9933 1.4925 1.2395 1.0007 0.8835 0.5953 0.6989 0.6998 0.1616 0.9596 0.1157 betaine 0.6278 0.8512 0.6813 0.9834 0.8534 0.8415 1.1933 0.6759 0.5387 0.8578 0.6216 1.0071 1.2972 0.9929 0.6647 1.6246 0.9793 0.8815 1.1916 1.5758 1.022 1.5188 0.9333 2.0528 1.8818 2.3993 2.1689 2.4479 3.5362 1.9623 3.019 carboxyethyl-GABA 0.9406 1.0855 1.0607 1.187 1.0028 1.0226 0.9862 1.0546 0.8572 0.9972 1.0253 1.0808 1.0708 0.9251 0.917 1.1521 1.0974 0.8919 1.1789 0.5446 1.0977 1.0956 1.0596 0.6308 0.4085 0.1849 0.3064 0.3702 0.0696 0.6772 0.0034 cis-urocanate 1.1243 1.0885 0.8957 1.396 1.0279 0.9879 1.0458 1.2483 0.9428 1.0121 1.2779 0.8908 0.2028 0.9328 0.8703 0.4256 1.0365 1.4338 1.0557 0.5545 1.2807 1.2842 1.7962 0.3811 0.6856 0.1084 0.3708 0.644 0.3825 0.4201 1.2614 citrulline 0.8946 0.6582 0.7991 0.5185 0.4548 0.9303 1.3174 0.9998 0.4672 0.7324 1.0494 1.1464 1.3136 0.6362 0.7117 4.0041 0.7373 1.0002 0.8691 1.251 0.809 0.7722 0.7417 5.3055 1.5534 2.7077 2.8549 2.1744 2.4568 1.1103 1.9373 creatine 1.0767 1.3162 0.8341 1.0773 0.9592 0.6737 1.3535 0.707 1.2577 0.769 1.0572 0.9916 0.5848 1.1125 0.4257 0.6861 1.0084 0.5491 0.7608 0.8459 1.1692 1.5842 0.6596 0.219 1.1712 1.5894 1.4008 1.3352 2.0189 0.6857 1.6881 creatinine 0.9536 0.8884 1.054 1.1728 0.9803 1.0706 1.0182 1.0416 0.9818 1.0976 1.0687 1.086 0.2037 1.027 1.0384 0.1511 1.0968 1.4134 1.2308 0.7409 1.2355 1.2864 1.2477 0.0274 0.5734 0.3226 0.4224 0.478 0.2078 0.7415 0.0425 cystathionine 1.2817 1.2601 1.1146 1.3245 1.1164 1.1247 1.3863 1.2246 0.9083 0.9028 1.2217 1.0024 0.7006 0.9475 0.9849 1 1.4837 1.1874 1.3941 0.7813 1.0661 0.9964 1.1557 0.365 0.8063 0.5731 0.5562 0.6637 0.2717 0.8485 0.2519 cysteine 1.2685 1.3837 1.198 1.6228 1.3088 1.4169 1.783 1.4365 1.1632 1.1802 1.0232 1.2566 1.4077 0.9534 1.1722 0.7249 0.9768 0.9695 0.7553 0.5407 1.0698 1.1402 0.9027 0.4451 0.4739 0.2654 0.314 0.4129 0.3088 0.4456 0.1106 cysteine s-sulfate 0.9928 1.4206 1.0072 1.839 1.7539 1.6538 2.518 1.3258 0.76 0.9444 2.3969 1.176 0.2298 1.0902 1.0548 0.0788 0.8191 1.3636 0.9212 1.2451 2.6359 2.3335 1.6074 0.0618 0.7789 0.3688 0.5166 0.6652 0.199 0.7283 0.0751 cysteine sulfinic acid 1.0248 0.9869 1.4728 0.9585 1.0131 1.2852 1.4989 1.9083 0.7954 1.5509 1.6404 2.0146 1.2793 0.833 1.2416 0.2169 1.4614 1.8435 2.2649 0.8222 1.1747 0.7925 1.4354 0.1086 0.4803 0.4357 0.4059 0.4972 0.2398 0.8636 0.1132 cysteinylglycine 1.0232 1.1717 0.9884 1.1745 1.0588 1.1516 1.2083 1.0116 1.042 1.1001 0.8722 0.9327 1.0312 0.8522 1.1053 1.7696 1.3674 1.3712 0.9766 0.6634 1.0763 1.2255 0.9784 0.7373 0.8149 0.8465 0.6384 0.7662 0.8003 0.7567 0.2402 cystine 1.0955 1.5332 1.013 0.4462 0.4521 0.987 1.5068 1.3808 0.5519 0.6456 1.8277 1.4359 0.5639 1.0778 0.5556 0.0518 0.3948 0.476 0.3879 2.491 0.7585 2.1469 0.3832 0.0518 3.8128 3.6099 5.1159 3.6496 3.0408 0.897 0.0909 dimethylarginine (SDMA + ADMA) 0.8834 0.9843 0.8395 0.9454 0.8776 1.1063 1.2338 0.8103 0.9576 0.8343 0.8026 0.7421 1.0405 0.7071 0.766 0.6208 1.115 1.0143 1.2267 0.9857 1.4066 1.6091 1.083 1.6708 1.133 0.9501 1.1595 1.2601 1.2358 1.4066 0.9802 dimethylglycine 1.1041 0.8214 0.918 0.5143 0.7411 0.8897 1.204 0.7959 0.738 1 0.7721 0.8119 1.1004 0.4938 0.8567 1.3022 0.9316 0.6814 1.4193 8.2527 0.4938 1.0993 0.8558 12.9744 11.4927 15.2305 17.5203 15.605 15.4391 10.6565 16.8249 ethylmalonate 0.438 0.5555 0.3832 0.7698 0.7826 0.7379 0.7649 0.6752 1.1353 0.7167 0.4812 0.8647 0.7917 0.7953 1.5262 0.6839 0.5795 1.7171 0.8536 1.8988 1.3611 1.5607 1.253 5.4011 2.9967 5.8852 5.8792 5.6087 5.392 3.2492 1.8967 formiminoglutamate 1.754 2.4332 0.6486 0.3798 1.0702 0.4485 1.9894 2.5509 0.4409 0.2563 0.6758 1.1404 3.478 0.5584 0.6426 5.1371 1.54 1.9451 2.78 0.4449 0.4475 0.7694 2.9713 3.8491 0.6525 0.445 0.2563 0.5005 0.2563 1 0.2563 gamma-aminobutyrate (GABA) 0.7661 0.8609 0.8441 0.9409 0.8807 1.0184 0.7777 0.9465 0.8759 1.0801 0.8311 0.9236 5.5662 0.9512 1.0161 1.6077 0.7719 1.0911 0.9169 0.9839 1.1149 1.2879 0.93 1.8076 1.1897 1.6366 1.4358 1.67 1.6687 1.1062 1.7526 gentisate 0.8654 0.2932 0.3959 0.4753 0.4627 1.6631 0.5064 1.5851 1.234 1.4823 0.2668 1.4168 1.1346 1.5113 1.1375 6.6651 0.4562 1.9702 2.3499 0.8403 2.4864 2.1128 0.3826 2.1477 0.2425 0.1206 0.4011 0.1206 0.139 0.1213 0.1206 glutamate 0.7985 1.0234 0.9585 0.8507 0.7577 0.9634 1.2263 0.9766 0.7143 0.8256 0.9218 0.7989 1.1489 0.4893 0.6927 0.3289 1.1382 1.3153 1.4509 1.074 1.11 1.4656 1.2487 0.3611 1.2798 1.0973 1.2384 1.2965 0.8781 1.2068 0.2858 glutamate, gamma-methyl ester 1.2094 1.4449 0.8375 1.2354 1.2073 1.8833 1.6739 0.9009 0.5944 0.8223 1 1.095 2.0189 1.1699 0.6701 0.2735 0.9655 1.0176 0.7262 0.7824 0.7376 1.463 0.984 7.3636 0.851 1.058 0.8285 0.8003 1.0151 0.9567 0.2735 glutamine 0.5916 1.0355 0.3892 0.5276 0.761 1.0819 2.2232 0.664 0.2971 0.4696 0.9232 0.9645 0.102 0.7985 0.5532 0.3875 0.9219 1.5802 1.7054 2.7842 1.0528 3.3383 1.401 0.233 3.8446 3.2749 3.7266 3.5692 2.564 2.2566 0.1528 glutarate (pentanedioate) 0.7778 0.5849 0.5614 0.5807 0.5 0.654 1.0212 0.7571 0.8202 0.7581 0.9788 0.7948 1.7045 0.4223 0.5517 1.8084 0.9535 1.0603 1.1287 1.207 0.6552 1.096 0.9717 4.2144 1.7073 2.7918 2.8666 1.9395 3.3492 1.134 4.903 glutarylcarnitine (C5) 1.1874 1.7116 1.0779 1 0.947 1.1296 1.1667 1.1836 0.9416 1.0645 1.1171 1.0537 0.424 0.8502 1.0186 0.5082 1.1235 1.2847 0.9337 0.3622 1.0647 0.9862 1.1765 0.2702 0.5 0.2456 0.2852 0.3403 0.13 0.6794 0.13 glycine 0.9697 1.2184 1.0977 1.2251 1.1286 1.5082 2.1488 1.0051 0.7233 0.5728 1.3993 0.7236 1.3729 0.7019 0.6256 0.2697 0.5167 0.9332 0.5398 1.0687 1.0901 1.5699 0.9517 0.521 1.1692 0.9552 1.1246 0.9949 1.1916 0.626 0.3056 guanidinoacetate 0.6884 0.6863 0.603 1.0254 1.1201 0.7118 0.9103 0.6582 0.5288 0.5903 0.5246 0.5881 2.0119 0.9746 0.5313 0.9098 0.644 1.0827 0.6286 1.052 1.2303 1.5239 0.5497 1.6603 1.4218 1.9924 2.1049 1.7872 3.8593 1.1759 2.7582 guanidinosuccinate 1.639 2.1149 0.7421 0.2396 0.4675 0.9208 1.1474 2.4363 1.5587 1.3224 1.7301 1.5134 1.8787 0.5448 1.3113 1.0792 1.2459 1.6813 1.1747 0.4944 0.5348 0.6173 1.5923 0.6698 0.5363 0.2949 0.5174 0.3238 0.2396 0.7416 0.2396 histamine 0.5342 0.4175 1.0573 0.9446 0.922 0.8378 1.1932 1.4439 0.9891 1.625 1.0109 1.5285 0.6188 1.2262 1.5088 0.9443 1.445 1.8168 2.0632 0.8821 1.6775 1.3298 1.3538 0.3559 0.6486 0.4535 0.4451 0.594 0.2424 1.0516 0.083 histidine 0.94 1.2056 1.0282 0.4349 0.9455 1.44 0.9718 0.9715 0.5739 0.6376 1.2057 0.835 0.9549 0.7681 0.654 0.488 0.9319 1.414 1.6239 2.1832 1.7323 2.3401 1.4326 0.2334 3.1525 3.3872 3.4697 3.32 3.2777 1.974 0.7404 homocitrulline 0.73 0.6953 0.8244 0.9171 0.7344 1.0523 1.1455 0.8667 0.4797 0.5445 0.9277 0.6702 0.9477 0.6011 0.5291 0.7703 0.8419 1.4703 1.4164 1.8601 1.3398 1.113 1.3519 1.3791 2.7167 3.1218 2.8148 3.4897 2.2738 1.7425 0.613 homocysteine 0.3193 0.3193 0.3193 0.3193 0.3193 0.3193 0.3193 0.3193 0.3193 0.3193 0.3193 0.3193 1.5001 0.3193 0.3193 8.8587 0.3193 0.3193 0.3193 0.3852 0.3193 1.1261 0.3193 1.5153 0.4426 0.8739 0.8032 0.7089 2.4965 0.3193 0.3193 homogentisate 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.575 0.6025 0.575 0.575 0.575 0.575 1.0034 2.232 1.0406 0.6952 0.9543 0.9966 2.5256 hypotaurine 0.8118 0.7806 0.6145 1.9308 2.2052 1.1986 2.1527 0.63 0.6171 0.7432 0.4992 0.4379 1.2597 2.1394 0.5393 0.8834 0.7239 0.8216 0.9532 0.8487 2.6931 8.2509 0.5784 1.2129 1.0468 1.5963 1.3111 1.5452 16.2663 1.2488 10.6675 imidazole lactate 0.341 0.4723 0.5626 0.61 0.546 0.6997 0.7081 0.484 1.1575 0.8682 0.3967 0.5951 3.8806 0.5347 0.658 4.5979 2.2034 2.1239 2.7925 1.4038 1.8591 2.2617 2.4419 12.9533 2.1251 1.1318 1.7004 2.2164 0.52 4.0651 0.1024 imidazole propionate 0.7986 0.7925 1.203 1.2236 0.7862 0.9804 0.9099 0.9393 1.0319 1.2552 0.9281 1.0196 92.8922 0.7688 0.819 152.4197 1.2242 1.7097 1.3997 0.842 1.3121 1.5919 1.31 68.691 0.7944 0.4183 0.6135 0.7051 0.2262 1.0922 0.1273 indoleacetate 0.2281 0.1855 0.2224 0.2612 0.2255 0.2612 0.2969 0.1447 0.1849 0.1849 0.2369 0.1507 0.1698 0.1908 0.1546 1.0405 1.4638 1.9212 5.3028 2.8833 2.0601 2.184 3.2649 9.5095 4.3267 5.7168 4.9605 5.7935 2.3458 8.0354 0.9595 indolelactate 0.5301 0.9224 0.9917 1.3306 0.9422 1.32 1.6453 0.7439 0.8611 0.6723 0.5767 1.4288 0.4521 1.0156 0.8983 1.5619 2.0156 2.4156 3.2781 1.2182 4.2596 2.5977 3.4528 0.8921 1.0083 0.5215 0.6378 1.2672 0.209 1.7144 0.0652 isobutyrylcarnitine 0.3089 0.3089 0.3089 0.3089 0.3089 0.3089 0.3089 0.3089 0.3089 0.3089 0.3089 0.3089 0.3089 0.3089 0.3089 0.3089 0.6146 0.4376 0.758 0.8124 0.3089 0.9929 0.5603 0.3089 1.5734 1.4564 1.7924 2.1287 1.8023 1.0071 1.4551 isobutyrylglycine 0.7739 0.9337 1.0853 1.6096 1.217 0.8184 1.568 1.2233 1.2405 1.5954 1 1.5165 0.7969 0.8259 1.4131 0.6275 0.5738 1.2646 1.0937 0.7158 1.6694 1.4945 1.5306 0.1859 0.0956 0.2274 0.1828 0.2078 0.0956 0.0956 0.0956 isoleucine 0.9736 1.468 1.0515 1.0247 1.1224 1.4913 2.1497 0.9684 0.6491 0.624 1.2505 0.7656 0.7107 0.7909 0.6374 0.2529 0.627 0.9753 0.5602 1.7049 0.886 2.3039 0.8936 0.2773 1.8019 1.9927 2.0792 1.8836 2.1726 1.2091 0.2228 isovalerate 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.0452 0.1559 0.2368 2.0164 0.3804 0.4157 0.8388 0.8852 3.4362 3.8647 3.5787 3.8681 2.9876 2.7892 0.3093 isovalerylcarnitine 0.6765 0.6122 0.8083 0.8397 0.587 1.0615 0.8476 1.1473 0.6139 0.7441 0.8907 0.8738 0.4823 0.8297 0.9669 0.6338 1.5759 1.0331 1.6961 2.2779 0.9344 1.6984 1.4591 0.8924 5.4997 4.713 6.5835 6.5375 5.1701 3.0459 2.9025 isovalerylglycine 1.0342 1.0419 1.3837 1.9101 1.0856 1.1331 1.3099 1.061 1.2326 1.6454 1.3561 1.3896 0.915 0.8285 1.9025 0.5155 0.5623 1.4422 0.6933 0.5865 1.4181 1.1489 0.9658 0.6583 0.3774 0.5636 0.5098 0.7803 0.4736 0.428 0.2586 kynurenate 0.7102 1.0228 0.8055 1.1837 1.0328 0.9814 1.4562 0.9667 1.4346 0.8795 0.3736 0.6908 1.1774 0.6616 0.9794 0.7264 1.1321 2.4272 1.2566 0.8276 1.0738 1.5793 1.7619 1.7534 0.8617 0.8469 0.9807 1.0186 0.5296 1.7642 0.3573 kynurenine 0.5619 0.7003 0.5619 0.6871 0.8604 0.6873 1.2222 1.225 0.5619 0.5619 1.1829 1.0005 0.5619 0.5683 0.7608 0.6289 0.5619 1.2579 0.9995 1.1401 0.5619 0.9061 1.4912 1.7407 1.0344 1.7048 1.7452 1.6259 3.5265 0.6497 0.9315 leucine 1.0067 1.5457 0.9566 0.9933 1.1767 1.5388 2.3048 0.9753 0.5546 0.6279 1.2144 0.8567 0.3829 1.0473 0.6747 0.3197 0.7334 0.9615 0.5477 1.9624 0.9489 2.8633 0.8089 0.2742 2.2949 2.4482 2.5479 2.542 2.5589 1.66 0.2483 lysine 0.773 1.0611 0.6854 0.6515 0.6808 0.999 1.532 0.6383 0.4362 0.4168 0.8031 0.4372 0.9511 0.5769 0.3842 0.4477 0.8403 1.001 1.2169 1.8637 1.1155 2.1995 1.0573 1.008 2.7539 2.9391 3.1951 2.7355 3.2296 1.8273 0.7651 methionine 0.8662 1.5406 0.8077 0.8624 0.9938 1.4493 2.5242 0.7625 0.5279 0.5067 0.976 0.6886 0.3354 0.9374 0.59 0.7604 1.0062 1.2802 0.8198 2.9905 1.2712 4.5086 1.1647 0.5412 3.893 4.3312 4.7049 3.9993 4.717 2.2361 0.4434 methionine sulfoxide 0.8123 1.1386 0.9215 1.0061 0.8592 1.2246 1.6665 0.8921 0.6146 0.652 1.1138 0.6542 0.1734 0.6 0.6245 0.4271 0.8285 1.3119 0.9939 1.338 1.0975 1.9973 0.9793 0.2841 1.356 1.7292 1.4836 1.4574 1.5671 1.1943 0.2376 methylsuccinate 0.4049 0.7573 0.3057 0.3057 0.3057 0.3057 0.3057 0.3057 0.51 0.3057 0.6696 0.3057 0.3057 0.3057 0.3057 1.802 0.3057 0.8991 0.7865 0.9518 0.3057 0.3057 1.1486 2.0274 1 1.4866 2.0449 1.5798 1.8205 1.2326 0.7572 N(1)-acetylspermine 0.2196 0.4866 0.3861 0.5022 0.4715 0.4554 0.6152 0.264 0.2333 0.3074 0.1865 0.4578 2.6031 0.2942 0.2735 1.3423 0.9086 0.8854 1.3514 2.0889 2.2346 1.0914 1.2741 4.8549 1.759 2.1591 3.5272 4.1994 2.2184 2.8152 1.4519 N1,N12-diacetylspermine 0.4126 0.6381 0.483 0.9281 0.8862 0.8576 1.1296 0.6282 0.4999 0.57 0.3592 1.1115 2.4753 0.7057 0.6392 1.4583 2.2832 1.8967 2.0363 1.0719 2.2865 1.834 2.0043 3.4771 1.1375 0.6915 1.1636 1.5634 0.3684 1.2612 0.1931 N2,N6-diacetyllysine 0.7303 1.1633 0.9389 0.9704 1.4107 1.3964 1.4149 1 1.2337 0.8774 0.7087 0.6664 0.8961 0.7102 1.2385 0.8927 0.7865 2.4944 0.7694 1.0053 1.1239 1.2767 1.5341 1.0608 1.0371 0.7121 0.8915 1.0382 0.4088 1.8195 0.3596 N2-acetyllysine 0.7455 1.3199 1.0631 1.1847 0.8208 1.0998 1.0312 0.9992 1.0322 1.1397 0.7806 0.8784 1.2873 0.6924 0.909 1.1672 0.975 1.2233 1.435 0.7568 1.1442 1.2665 1.2785 0.9012 0.827 0.604 0.8109 0.7961 0.321 1.0008 0.0459 N6,N6,N6-trimethyllysine 0.7313 0.8702 0.7416 0.8265 0.7965 0.9559 1.2453 0.7911 0.6363 0.7312 0.7466 0.7282 1.6206 0.5908 0.6575 0.8712 1.0441 1.2572 1.2799 1.0607 1.3307 1.7137 1.0907 1.1149 1.0954 1.0646 1.2417 1.2121 1.2462 1.1944 0.3279 N6-acetyllysine 0.6356 1.0104 0.7395 0.7395 0.6514 1.095 1.6134 0.6212 0.5898 0.5536 0.6182 0.484 1.2826 0.4936 0.5168 0.5134 0.9896 0.8837 1.2566 1.3442 0.8064 2.5974 0.9254 1.6506 1.704 2.3765 2.3183 2.032 4.1118 1.5532 1.8102 N6-carboxyethyllysine 0.9117 0.8477 0.9851 0.2983 1.2471 1.8499 0.2983 1.3082 1.0219 1.0592 0.9094 0.9199 1.6832 0.9108 1.0149 0.2983 0.9228 2.4458 1.9552 0.8748 2.4927 3.2846 2.4901 1.4436 0.981 0.2983 0.6414 0.5631 0.2983 0.7362 0.2983 N6-formyllysine 0.8093 0.7992 0.7975 1.0822 0.8204 1.0213 1.5851 0.7436 0.6588 0.5137 1.3341 0.8559 0.9787 0.7315 0.4677 0.9659 0.933 0.9567 1.0665 1.4848 1.4124 0.9678 1.4041 1.5201 1.7914 2.4982 2.1289 2.1978 1.1948 1.5126 0.4207 N-acetyl-1-methylhistidine 1.0133 1.5554 0.8507 1.1326 1.033 1.0151 1.2337 1.2904 1.0755 0.802 0.9401 0.9269 1.2472 0.8104 0.7912 1.0503 1.1465 1.4722 1.0977 0.4451 1.0136 0.9867 1.1228 0.679 0.4458 0.1703 0.318 0.3382 0.0769 0.76 0.0294 N-acetyl-3-methylhistidine 0.9102 0.7618 1.3522 1.2756 0.8538 0.9509 1.0219 1.3019 1.0454 1.3079 1.0491 1.2093 0.9162 0.9311 1.0649 1.2323 1.1699 1.0735 1.0153 0.3332 0.8774 0.9874 1.0126 0.55 0.5142 0.0994 0.2791 0.1874 0.0994 0.5927 0.0994 N-acetylalanine 1.0689 1.1611 1.239 1.6967 1.2588 1.4506 1.6816 1.191 0.9796 1.3534 1.1506 1.318 1.0825 1.0204 1.1626 0.4286 0.473 1.1175 0.4461 0.2673 1.2202 0.8545 0.8858 0.0506 0.1268 0.2304 0.1806 0.1583 0.2985 0.0816 0.0701 N-acetylarginine 1.1133 1.2889 1.3493 1.45 1.251 1.4895 1.417 1.2216 0.9938 1.3256 1.1874 1.1467 1.6192 1.0062 1.0746 0.0756 0.8841 1.0768 1.021 0.5245 0.9717 0.9392 0.9438 0.0864 0.5332 0.3464 0.3993 0.4979 0.1732 0.6463 0.0491 N-acetylasparagine 0.8124 0.9679 1.127 1.0259 1.0833 1.0727 1.0295 1.1435 1.0734 1.0221 0.9779 0.9281 1.4863 0.806 1.1758 0.8877 1.2313 1.8474 1.6273 0.7657 1.4714 1.7498 1.8847 0.6776 0.6099 0.2941 0.4379 0.5475 0.1569 0.8504 0.0915 N-acetylaspartate (NAA) 0.2058 0.2616 0.315 0.291 0.3064 0.3743 0.6385 0.2623 0.2708 0.2658 0.2332 0.2779 2.0975 0.218 0.2305 1.305 1.8248 1.5769 1.8611 0.966 1.2948 1.7173 2.3879 3.9163 1.2413 1.0621 1.6308 2.0185 1.034 1.2652 0.1092 N-acetyl-aspartyl-glutamate (NAAG) 1.0814 1.0915 1.2043 1.3424 0.9452 1.0313 1.0129 1.0264 0.9935 1.1282 0.9702 1.2089 0.907 0.8672 1 1.0685 1.1103 1.1745 1.0773 0.614 0.9559 1.1349 1.0549 0.5451 0.5093 0.2686 0.392 0.4344 0.1688 0.6458 0.0312 N-acetyl-cadaverine 0.5632 0.6591 0.9953 1 0.8627 1.0088 1.3433 1.1544 0.9748 0.9156 0.7905 1.0593 1.2413 0.7377 1.1461 1.324 1.3674 1.4025 1.8013 0.8891 1.6339 1.4189 1.1955 2.9819 0.6578 0.4824 0.4871 0.8985 0.0661 1.2114 0.0661 N-acetylcitrulline 0.6476 0.9693 0.9853 1.0408 0.863 1.0171 1.518 0.9345 0.8836 0.9972 0.5213 0.8208 1.1326 0.6524 1.1385 0.4207 1.0653 2.383 1.3356 1.0244 1 1.5384 2.0365 0.4956 0.6932 1.039 1.1337 0.7623 0.7721 1.2667 0.4207 N-acetylcysteine 1.1839 1.0607 0.9803 0.9909 0.9427 1.3234 1.2108 1.2876 1.1459 1.4776 0.7222 1.2879 1.3248 1 1.305 1.9691 0.74 1.1879 0.7595 0.5621 1.0988 1.0528 0.898 0.5514 0.2206 0.2206 0.2298 0.2206 0.2206 0.3106 0.4815 N-acetylglutamate 0.4375 0.4856 0.554 0.7911 0.5229 0.9885 0.7294 0.4298 0.5859 0.6425 0.4168 0.5344 4.9161 0.7563 0.6892 4.5861 1.1113 2.4313 1.1071 1.0106 1.4944 1.6712 1.2745 5.747 1.1326 1.3935 1.0303 1.3748 0.9894 1.1709 0.6549 N-acetylglutamine 0.9144 0.9879 1.1483 1.3645 1.0526 1.1792 1.4031 0.9875 0.9203 1.0355 1.1913 1.1081 1.078 1.0089 1.0042 1.1196 1.0701 1.2821 0.9958 0.6131 1.1058 0.9009 1.135 0.7557 0.4303 0.2716 0.2613 0.4449 0.1354 0.6476 0.1072 N-acetylglycine 0.7629 0.7687 0.7966 1.1023 0.9835 1.1167 1.0165 0.889 0.847 0.9151 0.7676 0.8668 0.9545 0.9754 0.9072 1.0606 1.0359 1.2588 1.299 0.9507 1.629 1.4613 1.3816 1.2908 0.7869 1.087 0.8503 1.2122 2.1044 0.9689 1.4379 N-acetylhistamine 0.4927 0.6179 1.0924 0.9798 0.9391 1.1576 1.5231 0.9923 0.9403 1.0792 0.7224 1.0053 2.102 0.9436 0.9947 1.1378 1.8739 2.3296 3.3281 0.8812 2.8251 2.3865 2.041 1.0086 0.7402 0.4997 0.5131 0.75 0.0928 1.7875 0.0223 N-acetylhistidine 0.8514 1.1271 1.0732 1.032 0.9771 1.1943 1.1323 1.0125 1.1348 0.9875 0.8355 0.7222 2.5468 0.788 0.8804 1.4219 1.1634 1.4408 1.4128 0.7744 1.1919 1.1923 1.2986 1.5178 0.781 0.4604 0.5621 0.7625 0.276 0.9796 0.0511 N-acetylisoleucine 1.5077 1.5662 1.9754 2.2222 1.9103 2.0964 1.7212 1.8384 2.1098 1.9512 1.8328 1.6652 2.4628 1.8463 2.1947 0.4537 0.192 0.9638 0.2686 0.3066 1.0362 0.6193 0.4521 0.1809 0.2887 0.2536 0.2899 0.3907 0.2208 0.1822 0.1015 N-acetylleucine 1.6044 1.7499 1.9186 2.5735 1.8998 1.9737 2.7306 2.2816 1.7895 2.1457 1.7918 1.9482 4.0211 1.4386 2.0998 0.4111 0.2806 0.7555 0.1838 0.4085 0.607 0.4089 0.588 0.2931 0.5343 0.6563 0.5616 0.4619 0.6536 0.343 0.2153 N-acetylmethionine 1.0913 1.2034 1.2243 1.7498 1.5732 1.4682 2.0665 1.3305 1.1293 1.593 1.1086 1.7041 1.3407 1.1771 1.495 0.2031 0.2934 1.0363 0.1433 0.1641 0.9637 0.5224 0.6078 0.0784 0.167 0.3592 0.2436 0.1544 0.453 0.0872 0.0879 N-acetylmethionine sulfoxide 1.1224 1.004 1.3994 1.4757 0.996 1.4616 1.5213 1.3975 1.1611 1.3891 1.3457 1.312 0.4413 1.1945 1.2134 0.0554 1.096 1.2408 0.934 0.4968 1.1265 0.9856 0.9829 0.0223 0.2169 0.3009 0.3313 0.287 0.1596 0.7229 0.0219 N-acetylphenylalanine 0.8606 0.9045 1.0317 1.3133 1.0724 1.076 1.3781 1.3629 1.2077 1.3594 0.8819 1.1886 1.2666 0.8867 1.4322 0.9298 0.9596 1.5814 1.4249 0.8292 1.2677 1.3669 1.5975 0.2935 0.751 0.8653 0.9136 0.8117 0.9683 0.5414 0.526 N-acetylproline 0.7785 0.5654 0.8567 1.0263 0.8454 1.1702 0.8223 0.974 1.3252 1.2324 0.9511 1.2357 1.0155 1.1843 1.3116 1.5301 1.1587 2.0291 1.2617 0.7407 1.3594 1.4307 1.2146 0.6812 0.4337 0.2615 0.3154 0.4859 0.0969 1 0.0969 N-acetylputrescine 0.8628 0.9206 0.9945 1.1805 1.064 1.1577 1.2256 1.045 0.9776 0.9888 1.0578 0.9356 2.0319 0.882 1.0055 6.9653 1.1231 1.3623 1.6274 0.4871 1.5798 1.2616 1.2352 15.4674 0.5634 0.1356 0.185 0.3482 0.0302 0.7454 0.0103 N-acetylserine 4.8898 6.5541 5.7415 6.9842 5.0551 6.6582 6.2491 5.0447 4.904 5.0787 5.4759 3.449 7.2421 3.6552 4.2343 0.7908 0.6036 0.6581 0.4672 0.4331 0.611 0.9674 0.5717 0.6176 0.4425 0.6091 0.5984 0.5354 1.0326 0.3781 0.5288 N-acetyltaurine 0.9813 1.4669 1.0085 1.1247 1.0213 1.1412 1.0136 1.009 0.9105 0.9468 1.04 0.789 1.4123 0.8558 0.8124 1.2312 0.9915 1.1786 1.1517 0.4492 1.1218 1.1514 1.105 0.7696 0.3931 0.2754 0.3525 0.3424 0.2897 0.5786 0.1475 N-acetylthreonine 5.7742 8.1741 7.9982 8.1232 5.9721 7.4434 8.5069 7.2116 5.6575 8.0871 5.4559 5.7098 11.5465 6.0919 6.5091 0.6764 0.7652 0.9927 0.6137 0.3967 0.9658 0.8685 1.0073 0.6571 0.4014 0.4124 0.4005 0.5205 0.4798 0.2753 0.103 N-acetyltryptophan 0.6768 1.125 1.0723 1.1292 0.859 1.0958 1.1396 1.1158 1.1782 1.0761 0.6876 0.6428 1.6452 0.647 1.0256 1.0999 0.8241 1.1705 1.0175 0.8318 0.9825 1.2425 1.0413 1.8299 0.749 0.5221 0.5679 0.7544 0.5061 0.8153 0.2475 N-acetyltyrosine 0.7699 0.7214 0.8491 1.031 0.7545 0.8493 1.2666 1.0833 1.0057 1.1626 0.8426 1.103 1.1148 0.7687 1.16 1.1644 1.0976 1.2422 1.2118 0.6508 0.9943 1.1587 1.3441 1.6255 0.6051 0.7008 0.6292 0.7038 0.6818 0.7184 0.3755 N-acetylvaline 1.0521 1.1953 1.2682 1.5449 1.3285 1.3969 1.5695 1.3115 1.3972 1.4316 1.0756 1.1896 1.6165 1.1733 1.4237 0.2525 0.2617 0.8149 0.2044 0.1716 1 0.5263 0.6688 0.0493 0.1769 0.1601 0.132 0.1181 0.1147 0.0861 0.0493 N-alpha-acetylornithine 0.5551 1.0296 0.6084 0.9659 0.5722 0.7782 0.5953 1.0246 0.8048 1.0439 0.1783 0.6537 3.6763 1.0634 0.7362 2.367 0.8535 1.5647 1.0342 1.1314 1.5053 1.4201 0.791 4.1969 0.9926 0.7469 1.0074 1.14 0.5024 1.2612 0.1341 N-delta-acetylornithine 0.5543 0.5093 0.653 0.6729 0.513 0.9436 1.2941 0.7339 0.5913 0.5942 0.8905 0.8314 1.8612 0.6304 0.5821 0.8713 0.7372 1.2643 1.1411 1.8987 1.0564 0.9404 1.1977 3.6555 2.9193 3.9003 3.8731 3.9245 3.059 1.9299 1.8675 N-formylmethionine 0.7462 1.0918 1.152 1.3108 1.1509 1.2843 1.5782 0.9623 1.2151 1.2286 0.721 1.2065 2.8433 0.8878 1.0377 0.3465 0.9506 1.3883 1.2121 0.7168 1.9293 1.4264 1.6682 0.3543 0.5029 0.393 0.3955 0.5189 0.2421 0.3173 0.0781 N-formylphenylalanine 0.8152 0.8005 0.903 1.1324 0.8577 0.9809 1.5918 1.0272 0.5536 1.0549 0.871 1.2686 1.0991 0.8825 1.0696 0.9649 0.8902 1.5381 1.0191 1.1469 1.4192 1.2531 1.5615 0.2687 0.6834 1.1241 0.9138 1.0298 0.8773 0.3525 0.2607 N-methyl-GABA 0.7587 0.5576 1.0063 1.1255 0.8396 1.4422 0.9937 1.0748 1.1017 1.6941 0.9017 1.2198 0.9197 1.2577 1.7084 0.653 1.0503 2.1611 1.4721 0.8476 1.6429 1.6919 1.7283 0.4824 0.4922 0.2475 0.3767 0.6114 0.1984 0.8991 0.1157 N-methylglutamate 0.8766 0.6397 0.7576 0.9334 0.9321 1.1434 1.0633 1.1126 0.7612 1.4986 0.7736 1.5073 1.2645 1.2534 1.4185 1.2168 1.3707 1.9539 1.5697 0.4195 1.5256 1.8061 1 0.1742 0.2279 0.2554 0.1742 0.3293 0.1742 0.6388 0.1742 N-methylproline 0.4788 1.0137 1.1943 1.4338 0.5002 1.0903 1.2252 0.2177 0.2177 0.2177 1.3549 0.2177 0.4895 0.2177 0.2177 0.2177 0.9656 0.3685 0.2177 0.8947 0.2177 1.1837 0.2177 0.4268 0.6218 0.8804 1.4871 1.161 1.6711 1 0.414 N-monomethylarginine 0.8046 1.1392 0.6907 0.9375 1.0281 1.0701 1.6527 0.6887 0.529 0.5505 0.739 0.5769 0.7886 0.6925 0.3886 0.1178 1.0026 0.9492 1.0862 1.3538 1.1957 2.0285 0.9974 0.4001 1.5215 1.706 2.0103 1.5927 2.5344 1.2264 1.2407 O-methyltyrosine 1.0559 1.0767 0.8631 1.1991 1.0654 1.0844 1.036 1.0234 0.7879 0.7966 0.7976 1.0405 1.3075 1.147 0.9669 0.9766 0.9534 1.0307 1.2537 0.7763 1.2791 1.1487 1.0799 0.5612 0.6134 0.2548 0.478 0.6642 0.2548 0.8388 0.2548 ornithine 0.7441 0.6573 0.5962 0.6119 0.9462 0.8098 0.986 0.576 0.5013 0.5753 0.6632 0.5504 69.4591 0.7086 0.5115 4.3878 0.848 1.014 1.4511 3.6685 1.299 1.9777 0.8601 17.2262 4.6616 20.1888 13.6954 10.1234 23.9969 5.0314 21.2799 p-cresol sulfate 0.0157 0.0157 0.0157 0.0157 0.0157 0.0157 0.0157 0.0157 0.0157 0.0157 0.0157 0.0157 0.0157 0.0157 0.0157 0.0157 0.0292 0.0294 0.1393 0.9907 0.0361 0.0754 0.0964 1.0093 2.2445 4.2118 3.8335 4.567 2.801 2.4272 3.5228 p-cresol-glucuronide 0.6741 0.8182 0.767 1 0.7446 0.9102 0.6655 0.5999 0.7497 0.7112 0.6251 0.6092 0.9545 0.4512 0.6863 1.0376 1.5694 1.5896 4.0406 6.445 0.8982 1.3355 2.3341 6.3834 19.3287 28.3139 30.7645 33.3236 15.6785 31.2238 18.4232 phenylacetate 0.1092 0.1092 0.1092 0.1092 0.1092 0.1092 0.1092 0.1092 0.1092 0.1092 0.1092 0.1092 0.1092 0.1092 0.1092 0.1092 0.332 0.5455 1.5479 1.0546 0.5087 0.4692 1 0.7667 1.7328 2.9955 2.2295 2.9624 1.9296 3.0046 0.4178 phenylalanine 0.8975 1.2603 0.7965 0.768 0.9531 1.2823 1.9869 0.9576 0.5004 0.6305 1.1255 0.9144 0.2423 0.9603 0.6794 0.4776 0.7919 1.1439 0.7709 2.4776 1.1373 2.531 1.0397 0.3349 3.2263 3.3576 3.6159 3.2135 3.2053 1.7663 0.7046 phenyllactate (PLA) 0.7905 0.8982 1.04 1.3757 1.1384 1.2173 1.6387 0.6918 0.9808 0.8157 0.5852 1.4921 0.1523 1.0311 0.9595 0.594 1.6096 2.3973 1.8416 1.4376 3.6881 2.5245 2.9684 0.2654 1.0192 0.7288 0.7592 1.2401 0.4281 0.9108 0.1243 phenylpyruvate 0.1585 0.3785 0.3547 0.2234 0.2568 0.1776 0.3577 0.4082 0.3637 0.5722 0.206 0.2631 0.1775 0.1766 0.3318 0.7201 1.9525 1.5143 3.8712 3.4579 1.2799 5.3522 1.6462 2.6271 5.1445 8.775 4.7108 4.8924 3.5461 3.532 3.6828 picolinate 0.8223 0.8376 0.6656 1.018 1.0247 0.9161 1.2471 1.1827 0.8579 0.982 1.2696 1.5559 4.7262 0.9484 0.9787 1.5959 1.3759 1.5344 1.2784 0.8278 1.7471 1.1727 1.8286 1.3753 0.6288 0.8421 0.7864 0.8475 0.6812 0.8208 0.3158 pipecolate 0.4355 0.5701 0.7711 0.6754 0.5625 0.7926 0.7903 0.6383 0.6721 0.8088 0.4788 0.9719 2.34 0.583 0.6679 2.2604 1.5638 1.6916 2.1181 1.1659 1.1588 1.4653 1.57 1.7176 1.2922 1.0281 1.3495 1.4712 0.62 1.6014 0.3686 pro-hydroxy-pro 4.375 3.7375 5.2813 5.8426 5.3382 5.637 3.4816 4.484 2.5537 5.0026 4.6017 4.4015 7.3461 4.3248 3.9693 0.0785 0.1193 0.7548 0.1929 0.5257 1 0.5959 0.864 0.351 0.4439 0.147 0.1495 0.229 0.0305 0.3164 0.0085 proline 1.8826 2.0519 2.2197 1.9617 1.5938 2.4396 2.6285 1.7741 0.8266 1.8663 1.8447 1.3765 3.2934 1.1344 1.018 0.3658 0.5027 0.7296 0.4627 0.7794 0.5975 1.2536 0.5799 0.5841 0.8487 0.8114 0.8756 0.7173 0.982 0.5261 0.2925 putrescine 0.314 0.4886 0.4372 0.6006 0.5087 0.4559 0.7967 0.7509 0.3699 0.8144 0.6607 1 1.0525 0.5884 0.7838 21.9398 1.1584 1.2453 1.1209 1.3215 1.1084 0.884 0.9614 25.9444 1.8433 1.4294 1.0828 1.6537 1.2355 1.1566 1.1694 pyroglutamine 0.8932 0.9184 0.8467 0.7425 0.7053 0.6582 1.2979 0.8435 0.7471 0.8942 1.0061 1.0099 1.1732 0.8877 0.4574 1.3254 1.091 0.7761 1.3592 1.8633 0.9939 0.9914 1.1035 2.5599 2.1624 2.5165 3.2745 2.5967 1.5913 1.66 0.9511 S-1-pyrroline-5-carboxylate 1.2825 0.6012 0.765 1.3272 0.8859 1.0629 1.1878 1 0.6836 1.0508 0.8743 1.0939 0.8856 0.7215 1.2378 0.4559 0.1248 0.9984 0.1248 0.5418 0.9836 1.7632 1.503 0.8601 0.6422 1.3395 1.0804 1.0365 4.6992 0.8311 6.9405 saccharopine 0.9178 0.934 1.027 1.0907 0.9416 1.0885 0.9804 1.0209 0.8023 1.0347 1.0475 1.1853 1.3649 0.9182 0.9514 1.3117 1.1398 1.0499 1.1556 0.4798 1.1255 1.0663 1.0196 1.1158 0.3831 0.1865 0.314 0.3653 0.0778 0.6283 0.0032 sarcosine 0.0961 0.0961 0.0961 0.0961 0.0961 0.0961 0.0961 0.0961 0.0961 0.0961 0.0961 0.0961 4.2478 0.0961 0.0961 1.807 0.0961 0.0961 0.0961 0.0961 0.0961 0.0961 0.0961 0.193 0.0961 0.0961 0.0961 0.0961 0.0961 0.0961 0.0961 serine 1.0067 1.4796 0.9536 0.9793 1.0061 1.4068 2.3568 0.8398 0.479 0.5183 1.4436 0.7998 0.1682 0.8804 0.576 0.3994 0.7742 1.1018 0.6909 1.606 0.9939 2.8049 0.9426 0.509 1.8348 1.6261 1.8492 1.6061 1.7376 1.0367 0.242 serotonin 1.1657 0.8678 0.9603 1.1611 0.764 0.7537 0.6719 1.0397 1.1696 0.7235 0.6799 0.6136 0.8889 0.6359 1.1354 1.5877 1.4536 1.3602 1.4031 0.5135 1.6449 2.2071 1.6481 0.5135 0.5135 0.5135 0.5135 0.5135 0.5135 0.5135 0.5135 spermidine 0.6746 0.8732 0.8538 1.0351 0.9682 1.1591 0.4681 0.7785 0.7428 0.6115 0.8899 0.8253 4.7571 0.9405 0.7048 2.5179 0.8142 0.9212 0.9141 2.5359 1.4272 1.0318 0.4701 19.8584 1.9887 2.4151 2.3842 2.7427 3.565 2.5775 4.2871 spermine 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 taurine 0.7033 1.1784 0.518 0.5085 0.6938 0.98 1.4682 0.6876 0.5839 0.6229 0.5499 0.5722 1.8684 0.7603 0.4984 3.7085 0.9963 0.6729 0.9677 1.2829 0.915 2.2334 1.0037 3.2949 2.0937 2.6434 2.3687 2.3076 5.6099 1.3268 4.3313 thioproline 0.8335 1.1351 1.3743 1.5144 1.3368 1.3426 1.7718 1.4897 1.0277 1.4292 0.9723 1.3459 3.5245 1.1645 1.4088 0.4123 0.2904 0.3272 0.3071 0.5485 0.3099 0.3338 0.2738 1.175 0.4825 0.603 0.4963 0.5311 1.0821 0.3925 1.0296 threonine 1.9529 2.4934 2.3374 1.9472 1.6417 2.6887 3.447 1.7196 1.2586 1.1856 2.1002 1.0494 0.9462 0.7633 0.9037 0.3642 0.6058 0.9154 0.498 1.0464 0.8818 2.3734 0.8211 0.3462 1.2813 0.8228 0.933 0.8012 0.9536 0.6115 0.1099 trans-4-hydroxyproline 1.5112 1.3307 1.7548 1.6684 1.2327 1.8479 1.7423 1.4176 2.238 1.7608 1.4862 1.3932 3.5125 1.3839 1.5664 0.7626 0.5618 0.7253 0.3428 0.2801 0.6966 0.6078 0.6365 0.8395 0.231 0.1274 0.1249 0.164 0.0992 0.1769 0.076 trans-urocanate 1.2296 1.23 0.8635 1.4722 1.2704 1.1094 0.9635 1.0536 0.9396 1.0485 1.4738 0.8495 0.0758 1.0365 0.6252 0.3069 1.1564 1.5301 1.1397 0.6571 1.1833 1.6545 1.6974 0.2873 0.4315 0.1432 0.2186 0.3162 0.1721 0.5085 0.0408 tryptamine 0.5761 0.5761 1.0933 0.8414 0.5761 0.5761 0.7658 1.2304 0.9761 1.2555 0.5761 1.2981 18.86 0.5761 1.1684 16.1398 1.1049 0.9824 1.4717 0.5761 1.0176 0.5761 0.9037 0.5761 0.5761 0.8139 0.5786 0.5794 0.5761 0.5761 0.5761 tryptophan 0.7569 1.0242 0.7718 0.8014 0.821 1.1137 1.8228 0.9048 0.5299 0.589 1.0748 0.8443 0.2827 0.731 0.6492 0.3859 0.6352 0.9758 0.8995 2.1039 1.1409 1.9285 1.0903 0.369 2.5778 2.5532 2.6626 2.5426 2.7601 1.4787 1.0339 tyramine 1.0081 0.4864 1.0066 0.8907 0.7745 0.5321 0.7445 1.2252 1.1731 1.1376 0.8577 1.7459 6.356 0.7614 1.4396 1.6683 1.2806 1.2962 1.1645 0.786 1.1512 0.7037 1.3388 1.0291 0.7846 0.8531 0.6471 0.9934 0.4018 0.7445 0.1111 tyrosine 0.8593 1.2089 0.8671 0.7747 0.8683 1.2734 1.931 0.896 0.4903 0.5859 1.0835 0.7881 0.451 0.77 0.5867 0.5247 0.744 1.0639 0.8329 2.6761 1.0384 2.5675 1.039 0.3846 3.8202 3.8456 4.163 3.6823 3.8485 1.9294 0.9616 urea 0.5792 0.3826 0.1368 0.0295 0.1402 0.5709 0.0295 1.5727 1.4208 1.7905 0.4312 0.3171 0.0295 0.3442 1.9544 0.0295 0.42 0.2315 0.0295 2.3214 0.0295 0.0295 0.0743 0.0295 2.7563 5.0145 5.7764 4.6624 4.3967 2.0273 3.3288 valine 0.8751 1.3784 0.9667 1.0167 1.0389 1.5601 2.5173 0.9002 0.4616 0.4747 1.2878 0.6132 0.6215 0.8392 0.486 0.1979 0.626 0.9833 0.5299 1.8784 1.0654 2.7359 0.8914 0.3127 2.1537 2.2379 2.4777 2.2639 2.4447 1.344 0.1695 xanthurenate 0.44 1.1383 1 0.739 0.9873 1.2709 1.1618 0.6208 0.2984 0.6097 0.2984 0.2984 3.5696 0.2984 0.342 2.5202 0.2984 0.2984 0.2984 0.2984 0.2984 0.2984 0.2984 1.2836 0.2984 0.2984 0.2984 0.2984 0.2984 0.2984 0.2984 1,5-anhydroglucitol (1,5-AG) 0.5833 0.7899 0.4904 0.5556 0.4997 0.7397 0.662 0.7548 0.7611 0.882 0.4495 0.783 1.2742 0.3652 0.5227 1.2881 1.1101 0.9004 1.291 2.5662 0.9741 1.0259 1.1254 3.1258 4.4444 6.6133 7.1669 6.8532 3.1695 2.001 1.6063 2-ketogulonate 0.8701 1.0163 1.2001 1.2312 0.8178 0.8261 1.5825 0.9837 0.7365 1.2613 0.0757 1.2229 1.4684 0.8203 0.0757 1.4598 1.4632 1.7261 0.8474 0.7425 1.0471 1.6183 1.596 0.2637 0.759 0.2404 0.278 0.3823 0.0757 1.591 0.0757 3-phosphoglycerate 1.6322 1.3284 1.292 1.4275 0.9988 1.0282 1.1947 0.6467 1.6162 2.0921 1.0012 0.3271 0.3271 0.9329 1.3372 0.75 0.3564 0.3271 0.3271 0.3271 0.611 0.7907 0.4347 1.7683 0.3271 0.3271 0.3271 0.3271 0.3454 0.3271 0.3271 3-sialyllactose 0.9799 1.0557 1.0282 1.1662 1.0119 1.0741 1.0295 1.038 0.8826 1.0538 0.9487 1.1839 0.1387 0.864 0.972 0.1387 1.1181 1.0694 1.0873 0.6336 1.062 0.9881 1.0432 0.1387 0.6273 0.2881 0.4299 0.5489 0.1554 0.6848 0.1387 arabinose 1.6123 0.6548 0.5782 0.7875 0.7909 0.5744 1.3094 1.4672 1.262 1.6601 2.7199 1.4829 12.1443 1.6466 1.3257 16.0025 0.9945 0.9569 1 0.607 1.1162 0.7093 1.2011 4.3153 0.3443 0.2438 0.3467 0.4672 0.1622 0.5124 0.1622 arabitol/xylitol 0.8652 0.9985 1.0699 1.2028 0.9734 1.235 1.235 1.2465 1.0015 1.0748 1.126 1.1826 1.1791 0.8992 0.9922 0.9664 1.1351 1.3273 1.2632 0.6383 1.2069 1.2997 1.2363 0.3836 0.5086 0.2523 0.3554 0.4294 0.1565 0.6851 0.0243 arabonate/xylonate 2.3608 2.7806 2.7793 2.7631 2.499 2.5466 3.0407 2.5856 1.59 2.592 2.7519 2.458 2.8396 1.9354 2.0989 0.9184 0.9764 0.7891 0.6001 0.5273 0.825 1.0236 0.7859 0.687 0.404 0.1634 0.2343 0.3002 0.0708 0.4401 0.0084 erythronate 0.7102 0.9568 0.9849 1.3691 0.9838 1.2676 1.2928 1.0949 1.0248 1.1675 0.7291 1.1127 1.3282 0.7602 1.0151 1.3472 1.1732 2.1044 1.5375 0.6418 1.4787 1.5844 1.6367 0.8157 0.5787 0.3292 0.4585 0.6076 0.187 0.9266 0.0507 fructose 1.6517 1.1523 1.4405 0.882 0.6609 0.9709 0.6928 1.5929 1.4253 2.6452 1.6946 1.9116 0.7016 1.3796 2.0606 1.2982 1.188 1.1954 1.2414 0.4584 1.0401 1.0291 0.763 0.254 0.1407 0.0868 0.2461 0.1817 0.0427 0.3683 0.0169 galactitol (dulcitol) 0.2494 0.2494 0.2494 0.2494 0.2494 0.2494 0.2494 0.2494 0.2494 0.2494 0.2494 0.2494 3.9182 0.2494 0.2494 0.2494 1.2482 1.4373 1.3412 0.8217 0.2494 1.3168 1.3981 1.3306 0.795 0.4992 0.687 0.6833 0.2494 1 0.2494 galactonate 1.2306 0.9682 1.3736 0.8976 0.9589 1.1955 0.9101 1.6676 0.8291 1.6347 0.9 1.5964 1.4517 1.3207 1.1786 0.6436 1.7842 0.9203 1.795 1.4499 1.6174 1.0318 1.7549 0.2243 0.7025 0.6373 0.9535 0.7329 0.1664 1.3623 0.0165 glucose 1.3446 0.9679 1.0787 1.0407 0.903 0.8974 0.8981 1.3973 1.0668 1.4934 1.4363 1.2919 1.187 1.1059 1.3791 2.4114 1.0753 0.9799 1.0298 0.6394 0.929 1.0083 0.9917 1.1689 0.554 0.2876 0.4177 0.4905 0.1716 0.671 0.0141 glucuronate 1.164 1.7624 1.5176 1.4326 1.2313 1.5997 1.3048 1.1446 1.6395 1.3505 0.9606 0.8932 0.2551 0.8796 1.1114 0.2465 1.1605 1.0866 1.0198 0.8379 0.9731 1.147 1.1209 0.2324 0.1201 0.4244 0.6463 0.7533 0.3336 0.9802 0.1674 glycerate 1.5136 1.3204 1.6934 1.9803 1.3981 1.5604 1.2541 1.1162 1.5103 1.0531 0.9469 1.171 1.3284 1.4409 0.9304 0.7085 0.6582 0.7635 0.4634 0.8061 1.0915 0.9435 0.7977 0.8107 0.5506 1.317 0.4629 0.7404 0.5622 0.3549 2.2078 isomaltose 3.6382 0.8449 0.981 0.9085 0.7652 0.4976 0.3494 1.6543 0.7425 1.3287 14.4925 1.019 0.3494 2.786 1.8234 0.3494 0.3494 0.3494 0.3494 0.3494 0.3494 0.3494 0.3494 0.3494 0.3494 0.3494 0.3494 0.3494 0.3494 0.3494 0.3494 lactate 1.5711 0.784 1.0261 1.8048 1.6526 1.2469 0.9945 1.4654 1.0055 1.8547 1.4917 2.3739 0.0618 1.9339 1.9375 1.0931 0.934 1.1688 0.5807 0.4512 1.7337 1.0965 0.7751 0.1788 0.3591 0.288 0.3221 0.5169 0.3069 0.3347 0.0926 lactobionate 0.927 1.082 1.4012 1.2841 1.0322 1.0081 1.2678 1.6261 1.1694 1.5261 0.984 1.3955 0.9094 0.9796 1.4897 0.9919 1.2596 1.0199 1.054 0.7836 0.8995 1.3511 1.0259 0.4763 0.6282 0.2769 0.3946 0.438 0.1096 0.5371 0.0103 maltopentaose 1.7935 1.4436 1.8758 2.2702 1.41 1.6709 2.2777 1.0801 1.3603 1.0503 0.9778 0.8912 0.0811 0.6659 1.4407 0.1479 0.7367 1.0491 0.9002 0.4666 1 1.0343 1.3914 0.0192 0.5496 0.3418 0.3534 0.3867 0.1553 1.0604 0.008 maltose 1.3736 1.0332 1.3139 1.7737 1.0841 1.2271 1.5028 1.2408 0.9043 1.1971 0.5587 1.4269 0.1468 0.5293 1.1628 0.9184 0.8936 1.2106 0.9668 0.4781 1.1451 1.2116 1.366 0.0309 0.4075 0.2635 0.3485 0.5543 0.2006 0.5847 0.0309 maltotetraose 14.2926 3.1618 1.3535 2.7889 1.6225 1.364 1.0941 5.0816 1.6845 1.5303 25.3407 1.3563 0.2661 4.5983 4.0068 3.7842 0.7148 0.6674 0.7349 0.3292 0.7399 0.9059 0.8442 0.0527 1.1867 0.2577 0.2913 0.2641 0.171 0.4953 0.0137 maltotriose 1.3194 0.8633 1.2089 1.9307 1.1321 1.0533 1.8508 1.147 0.8376 0.8636 1.6315 1.1174 0.2739 0.7239 1 0.6669 1.2276 1.7359 1.0302 0.5391 1.6091 1.4246 1.9503 0.0425 0.6256 0.2939 0.3586 0.4458 0.1219 0.8693 0.0053 mannitol/sorbitol 1.874 2.0719 2.2738 2.4446 2.1761 2.2529 2.5003 2.7637 1.9791 2.6218 2.1602 2.6543 1.4132 2.0612 2.2072 1 0.021 0.0391 0.0098 0.0169 0.9168 0.0115 0.0149 0.0124 0.0316 0.0114 0.0033 0.0136 0.0126 0.0087 0.0033 N6-carboxymethyllysine 0.7976 0.8604 1.1259 1.2378 0.9527 1.111 1.0362 1.1773 1.0038 1.0574 0.9552 0.9962 1.1731 0.8614 1.0873 0.9691 1.1328 1.5104 1.193 0.8218 1.4609 1.5742 1.3401 0.9258 0.8159 0.4235 0.5994 0.7429 0.2942 1.0394 0.0301 N-acetylglucosaminylasparagine 0.9507 0.9249 1.2356 1.2031 0.9485 1.1121 1.1959 1.0347 0.7434 1.011 1.1881 1 49.9543 0.9772 0.9005 4.1205 0.1781 0.1356 0.0375 0.0375 0.0375 0.1223 0.0375 7.3795 0.0454 0.0375 0.0375 0.0375 0.0375 0.0375 0.0375 N-acetylmuramate 1.0424 0.4551 1.2456 1.5232 1.0577 1.1706 0.9891 1.0567 1.3879 0.5786 0.4064 0.9919 4.1895 1.0595 1.0388 2.4226 0.9405 0.7183 0.9715 0.6547 0.8756 1.0081 0.4461 4.6889 0.6641 1.1904 0.7946 0.7342 0.4637 1.1196 0.1116 N-acetylneuraminate 1.2134 1.8739 1.4448 1.5193 1.4082 1.3384 1.3044 1.0047 1.2452 1.1699 0.9953 1.1292 10.9575 1.1529 1.0818 1.3111 0.4491 0.2319 0.4194 0.5316 0.2181 0.4025 0.3002 1.0555 0.5789 0.4776 0.5069 0.5264 0.5131 0.6094 0.1989 pyruvate 0.6213 1.5433 2.0054 3.8531 3.4298 2.6363 1.8891 1.025 1.0701 0.975 0.4583 1.1432 0.2895 0.5233 0.598 3.4414 10.327 6.4937 10.955 0.3559 5.4864 7.9143 1.3761 0.2065 0.2843 0.2381 0.3529 0.4732 0.2666 0.4162 0.0394 raffinose 21.6141 5.1058 1.5737 2.9935 1.8068 1.4438 0.8058 8.9343 3.361 3.651 37.9153 1.4903 0.2493 7.9867 7.6651 3.8486 0.5941 1.0078 0.5347 0.1735 0.8323 1 0.7203 0.4566 0.6876 0.1639 0.2956 0.2174 0.1367 0.1293 0.1028 ribonate 1.0994 1.0486 1.1642 0.9843 1.0268 1.1486 1.2325 1.2881 1.0898 1.2573 1.2134 1.3441 1.0627 0.9468 1.1585 1.2407 0.8274 0.9573 0.9442 0.6617 0.956 1.0397 1.0157 0.5314 0.5042 0.268 0.3736 0.4634 0.1144 0.8324 0.0202 ribose 0.6037 0.6701 0.4777 0.6143 0.6561 0.7087 1.1438 0.8205 0.4759 0.7693 0.6728 1.132 1.9366 0.8731 0.7696 3.9594 1.4937 1.1269 0.8705 0.7453 1.313 2.4705 1.5067 8.0886 1.1511 1.4201 1.5718 1.426 2.7776 0.6441 0.577 ribulose/xylulose 1.135 1.255 1.0039 1.754 1.326 1.4483 1.8462 1.1297 0.9961 0.8484 0.8414 0.8601 4.5678 0.7533 0.7619 3.4107 0.9028 1.1064 1.0129 0.4052 1.5648 1.3279 1.1567 1.4845 0.2697 0.1715 0.2418 0.2296 0.1746 0.2786 0.0583 sedoheptulose 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 0.4275 1 0.4275 0.4275 1.5905 0.4275 0.7079 sucrose 6.4057 1.8133 2.0937 2.2035 1.1284 0.9198 0.8574 4.6646 2.2433 4.3094 6.8204 2.6155 0.461 3.6609 5.7608 3.2531 0.8457 1.2664 0.6865 0.2859 1.0802 0.8902 1.2266 0.3823 0.3659 0.2003 0.2862 0.3283 0.0892 0.4267 0.0406 xylose 0.4851 2.0846 1.4632 1.4595 1.4367 1.5781 1.6671 0.233 1.0304 1.4836 0.7728 0.7426 3.633 1 1.1157 0.233 0.9914 0.6534 0.233 0.7549 0.6203 0.233 1.1873 1.436 0.6224 0.2561 0.4526 0.4395 0.233 0.4698 0.233 1-methylnicotinamide 2.5376 4.5208 0.7835 1 0.8667 0.6489 2.4617 2.009 1.0826 0.546 1.413 1.9476 2.2146 0.5461 0.5044 2.3396 2.0084 2.127 1.2275 0.3556 0.7243 1.1404 2.1596 1.3286 0.6541 0.7426 0.9526 0.3047 0.2999 0.5166 0.4701 alpha-tocopherol 0.815 1.0087 1.0227 1.037 0.846 0.9228 0.9111 0.8393 0.9895 0.9993 0.8246 0.914 1.1259 0.7158 0.8504 1.1383 1.0007 0.953 0.981 1.0337 1.0276 0.9573 1.0193 1.4751 1.0385 1.0198 1.0845 1.1659 0.7716 1.1686 0.4402 alpha-tocopherol acetate 0.9319 0.5914 1.0967 1.2944 0.8009 0.8648 0.6681 0.7774 1.1869 1.9255 0.9978 1.3955 0.7959 1.1662 1.2327 1.1177 0.9121 1.0022 0.9925 0.9459 1.2759 1.2466 0.7053 1.2077 0.9475 0.9926 1.0044 1.5013 1.5145 1.4178 0.7298 alpha-tocotrienol 0.5122 0.6402 1.0343 0.963 0.7287 0.8886 0.9657 0.7749 1.4258 0.7037 0.6483 0.9147 2.4376 0.5241 0.9646 0.7934 0.9054 1.1268 1.5193 1.4764 1.1371 1.3651 1.1438 1.2584 1.1825 1.2822 0.9371 1.8844 1.0664 2.3793 0.4778 bilirubin (Z,Z) 0.6598 1.323 0.3315 1.0507 1.1007 0.4398 0.6843 0.3315 1.0083 0.4082 0.4298 0.3315 2.3427 0.6137 0.5107 0.3315 0.4481 0.4633 0.3315 1.3707 1.1582 1.2758 0.8434 1.6019 1.512 0.9301 1.2426 1.9 0.9917 1.2946 0.5716 biliverdin 1.1489 1.6379 2.1818 1.0033 1 2.1155 0.8372 1.5002 3.2532 2.3553 0.9211 0.8101 1.3048 1.0854 1.5697 0.9723 1.1477 0.7489 0.6329 0.8131 0.9827 1.2527 0.6602 1.45 0.9649 0.1224 0.1224 0.3163 0.1224 0.8638 0.1224 delta-tocopherol 0.6587 0.5919 1.1243 0.9168 0.7261 0.6442 0.7221 1.1539 1.1185 0.8816 0.9677 1 0.8815 0.7714 1.1153 1.2823 0.9187 0.9741 0.919 1.3039 1.1267 1.1488 1.1448 1.374 1.4832 1.0669 0.907 1.2441 0.6965 1.1801 0.5919 D-urobilin 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 flavin mononucleotide (FMN) 0.4481 0.4481 0.4481 0.4481 0.4481 0.4481 0.4481 0.4481 0.4481 0.4481 0.4481 0.4481 0.4481 0.4481 0.4481 1.283 0.4481 0.4481 0.5029 0.4481 0.4481 0.6741 0.4481 1.1882 0.4481 0.9833 0.9982 1.5495 1.8559 0.4481 1 gamma-tocopherol/beta-tocopherol 0.763 0.8253 1.0311 0.888 0.8303 0.8517 0.9122 1.3216 1.582 1.1133 1.177 1.0499 0.9989 0.9585 1.3174 1.2155 0.9864 0.968 0.9972 1.0174 1.0011 0.8903 0.9712 1.4375 1.5881 1.0378 0.9846 1.2453 0.7419 1.1023 0.3242 gamma-tocotrienol 0.4668 0.4668 0.6854 0.4668 0.6635 0.4668 0.6584 0.4668 0.4668 0.6073 0.4668 0.5511 1.2315 0.4668 0.4668 1.1242 0.4668 1.1251 1.1679 1.239 1.0992 0.4668 0.6585 0.9382 1.0618 0.8264 0.7632 1.571 1.421 1.0836 0.7041 glucarate (saccharate) 0.557 1.2921 1.5597 1.5713 1.2565 0.9581 1.3268 1.738 0.6929 1.6261 1.6919 1 1.9604 0.6554 0.9876 0.3065 1.0943 0.5457 1.6344 0.7774 0.7616 2.0425 1.1049 0.3207 0.6197 0.3674 0.7495 1.3077 0.0671 1.8364 0.0287 gulonate 0.858 1.4286 0.9964 1.0555 0.9056 1.2353 1.3328 1.0036 1.1887 0.9354 1.1646 0.9192 1.0178 1.0799 1.2208 0.9318 1.1788 1.1164 1.1471 0.6827 1.038 1.3317 1.2504 0.2711 0.5908 0.2979 0.4361 0.5749 0.1712 0.7998 0.0188 heme 1.3206 1.4652 0.9996 0.8636 0.8165 1.1618 1.0971 0.7961 1.0004 0.9367 0.6167 0.5134 0.5508 1.1856 0.7563 0.7601 0.9301 1.0076 0.4908 0.9449 1.891 1.165 0.754 1.6147 1.2012 1.3841 2.7406 2.0521 1.7664 0.8514 1.0863 N1-Methyl-2-pyridone-5-carboxamide 0.8145 0.7335 1.2079 1.2021 0.7848 0.8855 0.7735 0.9014 0.95 1.5443 0.7951 0.9268 0.9175 1.0995 1.1989 0.9282 1.0515 1.1803 0.8753 0.7659 1 1.1483 1.2962 1.2583 1.125 1.0965 1.4261 1.1793 0.6159 1.4457 0.9083 nicotinamide 0.9262 0.9065 0.963 0.7714 0.9981 1.0439 0.819 0.8958 0.9772 1.0828 1.0019 1.084 1.4133 0.9329 1.0158 2.2528 1.1226 0.9363 1.1627 1.1002 0.7401 0.9818 0.9668 0.8744 0.841 1.0795 1.1091 1.3244 1.1292 0.4581 1.2861 nicotinamide riboside 0.7921 0.8178 0.7898 0.9516 0.7758 0.8036 0.7782 0.9499 0.7982 0.9478 0.7769 1.3961 2.4014 0.8331 0.8651 4.9708 1.6567 1.232 1.1912 0.5757 1.3156 1.0484 1.5788 3.5151 1.0653 1.0529 1.4129 1.3431 0.7244 1.1424 0.1905 nicotinate 0.8143 0.7881 0.6491 0.635 0.5086 0.7154 1.4417 1.0966 0.7456 1.0327 0.9201 0.9526 1.0155 0.5297 0.9078 1.5883 1.4739 1.1724 1.4936 0.7282 1.0615 1.4783 1.979 2.7683 0.8138 1.0843 1.3273 1.0824 0.7829 0.9845 0.3871 nicotinate ribonucleoside 1.0278 0.9489 1.1545 1.1922 1.145 1.1125 1.1186 0.9018 0.9049 0.9458 1.2628 1.0581 1.4336 0.9304 1.0381 1.5934 1.4127 1.0124 1.2058 0.7093 0.9043 1.0251 1.166 0.9824 0.1206 0.4106 0.4238 0.6856 0.1886 0.9876 0.0548 oxalate (ethanedioate) 0.7875 0.9763 0.8168 0.7411 0.8112 0.8139 1.0719 1.0237 0.6837 0.8872 0.9519 0.9586 1.3439 1.2331 0.9269 1.2176 0.861 0.8661 0.866 2.9497 0.9346 1.4714 0.9576 10.658 4.7472 6.2332 8.4172 9.1633 5.343 4.2786 4.4622 pantothenate 0.2934 0.6535 0.4234 0.3787 0.4086 0.4951 1.1708 0.3853 0.3954 0.2688 0.1909 0.4504 2.5173 0.1863 0.2776 4.4097 1.1618 1.2707 1.519 0.7711 1.2654 1.6716 1.6619 7.5758 0.8984 2.1588 1.6476 1.1016 2.0701 0.8436 1.3208 pyridoxal 0.7308 0.7395 0.639 0.6712 0.6294 0.7839 0.936 0.848 0.6141 0.7963 0.816 0.8091 3.4563 0.7057 0.7566 9.4117 1.1655 1.4785 1.1601 0.9067 1.2008 1.5724 1.2962 10.2925 1.2076 1.064 1.4046 1.2761 1.0693 1.1607 0.7506 pyridoxamine 0.1913 0.2202 0.2078 0.2862 0.3273 0.247 0.1731 0.227 0.2171 0.1808 0.3212 0.3443 1.3959 0.3897 0.3653 2.747 1.4128 1.0057 1.7138 1.099 0.7171 0.9943 1.4436 10.3691 1.7669 2.7485 2.6003 2.8108 3.6527 1.3414 1.2434 pyridoxate 0.8578 0.7927 0.7702 1.0916 0.9389 1.0064 1.0981 1.2345 1.0221 1.1059 1.049 1.1661 0.7603 0.9936 1.147 1.1697 0.9606 1.355 1.1879 0.4932 1.2434 1.2538 1.3247 0.645 0.3987 0.1527 0.2006 0.2958 0.0943 0.5748 0.0311 pyridoxine (Vitamin B6) 0.8652 0.8275 1.1737 1.1151 1.1794 1.2199 0.9062 0.9796 1.0204 1.216 0.9149 1.2083 1.8702 0.9761 0.895 3.4331 1.0248 1.343 1.3445 0.4531 1.3385 1.2018 1.1729 2.7962 0.4806 0.2034 0.2676 0.4104 0.1468 0.5699 0.0358 quinolinate 1.1995 2.6785 1.12 1 1.155 1.5916 1.6911 1.2322 1.027 1.1521 1.3653 0.9679 0.9944 0.7754 0.7999 0.4479 1.3064 1.7 0.9522 0.5497 1.0404 1.1191 1.2718 0.2302 0.3435 0.1485 0.3808 0.3039 0.0407 0.9091 0.0407 riboflavin (Vitamin B2) 0.1267 0.1961 0.1267 0.1267 0.1267 0.1267 0.3136 0.1267 0.1267 0.1267 0.1267 0.1267 1.1224 0.1267 0.1267 1.9463 0.6236 0.948 0.9619 0.9855 0.8362 1.2349 0.9852 4.0227 1.1581 2.4419 1.8927 2.1009 3.0268 1 0.9039 thiamin (Vitamin B1) 1.2715 0.881 0.7591 1.1352 1.3208 0.9385 1.2454 1.2129 0.7644 1.1181 4.11 0.7917 0.832 0.63 0.6591 0.2041 1.2379 1.3383 0.7617 0.7263 0.9595 0.9319 0.9992 1.4993 1.0328 1.0108 1.0226 1.0008 1.2758 0.5422 0.2017 threonate 0.9055 1.2431 1.1911 1.3639 1.3725 1.2431 1.5891 1.1647 1.0325 1.1385 1.069 1.1624 1.4241 0.9616 1.1265 0.6696 0.2013 1.5157 0.4079 0.107 0.9994 1.0006 1.0484 0.0649 0.1144 0.1824 0.1727 0.2448 0.1557 0.1228 0.1455 trigonelline (N'-methylnicotinate) 0.7654 1.0042 0.7073 0.6648 0.6544 0.8359 1.0946 1.113 0.6588 0.8767 0.8169 0.7577 1.3174 0.546 0.7055 1.0039 0.9182 1.3104 1.0715 1.5898 0.994 0.8939 1.0817 2.0898 1.9988 2.0684 3.2969 3.1581 0.9961 1.8084 1.0689 2-methylcitrate/homocitrate 1.0127 0.6983 0.1863 0.9873 0.8523 0.7775 1.0432 0.8871 0.1863 0.1863 1.1568 0.1863 0.1863 1.2429 0.9542 0.1863 1.0897 1.2862 1.4096 1.2984 0.9373 1.1467 0.1863 1.9081 0.7309 1.0207 0.8694 0.7691 0.4187 1.0577 0.8394 aconitate [cis or trans] 1.0091 0.389 0.661 1.1159 0.8093 0.7 0.6889 0.7823 0.6843 1.3175 0.7583 1.745 1.0807 1.4407 1.1939 0.9909 0.6209 0.9178 0.5398 1.9731 0.9436 0.5611 0.5037 2.2147 1.7978 4.036 2.7596 2.5286 2.7798 1.3411 4.0633 alpha-ketoglutarate 0.3267 0.6026 0.5036 0.4203 0.421 0.4319 0.4408 0.3902 0.7202 0.4442 0.3872 0.3492 1.2798 0.2368 0.3848 1.3931 6.0745 5.8562 10.71 2.8423 4.2677 5.2394 5.0197 0.0644 3.7196 4.5292 5.5383 5.3356 4.2916 3.3664 0.5339 citraconate/glutaconate 0.884 0.907 0.638 1.2128 1.1818 1.0212 1.1645 2.5669 1.3818 1.7266 1.0291 3.0763 0.4475 1.1092 1.2779 0.2973 1.2391 2.2509 0.9788 0.6257 1.5275 1.8869 1.7925 0.333 0.5665 0.3272 0.3122 0.5296 0.3056 0.7188 0.1827 citrate 1.2595 0.3525 0.6218 0.8736 0.983 0.7184 1.0478 0.7858 0.5857 1.1088 0.7337 2.0987 0.8935 1.6896 1.017 1.3199 0.6459 0.5988 0.5011 1.8468 0.6974 0.576 0.4227 2.2157 1.7609 2.3305 1.5825 1.5223 1.8063 1.2715 2.446 fumarate 0.2757 0.4023 0.1507 0.1538 0.2521 0.2348 0.5823 2.465 0.3675 3.9908 0.5379 12.5461 8.1524 1.3497 4.5571 12.9405 0.374 0.2278 0.2697 0.93 0.3279 1.01 0.1904 14.1268 4.6994 5.158 3.0155 2.8015 5.7389 0.99 6.5951 isocitric lactone 0.7273 0.9865 0.9926 1.2011 1 1.1486 1.0441 1.4025 0.9605 1.2633 1.1518 1.3703 1.0627 0.8358 1.1088 0.864 1.1511 1.1075 1.2955 0.3057 1.2749 1.3503 1.2524 0.3276 0.2217 0.1044 0.1831 0.2442 0.0255 0.583 0.0008 malate 0.851 0.5954 0.4423 0.5572 0.4833 0.5893 1.1967 0.6006 0.4439 0.8291 0.6563 1.9928 9.9536 0.9409 1.1502 12.3962 0.7604 0.5833 0.4074 3.1089 0.7188 1.0591 0.5467 16.8677 7.5613 7.7699 5.9485 6.2526 9.2983 1.5664 2.9074 phosphate 0.3799 0.7925 0.7775 0.7145 0.5005 0.388 0.9767 1.0233 0.7217 1.4838 0.5602 1.1173 1.1189 0.5023 0.9685 0.8703 1.3449 0.6405 1.2314 1.6026 0.4265 1.5178 0.6016 3.7689 2.4599 2.2138 3.1019 2.5772 2.2323 1.3054 0.7633 succinate 0.3792 0.2812 0.2481 0.2303 0.3191 0.2942 0.5483 0.8312 0.4162 0.7962 0.9275 0.4937 28.7814 0.7532 0.6255 44.9284 2.1663 2.2439 2.2449 0.8382 1.0725 1.4507 1.3699 29.3905 10.8032 2.9869 2.5362 2.5819 4.4916 0.9201 1.7053 succinylcarnitine 1.1275 1.2973 1.2438 1.191 0.8937 1 1.4849 0.1491 0.8675 0.9945 1.1719 0.1491 0.1491 0.7838 0.8947 0.1491 1.1605 1.0916 0.1491 0.2805 0.1491 1.2821 1.2879 0.1491 0.3779 0.1491 0.1491 0.1491 0.1491 0.3412 0.1491 tricarballylate 0.6404 0.9984 1.2602 1.082 0.9467 0.8024 1.0757 1.2831 1.0562 1.2829 0.7926 1.1946 1.8787 0.8403 1.154 1.2203 0.969 0.7905 1.2307 1.0016 0.8159 1.1494 1.2652 1.6128 0.7867 0.5918 0.5269 0.8786 0.1797 0.5335 0.2087 1-(1-enyl-oleoyl)-2-oleoyl-GPE (P-18:1/18:1) 0.8985 1.7396 1.0818 0.4682 0.7698 0.9098 1.3649 1.1051 0.976 0.6769 0.81 0.6396 1.3101 0.7172 0.9308 0.8143 1.1985 0.4824 0.8516 1.024 0.2551 1.9098 0.4936 1.3605 1.74 3.3481 4.1089 2.0566 3.2902 1.4296 3.7305 1-(1-enyl-oleoyl)-GPE (P-18:1) 0.68 1.0295 0.9705 0.4762 0.3759 1.4531 1.8992 0.2493 0.3053 0.3055 0.2827 0.1505 3.9912 0.3335 0.2269 0.8465 0.8924 0.6243 1.3844 10.6093 0.5634 1.5723 0.5812 20.1761 3.5455 21.9741 17.8724 13.4668 31.5361 5.8877 20.0418 1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20:4) 0.1543 1.1617 0.8874 0.1543 0.6029 0.8274 1 0.1543 0.6772 0.4172 0.1543 0.1543 0.7191 0.1543 0.1543 0.1543 0.4307 0.2838 0.1543 1.8649 0.1543 4.0824 0.1874 1.0002 1.8793 4.6204 3.9525 3.7029 7.6854 1.2373 6.7081 1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20:4) 1 1.9654 0.8622 0.8143 0.8787 1 1.4112 0.8953 0.7973 0.8194 0.7179 0.5812 1.2538 1.0295 0.6595 0.6459 1.0514 0.4147 0.7511 1.495 0.4242 4.3021 0.4333 1.3914 2.1133 4.2754 3.9524 3.3743 6.6587 1.5528 4.6828 1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2) 0.7375 1.7248 1.0754 0.7528 0.6222 0.9227 1 0.5211 0.665 0.4799 0.4391 0.2653 1.0461 0.491 0.2653 0.2653 0.8397 0.3734 0.6312 2.2543 0.2653 5.832 0.3613 2.1395 2.8471 7.4728 5.9169 4.8376 15.5911 1.8934 10.9291 1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2) 0.9296 2.3564 0.924 0.9292 0.9566 0.958 1.4646 1.1901 0.873 1.042 0.9133 0.7464 1.0694 0.8108 0.9103 0.68 1.3053 0.451 0.8244 1.4426 0.5782 3.1383 0.5699 1.2267 2.6329 4.5269 4.2956 3.4694 9.1113 1.7086 5.755 1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1) 0.9479 1.7948 1.3683 0.7114 0.5492 1.0157 1.2097 0.7719 0.9363 0.802 0.4346 0.3222 1.2022 0.5192 0.6128 0.7122 0.9809 0.4912 0.9843 2.3837 0.2613 3.663 0.501 2.484 2.5756 8.3338 7.0761 5.2398 13.3562 2.1413 11.8617 1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1) 0.9046 1.7756 1.0374 0.7316 0.6987 0.9582 1.284 1.0948 0.8981 0.9626 0.816 0.6724 1.1549 0.6673 0.7053 0.8342 1.1286 0.4959 0.8397 1.2434 0.3537 1.9123 0.4983 1.3946 1.9799 3.9938 3.8998 2.9396 5.045 1.3867 4.0137 1-(1-enyl-palmitoyl)-GPC (P-16:0) 0.1737 0.1737 0.2407 0.1737 0.1737 0.1737 0.2228 0.1737 0.1737 0.1737 0.1737 0.1737 0.3587 0.1737 0.1737 0.1737 0.1737 0.2393 0.3543 1.1209 0.1737 0.4843 0.2559 1 1.0928 2.1978 1.7633 1.8946 3.2469 1.0652 2.9951 1-(1-enyl-palmitoyl)-GPE (P-16:0) 0.7271 1.1229 0.6695 0.4559 0.5164 1.0589 1.0248 0.3342 0.5394 0.2984 0.2866 0.188 1.4405 0.2123 0.2366 0.6671 0.8763 0.9752 1.3021 3.5615 0.642 1.5359 0.774 4.3117 2.7241 5.5013 4.8966 5.0837 7.8956 3.0596 6.1261 1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:4) 1.0147 2.1337 0.9532 0.9297 1.0338 0.9603 1.4331 0.9803 0.8388 0.805 0.8055 0.5905 1.2281 0.9853 0.7294 0.7 1.1287 0.4305 0.8475 1.5251 0.4873 4.8907 0.5023 1.6181 2.4951 5.2163 4.7344 3.7745 8.777 1.7454 5.4879 1-(1-enyl-stearoyl)-2-linoleoyl-GPE (P-18:0/18:2) 0.7805 2.3774 0.9558 1.343 0.6617 0.646 1.2575 0.9633 0.6979 1.2049 0.7897 0.8201 1.0367 0.6743 0.5184 0.8819 1.3257 0.3862 0.7095 1.3936 0.7058 3.1561 0.5582 1.1706 2.7784 5.5657 4.2439 4.1121 11.9968 1.5786 4.9496 1-(1-enyl-stearoyl)-GPE (P-18:0) 0.7668 1.202 0.8586 0.5959 0.542 1.0213 0.9912 0.4862 0.7549 0.456 0.396 0.251 1.6155 0.2461 0.3515 0.7402 1.0088 0.9202 1.3631 3.0422 0.7372 1.4571 0.8529 4.6898 2.7012 5.5284 4.8764 4.77 7.6887 2.8156 5.7276 1,2-dilinoleoyl-digalactosylglycerol (18:2/18:2) 0.8923 0.2795 1.414 1.0775 1.0493 1.5684 0.6464 1.1712 1.3447 1.1163 0.4379 0.2795 0.4656 0.9099 0.8271 0.5184 1.2901 1.6669 1.2308 0.6038 1.3858 0.5837 1.2063 0.9507 0.4655 0.2795 0.2795 0.561 0.2795 1.2136 0.2795 1,2-dilinoleoyl-GPC (18:2/18:2) 0.9781 1.0517 0.9499 0.7565 0.8746 0.8199 1.0749 0.9851 0.8039 0.7029 1.0149 0.5524 0.6759 1.2944 1.3523 1.1432 1.8505 1.8517 1.0503 0.6768 0.5418 2.3934 0.8315 0.4534 1.102 2.0646 1.6039 1.3489 4.7998 0.6423 3.5765 1,2-dilinoleoyl-GPE (18:2/18:2) 0.8914 1.227 0.7784 0.8747 1.057 0.8305 1.0463 1.2864 0.8562 1.0056 1.1106 0.6008 0.7204 1.9476 1.2629 1.172 1.5845 0.9838 0.8218 0.5687 0.6757 2.6407 0.5832 0.466 1.0261 1.7907 1.1767 0.9944 3.2658 0.3599 3.3869 1,2-dipalmitoyl-GPC (16:0/16:0) 0.9306 1.4132 0.7032 0.6288 1.2602 1.2615 1.829 0.7983 0.7314 0.8013 0.6211 0.4952 0.7842 1.5077 0.6659 1.2086 1.0376 0.6331 0.5492 0.9624 0.7826 9.4032 0.4604 2.037 1.6816 2.498 2.2537 1.7793 6.1008 1.5454 6.0605 1,2-distearoyl-GPC (18:0/18:0) 0.7428 1.0824 1.0091 0.5964 0.6535 0.7836 0.7856 0.8301 0.7676 0.9071 0.7133 0.5964 1.1385 0.5964 0.7389 0.8523 0.5964 0.5964 0.8639 0.9909 0.5964 1.0576 0.5964 2.2936 1.3081 2.7505 2.9067 2.1491 3.3013 1.2213 4.3648 10-heptadecenoate (17:1n7) 0.576 0.6639 0.445 0.6849 1.6435 0.8904 0.9208 0.6653 0.5667 0.4303 0.5243 0.3081 1.03 0.9887 0.4818 0.7908 0.5569 1.0668 1.0113 2.7227 1.166 1.0744 0.8602 11.9729 4.9233 3.8749 4.0932 3.1917 8.5873 1.7181 8.4228 10-hydroxystearate 0.1647 0.3616 0.2745 0.4097 0.3801 0.4846 0.86 0.3591 0.3285 0.1758 0.0738 0.0515 2.2984 0.0798 0.1722 0.5837 1.1441 1.2123 2.4922 2.9056 0.8573 1.14 1.1763 6.1262 3.9678 5.9148 6.4934 5.685 3.9425 3.3644 1.7754 10-nonadecenoate (19:1n9) 0.8139 0.5892 0.716 0.5892 3.0308 1.0501 0.9297 0.8543 0.7359 0.5892 0.8009 0.5892 0.5892 2.1823 0.7363 0.797 0.7047 0.9499 1.3753 2.6725 0.5892 1.3054 0.9088 0.5892 3.0812 2.985 2.8748 2.3788 8.4263 0.8428 7.0842 12,13-DiHOME 0.6711 0.5427 0.6312 0.779 0.9047 0.7964 1.5762 0.793 0.9859 0.86 0.8645 0.6039 1.3003 0.7427 0.9648 0.9572 0.7845 1.0876 1.6662 1.5077 1.0141 1.6253 1.9762 4.2246 1.2649 2.0138 0.9256 1.0241 4.5537 1.6625 5.7172 12-HETE 0.6986 0.1468 0.5011 0.427 0.5678 0.9612 1 0.2104 0.3747 0.1468 0.1537 0.1468 1.9416 0.4326 0.1468 0.9018 0.8852 1.3714 1.1797 1.9732 0.7461 1.1696 0.6062 1.5495 1.661 4.3412 2.5039 3.0279 4.4776 1.9419 1.6653 13-HODE + 9-HODE 1.2035 0.6488 0.9407 0.2457 1.9501 1.0561 2.4041 1.0033 0.9967 1.0537 1.3734 0.8365 0.3143 1.2922 0.9683 0.4283 0.3204 0.5353 1.0662 0.5109 1.1432 1.6126 0.1952 0.9176 1.0505 1.1405 0.9197 0.6781 5.714 0.5458 6.398 13-methylmyristate 1.0311 1.2629 1.0419 0.8562 0.9583 0.871 0.7293 1.1447 1.1053 0.4755 0.6012 0.558 28.3942 0.864 0.588 23.5177 0.7065 0.66 0.9689 1.5741 0.9326 0.7966 0.6353 705.8217 1.5689 1.0579 1.4251 1.751 1.7271 0.7589 1.7471 15-methylpalmitate 0.7125 0.8483 0.6797 0.9354 1.2534 0.9835 0.7713 0.7614 0.8016 0.6701 0.8658 0.6134 1.3534 1.1646 0.7141 1.0952 0.8535 0.9293 1.018 1.6458 1.0165 0.8623 0.9616 11.5713 2.0064 1.5379 1.7007 1.5657 2.455 1.1995 2.4718 17-methylstearate 0.6714 0.9542 0.9118 0.8938 1.6034 1.1543 0.7247 0.7433 0.786 0.552 0.7996 0.3651 0.9774 1.2275 0.3651 0.8958 0.7556 0.6472 1 2.8466 1.0157 1.29 0.9012 3.574 2.1408 1.6714 2.4147 2.3521 4.3382 1.7499 3.1262 1-arachidonylglycerol (20:4) 0.2445 0.9766 0.2445 0.2445 1.0717 0.3532 0.6818 1 0.4051 0.2445 0.2445 0.2445 0.7277 0.4964 0.3988 0.3565 0.265 0.2445 0.7072 1.1973 0.2445 2.9657 0.2445 1.1428 2.2606 3.4694 4.0857 2.1135 7.5741 1.1484 5.6714 1-dihomo-linolenylglycerol (20:3) 0.5201 1.347 0.8623 0.9523 1.9851 0.6277 1 0.9694 0.6555 0.4363 0.3494 0.1749 1.5737 0.7365 0.1749 0.6108 0.829 0.3064 1.2471 1.3398 0.1749 2.0283 0.326 1.2136 2.8386 4.166 2.5847 3.1166 11.129 1.691 4.8319 1-docosahexaenoylglycerol (22:6) 0.4727 1 0.6698 0.8881 1.0985 0.8402 0.8061 1.0105 0.5194 0.4927 0.4226 0.2301 1.0651 0.846 0.4588 1.2025 0.5556 0.49 1.0645 1.9375 0.733 2.0371 0.7434 1.7329 3.4762 2.657 2.7412 2.0099 6.3598 1.6838 4.3295 1-eicosapentaenoylglycerol (20:5) 0.3319 0.3319 0.3319 0.3319 0.67 0.4847 0.4765 0.3319 0.3319 0.3319 0.3319 0.3319 0.9253 0.3319 0.3874 0.8907 0.3319 0.3319 0.904 2.0367 0.3319 1.5194 0.3319 0.3319 3.6721 4.2468 4.5031 2.8434 12.9931 1 7.3006 1-lignoceroyl-GPC (24:0) 0.646 0.4912 0.8543 0.746 0.7994 0.7986 0.7804 1.1653 0.619 0.9195 0.5175 0.4577 0.7027 0.8419 1.0487 1.3163 0.8619 1.52 1.0636 1.4295 0.8708 1.8515 0.9513 1.8002 2.0138 3.3427 2.2312 2.8084 5.2266 2.3708 5.1761 1-linolenoylglycerol (18:3) 0.2566 0.8386 0.7402 0.9731 1.8305 0.9718 0.4819 1.1641 0.7675 0.2566 0.6564 0.2566 0.6702 0.8247 0.5158 1.0721 0.6609 0.7464 2.6464 1.665 1.0269 2.0417 0.8731 0.2566 2.8619 2.0538 2.6994 2.2621 11.9868 1.3086 2.9183 1-linolenoyl-GPC (18:3) 1.0169 0.9831 0.8369 0.7297 1.3353 1.0875 1.2766 0.5001 0.61 0.3123 0.4778 0.2911 0.613 0.7209 0.5283 0.6634 0.9675 1.4916 0.9486 2.6412 0.456 2.6147 0.5868 1.5782 2.991 5.0107 3.7175 2.9571 7.6286 2.1693 6.8513 1-linoleoylglycerol (18:2) 0.4859 0.7141 1.0152 0.6903 1.4875 0.8179 0.6504 1.1936 0.8821 0.4579 0.5006 0.3134 0.8379 1.2195 0.8434 1.0654 0.823 1.0999 2.276 1.3857 1.4791 1.4651 0.662 0.315 2.4556 1.6656 2.0337 1.3814 8.2207 0.9848 2.2678 1-linoleoyl-GPC (18:2) 0.9315 0.3749 1.0553 0.7367 1.1469 0.3963 1.123 0.4654 0.5547 0.3908 0.5142 0.35 0.1934 0.5684 0.955 1.081 1.9402 4.4852 1.4637 1.5083 0.2973 1.6301 1.4796 0.8698 1.262 2.1521 1.3352 1.045 4.8362 0.6886 4.3615 1-linoleoyl-GPE (18:2) 0.9047 0.4173 0.9799 0.7348 0.8988 0.5764 0.9661 0.5345 0.6782 0.4774 0.3481 0.3481 0.4856 0.6859 1 1.1976 1.4256 3.4119 1.2927 1.5484 0.6966 1.594 1.7203 1.0069 1.2226 2.4126 1.6325 1.2683 4.5995 1.289 4.386 1-linoleoyl-GPG (18:2) 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 0.3505 1 0.3505 0.3505 0.3505 0.3505 0.3505 1.8572 0.8074 0.6809 6.0939 0.3505 2.5848 1-myristoylglycerol (14:0) 0.5052 0.6854 0.9585 0.8024 1.0539 0.7869 0.6381 1.003 0.6715 0.6588 0.52 0.6769 1.0187 1.1318 0.7033 0.997 0.9291 0.9283 1.6271 2.6636 1.2971 1.1599 1.1596 3.6842 2.79 2.5463 1.8438 1.2797 6.7229 0.9907 2.9245 1-oleoyl-2-linoleoyl-GPC (18:1/18:2) 1.2236 2.1928 0.8343 0.8534 1.3079 0.9436 1.4104 0.8625 0.7565 0.6887 0.8661 0.5295 0.8698 0.8968 0.9512 1.0306 1.3971 0.9193 0.9965 1.0202 0.4704 3.728 0.8651 1.0035 1.63 3.0774 2.9565 2.1447 4.7726 1.1157 4.0912 1-oleoyl-2-linoleoyl-GPE (18:1/18:2) 1.0224 2.1325 0.8514 1.1738 1.082 0.9776 1.3591 1.0855 0.7617 0.8433 0.7906 0.6137 0.928 1.1803 0.8069 1.1672 1.2528 0.5177 0.6577 0.8048 0.7084 3.2286 0.4845 0.8708 1.4626 2.5801 2.2657 1.5966 3.9993 0.7027 3.2846 1-oleoylglycerol (18:1) 0.8388 0.8272 0.825 0.6991 1.8093 1.0052 0.7637 5.1359 0.7871 0.737 0.5323 0.35 1.6418 1.2641 0.6505 0.8962 0.8212 0.9948 1.5773 1.4146 1.1937 1.5008 0.6094 0.3833 2.5512 1.8947 2.1673 1.7372 6.7597 1.8178 2.7548 1-oleoyl-GPC (18:1) 0.9726 0.8812 0.8495 0.7071 1.3936 0.8471 1.2208 0.3725 0.6053 0.3856 0.4423 0.2114 0.3568 0.5186 0.7031 0.9716 1.1535 2.4303 1.1772 2.3225 0.3226 2.514 1.0274 2.1918 2.2846 5.263 3.5381 1.967 10.0493 1.8335 8.4999 1-oleoyl-GPE (18:1) 0.7228 0.9361 0.8868 0.665 1.1605 1.0639 1.6303 0.4446 0.3951 0.7536 0.6154 0.4229 1.414 0.7803 0.5683 1.3319 0.7522 0.6311 0.6708 4.003 0.4373 1.6474 0.576 3.2692 2.758 12.5695 7.5113 5.9682 19.7928 1.9767 12.201 1-palmitoleoyl-2-linoleoyl-GPC (16:1/18:2) 1.0837 3.6439 0.5235 0.9163 1.2038 1.166 2.6679 0.9089 0.505 0.1195 0.5716 0.2841 0.4989 0.7544 0.4516 0.617 1.9312 0.4552 0.6241 1.5044 0.2569 6.6044 0.5788 1.2531 3.6669 6.0231 5.4477 3.7737 11.534 1.7833 11.9754 1-palmitoleoyl-GPC (16:1) 0.1669 0.2272 0.1669 0.1669 0.1669 0.1669 0.5059 0.1669 0.1669 0.1669 0.1669 0.1669 0.1669 0.1669 0.1669 0.1669 0.1669 0.2704 0.1669 1.2837 0.1669 0.5806 0.1669 1.4021 1.0609 2.4995 1.8719 0.9391 4.913 0.8478 6.1755 1-palmitoyl-2-alpha-linolenoyl-GPC (16:0/18:3n3) 0.8424 1.9439 0.6483 0.9782 0.8294 1.044 1.7157 0.891 0.5058 0.6484 0.6737 0.3698 0.7957 1.0191 0.8102 0.8407 1.6385 0.9809 1.1825 1.9094 0.8363 4.6657 0.6955 1.0451 2.9265 4.843 4.2115 4.1866 9.2484 1.4212 6.1525 1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4) 0.9432 1.8528 0.7854 0.8133 1.0568 1.0758 1.7625 0.9079 0.7506 0.5762 0.5614 0.3728 0.9004 1.2165 0.6079 0.7622 1.1284 0.432 0.7057 1.1834 0.5005 8.5697 0.4944 1.3239 2.2225 3.1935 3.2464 2.8442 6.1306 1.4111 5.4733 1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4) 1.0126 2.2249 0.7176 0.9229 1.0768 0.9874 1.9023 0.9169 0.641 0.7341 0.7466 0.6577 0.9821 1.3283 0.8305 1.4793 1.248 0.3591 0.64 0.9079 0.7161 5.741 0.4996 1.1785 2.0325 3.3113 3.1235 2.1011 6.2581 0.9511 4.8558 1-palmitoyl-2-linoleoyl-digalactosylglycerol (16:0/18:2) 0.6664 0.6795 1.2487 1.1067 1.06 1.2875 0.8555 0.9278 1.2141 1.0112 0.4988 0.6128 1.0202 0.9186 0.9746 0.9206 1.9627 2.0832 1.8102 0.9465 2.1042 1.5703 2.2248 2.0106 0.9888 0.6594 0.8653 1.0927 0.2184 1.2309 0.233 1-palmitoyl-2-linoleoyl-galactosylglycerol (16:0/18:2) 0.3673 0.7013 0.5554 0.6751 0.5357 0.5656 0.9559 0.6428 0.7156 0.5827 0.3559 0.3587 0.4772 0.464 0.5268 1.0107 1.3202 1.8413 1.3671 0.9893 1.9302 1.9034 1.8849 2.1033 1.4574 1.7525 2.0088 1.8507 2.5804 1.177 1.2457 1-palmitoyl-2-linoleoyl-GPC (16:0/18:2) 0.9154 2.277 0.8525 0.9407 1.0593 1.1329 1.6196 0.8513 0.7831 0.7325 0.6474 0.3916 1.0804 0.8725 0.7262 0.8902 1.3265 0.5839 0.7364 1.5711 0.5889 4.2428 0.5583 1.34 2.3914 3.7438 3.6741 3.101 6.6789 1.5346 4.8509 1-palmitoyl-2-linoleoyl-GPE (16:0/18:2) 0.8282 1.6784 0.8011 0.9176 0.9918 0.9014 1.2468 1.0082 0.7041 0.8905 0.8044 0.5628 1.2818 1.1409 0.8626 3.3768 1.1493 0.5874 0.7185 0.9043 0.7364 2.4009 0.5365 2.1297 1.8082 2.7611 2.2793 1.6977 4.9181 0.7872 4.3969 1-palmitoyl-2-oleoyl-GPC (16:0/18:1) 0.8669 2.3665 0.6952 0.6123 0.7435 0.9606 1.9589 0.7648 0.6369 0.6401 0.6285 0.4175 1.1601 0.8237 0.6937 1.0394 1.7463 0.4746 0.8744 1.9412 0.4159 3.5849 0.6493 2.572 2.8411 6.0958 5.2384 3.5873 9.3754 1.7821 9.1789 1-palmitoyl-2-oleoyl-GPE (16:0/18:1) 0.854 2.1776 0.6525 0.7691 0.741 0.8742 1.9522 0.8873 0.3768 0.74 0.811 0.5826 0.791 1 0.6789 1.8435 1.5781 0.3768 0.8862 1.2982 0.5473 2.9387 0.6699 2.316 2.7149 5.6444 4.8162 2.7044 9.7205 1.2283 9.3651 1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1) 0.8107 2.6495 0.5016 0.5089 0.7018 1.0454 2.6272 0.7452 0.5208 0.5539 0.6551 0.3736 0.8713 0.8975 0.583 1.0457 2.1746 0.4803 0.9546 2.0224 0.4323 6.045 0.7461 2.6394 3.5289 7.4012 6.5411 3.7453 11.7653 1.7103 15.1563 1-palmitoyl-2-stearoyl-GPC (16:0/18:0) 0.8458 1.6006 0.6898 0.8058 1.1443 1.437 1.61 0.8315 0.7156 0.7267 0.4896 0.3838 1 1.1565 0.6333 1.1246 0.934 0.5267 0.7239 1.1343 0.8326 7.2255 0.4033 2.9427 0.3838 4.079 3.7387 2.3736 9.683 2.0514 9.8701 1-palmitoylglycerol (16:0) 0.591 0.7796 0.8947 1.2209 1.4585 0.809 0.8211 0.8678 0.674 0.4768 0.6663 0.3941 1.3587 1.0209 0.6213 0.833 0.9995 0.9302 1.2707 1.9914 0.8757 1.4033 0.6355 2.0405 3.01 3.1911 1.9367 1.7923 7.7248 1.5096 2.97 1-palmitoyl-GPA (16:0) 0.3401 1.497 0.3401 0.4974 0.4617 0.3401 0.4925 0.3401 0.3401 0.4038 0.3671 0.3401 0.748 0.3911 0.3401 0.5153 0.3401 0.3401 0.3401 1.5547 0.3401 0.4784 0.5572 3.5796 1.5603 3.4811 1.252 3.2195 6.4341 2.4123 2.8115 1-palmitoyl-GPC (16:0) 0.957 0.9753 0.7327 0.6687 1.1828 1.0689 1.2291 0.3613 0.4779 0.3304 0.3364 0.2076 0.4771 0.5796 0.5271 0.8409 1.0494 1.4318 0.8268 2.8163 0.4062 2.6018 0.5572 2.0483 3.1288 5.443 4.4136 3.14 12.1694 2.5432 10.7405 1-palmitoyl-GPE (16:0) 0.8572 0.8712 0.5692 0.6726 1.0472 0.9408 1.1276 0.4226 0.5568 0.3599 0.3721 0.2142 0.8162 0.6957 0.5746 1.8197 1.1659 1.5581 0.9528 2.3167 0.4784 2.1679 0.7014 8.393 1.8623 3.7426 2.4017 1.7237 7.9873 1.5285 8.82 1-palmitoyl-GPG (16:0) 0.1925 0.1925 0.2703 0.1925 0.1925 0.1925 0.3183 0.1925 0.1925 0.1925 0.1925 0.1925 0.1925 0.1925 0.1925 0.3484 0.3298 0.4251 0.1925 2.7008 0.1925 0.6891 0.3046 2.5575 1.0573 5.9072 2.615 2.1446 12.6605 0.9427 6.468 1-palmitoyl-GPI (16:0) 0.5078 0.2477 0.9417 1.026 1.0275 1.0045 1.4139 0.2155 0.1601 0.3964 0.3021 0.2531 0.7422 0.9955 0.4797 1.5507 0.7959 1.9535 0.8498 3.32 0.4025 0.9388 0.5431 2.3402 2.0628 7.5159 2.8144 3.9803 18.0615 1.9268 6.7681 1-palmitoyl-GPS (16:0) 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 0.2688 1.1271 0.2688 0.4681 3.6171 0.2688 1.0129 1-pentadecanoylglycerol (15:0) 0.504 1.1749 0.8196 0.7939 1.0377 0.7042 0.8348 0.7652 0.6066 0.459 0.6863 0.7971 8.7814 0.6857 0.5752 8.533 0.459 1 1.0126 1.4107 0.7879 0.9312 0.74 78.008 1.6922 1.9441 1.6983 1.0774 3.3334 1.1763 2.4976 1-stearoyl-2-arachidonoyl-GPC (18:0/20:4) 1.0953 1.833 0.835 0.8891 1.0653 1.0749 1.4455 0.8409 0.743 0.6169 0.4725 0.348 1.0886 0.9762 0.5667 0.7517 0.8396 0.3291 0.5888 1.0238 0.5514 8.5738 0.4403 1.4681 2.2807 3.5183 3.2471 2.7037 6.2282 1.3206 4.5554 1-stearoyl-2-arachidonoyl-GPE (18:0/20:4) 1.1322 1.7652 0.8812 1.2347 1.2879 1.0602 1.3711 1.0526 0.8472 0.9164 0.7972 0.7062 0.9199 1.2087 0.7742 1.0459 0.9541 0.4274 0.7079 0.7866 0.7145 4.9031 0.5718 0.8524 1.2938 2.1215 2.0889 1.701 3.668 0.7353 2.1489 1-stearoyl-2-arachidonoyl-GPI (18:0/20:4) 1.1314 1.4715 0.6779 0.5869 0.8725 1.2371 1.2773 0.7711 0.7185 0.8929 0.5359 0.5968 1.0316 0.9684 0.7082 0.9523 0.7737 0.5359 0.7412 1.3499 0.7066 4.1861 0.5881 1.1742 1.5384 2.6145 3.5235 2.2345 4.0809 1.2002 4.552 1-stearoyl-2-linoleoyl-GPC (18:0/18:2) 0.9373 1.9759 0.8745 0.9576 1.0424 1.0769 1.4088 0.7466 0.7308 0.7194 0.5477 0.3817 1.1 0.7715 0.6505 0.9432 1.1042 0.4356 0.6965 1.3431 0.5833 3.9279 0.5342 1.5016 2.0197 3.6615 3.409 2.6244 6.0975 1.3565 4.2181 1-stearoyl-2-linoleoyl-GPE (18:0/18:2) 0.9565 1.9264 0.9857 1.3308 1.2612 1.1164 1.4137 1.0143 0.8419 0.9841 0.787 0.6528 0.9844 1.0777 0.8515 1.1084 1.1485 0.5724 0.7312 0.9178 0.8792 2.9649 0.6074 0.9225 1.4823 2.5212 2.543 1.8511 4.5963 0.8383 2.8602 1-stearoyl-2-oleoyl-GPC (18:0/18:1) 0.91 2.1016 0.8222 0.7113 0.7922 1.0189 1.805 0.7747 0.6859 0.674 0.595 0.4561 1.2287 0.717 0.6071 0.9811 1.4548 0.3994 0.9034 1.8133 0.4517 4.2757 0.6447 2.6902 2.9623 7.7004 6.3014 3.9356 12.3026 1.8403 11.4735 1-stearoyl-2-oleoyl-GPE (18:0/18:1) 0.9789 2.1357 0.8502 0.9098 0.8767 0.9153 1.7865 1.0211 0.6385 0.7656 0.7623 0.6178 1.0509 0.7968 0.7039 0.9062 1.286 0.4374 0.9238 1.5184 0.5355 2.5942 0.6943 1.335 2.174 4.9016 4.5587 3.0396 7.6004 1.363 4.7956 1-stearoyl-2-oleoyl-GPS (18:0/18:1) 0.8935 1.7132 1.1374 0.9881 0.9045 0.7765 1.2281 1.0729 1.0119 0.9683 0.9484 0.7724 1.0424 0.8575 0.9359 0.8486 1.1528 0.499 0.8767 0.7532 0.5581 2.5134 0.5981 1.1234 1.4939 2.616 2.7219 2.3116 4.0142 1.3297 1.3055 1-stearoyl-GPA (18:0) 0.3425 1 0.5671 0.3505 0.3425 0.3425 0.3425 0.3425 0.3425 0.3425 0.5039 0.3425 0.9041 0.3425 0.3425 0.3425 0.3425 0.3425 0.3425 0.3425 0.3425 0.3425 0.3425 2.8045 0.6573 2.9309 1.1609 1.5291 5.4957 1.0863 0.8778 1-stearoyl-GPC (18:0) 0.9076 1.1521 0.8037 1.0623 1.3167 1.6744 1.1822 0.4229 0.5039 0.3578 0.3047 0.1802 0.6396 0.4467 0.33 0.8914 0.8232 0.9377 0.7044 3.3516 0.8657 2.847 0.5035 2.3105 4.411 7.1763 7.6529 5.2886 12.8172 4.8273 8.1965 1-stearoyl-GPE (18:0) 0.954 1.3498 0.9054 1.2898 1.2253 1.7708 1.2385 0.4077 0.4982 0.3629 0.3633 0.2225 0.7316 0.4149 0.3309 0.9363 0.7999 0.9396 0.754 2.7495 1.046 2.4903 0.6722 2.7015 1.554 3.7357 3.1129 2.3487 7.9142 1.5003 6.3049 1-stearoyl-GPG (18:0) 0.4238 0.4524 1.195 0.4429 1.1756 1 0.5482 0.1836 0.6617 1.2637 0.1836 0.1836 0.264 0.4549 0.8047 0.9883 1.6532 0.7272 0.1836 2.3869 0.5713 0.6138 0.45 2.411 1.1713 3.8136 2.4636 3.0935 7.2976 1.1405 2.8118 1-stearoyl-GPI (18:0) 0.8388 0.6811 0.9076 0.843 0.8064 1.3654 1.3373 0.1411 0.3195 0.7983 0.5721 0.506 2.2294 1.0186 0.3569 1.2865 0.7894 1.0207 0.3268 2.2957 0.4249 0.9814 0.8485 5.7588 2.2817 8.6302 3.4637 5.3558 11.8077 4.059 3.6477 1-stearoyl-GPS (18:0) 0.7193 0.9657 1.0343 0.8198 0.8863 1.5438 1.5155 0.2116 0.2822 0.45 0.5161 0.3588 2.6251 0.5925 0.3154 1.2164 0.7463 0.5861 0.4302 3.9418 0.4641 1.7402 0.7631 7.3676 2.3058 11.7675 5.0096 5.7125 23.3793 2.9412 5.0178 2-docosahexaenoylglycerol (22:6) 0.198 0.918 0.5102 0.6818 1.1049 0.5351 0.5304 1.3588 0.198 0.6044 0.2387 0.198 1.2708 0.4133 0.198 0.675 0.5354 0.198 0.763 1.082 0.198 1.894 0.5146 2.2819 2.4822 1.6896 2.0686 1.1736 3.9641 1.1372 2.4535 2-hydroxydecanoate 0.7594 0.5605 0.5605 1.0077 1.0086 0.702 0.8575 0.6674 0.6774 1.0359 0.5605 0.9636 0.5605 1.0046 0.5605 0.6968 0.8966 1.2792 0.7048 0.7501 0.9424 1.1093 0.9954 0.8784 1.2999 1.2638 1.2633 1.6804 1.3883 1.0722 2.7877 2-hydroxyglutarate 0.1391 0.2019 0.1453 0.1263 0.5138 0.1593 0.2911 0.348 0.2882 0.3855 0.2237 0.5037 6.3706 0.7045 0.3914 10.7859 1.3587 0.7994 2.287 1.2006 1.9641 1.5361 1.9742 28.3415 1.8353 1.9178 2.1221 2.5464 1.696 1.5927 0.3914 2-hydroxypalmitate 0.7104 1.2068 0.5184 0.9281 1.5166 1.1045 1.0451 0.4428 0.5868 0.5593 0.48 0.2707 1.1931 0.9549 0.4564 0.5435 0.5218 0.5717 0.8696 1.7838 1.0726 0.7584 0.9144 2.3555 1.846 1.7161 2.4577 1.9232 2.3013 1.208 3.6108 2-hydroxystearate 0.7709 1.028 0.6559 0.9228 1.0663 1.0148 0.8724 0.4841 0.7423 0.5362 0.5074 0.3342 1.3586 0.7697 0.4172 0.6788 0.7669 0.6401 1.0046 1.7141 1.0507 0.9954 0.7144 3.1758 1.6545 2.1106 2.6722 2.1053 2.9663 1.6381 3.1211 2-linoleoylglycerol (18:2) 0.4273 0.9405 1.2666 1.3602 1.2341 0.6258 0.5319 1.7767 1.0317 0.5173 0.5063 0.374 2.4748 1.1082 0.8383 0.8574 0.9683 0.8905 2.8959 1.1666 0.7359 1.9207 0.8057 0.3033 2.7721 1.5444 1.5847 1.4108 9.9086 0.7029 1.3728 2-myristoylglycerol (14:0) 0.4555 0.6871 1.031 0.564 0.6767 0.5559 0.4578 1.3772 0.4555 0.7005 0.4555 0.7563 1.8907 1.0115 0.7289 1.3709 1.039 0.8917 1.9533 1.4279 0.9303 1 0.8011 13.0128 2.4068 1.6543 1.1684 0.6062 5.583 0.6457 1.3152 2-oleoylglycerol (18:1) 1.7455 0.9755 1.0301 1 2.0963 0.8921 0.6599 2.392 0.792 0.6758 0.3431 0.3431 8.5306 0.9741 0.8019 0.6495 0.8614 0.575 1.8124 1.1339 0.7791 1.6803 0.3753 5.3711 3.1245 2.0965 1.5906 4.3015 6.3934 4.636 0.9555 2-palmitoleoylglycerol (16:1) 0.5808 0.5808 0.8219 0.5808 9.3182 0.5808 0.5808 0.5808 0.5808 0.8433 0.5808 0.5808 1.0723 1.287 0.5808 0.757 0.8778 0.9277 0.5808 0.6208 0.5808 0.5808 0.5808 0.5808 2.0257 2.0674 1.49 0.5808 8.7342 0.6776 2.4288 2-palmitoylglycerol (16:0) 0.4071 0.7273 1.1859 1.4078 1.3716 0.6452 0.7818 1.1629 0.9728 0.4621 0.9067 0.475 2.1248 0.7945 0.6494 0.711 1.2358 0.6927 1.4585 1.2246 0.5147 1.2318 0.4305 2.0682 2.2995 2.0989 1.0039 0.9961 6.6639 2.0616 0.9518 2-palmitoyl-GPC (16:0) 0.6324 0.7045 0.2196 0.2196 0.8814 0.2196 0.9613 0.7196 0.5851 0.2196 0.2196 0.3474 0.2398 0.2196 0.2196 0.2196 0.2196 0.2196 0.2196 2.6366 0.2196 0.6904 0.2196 3.3829 1.0387 3.1069 3.7537 2.8392 6.8533 2.2094 4.5686 2-stearoyl-GPE (18:0) 0.7109 0.6899 1.0788 0.9796 0.8045 1.4411 1.572 0.2562 0.2562 0.5602 0.2562 0.265 1.4585 0.4795 0.2562 0.7348 0.3379 0.34 0.4426 2.5584 0.7781 1.311 0.565 4.63 1.4134 5.1369 3.7578 2.9079 10.5978 1.2188 5.5877 3-carboxyadipate 0.8103 1.0602 0.9101 1.1528 1.2114 1.0263 1.533 1.7144 0.8094 1.3891 0.8125 1.1666 0.7728 1.0104 0.8819 0.8596 1.5361 1.5386 1.3271 0.7145 1 0.9228 1.6104 1.1181 0.7198 0.49 0.7903 0.9749 0.3393 0.7546 0.3393 3-dehydrocholate 0.9327 0.77 0.3442 1.1482 0.6408 0.2088 4.6632 0.4439 0.5129 0.5348 0.2088 1.5771 1.0673 0.2088 0.2088 15.9474 2.9488 0.8911 1.4803 0.2088 3.849 4.6888 8.6526 0.8407 0.2088 0.2088 0.2088 0.2088 0.2088 0.4038 0.2088 3-hydroxy-3-methylglutarate 0.558 0.8723 0.8007 0.5992 0.9024 0.7558 1.0306 0.7721 0.9961 0.8418 0.9083 0.9646 6.1471 1.2079 0.6155 19.688 0.6718 0.8325 1.1631 2.1037 1.0039 1.5393 0.8317 27.697 3.0125 3.5238 3.4342 4.2791 3.8276 2.8181 0.8281 3-hydroxybutyrate (BHBA) 0.4045 1.9201 0.6215 1.0903 1.8144 0.7363 1 0.3625 0.0946 0.2512 0.2112 0.0946 0.5088 0.0946 0.0946 1.8338 0.68 0.6603 0.7764 1.369 0.9153 1.1222 1.033 11.5249 2.0852 4.2269 2.1748 3.8723 3.0946 1.4371 0.8627 3-hydroxydecanoate 1.0556 0.7752 1.1667 0.8481 0.7198 0.9761 1.236 0.8698 0.8107 1.1227 1.0239 1.1192 1.8785 1.1133 0.9355 2.0557 1.4951 1.4815 0.8184 0.8537 0.7126 0.6767 0.8051 1.7142 0.9027 1.2453 0.8504 0.8483 1.1982 0.8005 1.3405 3-hydroxyhexanoate 0.6545 0.0648 0.246 0.0648 0.0648 0.2141 0.4098 0.2142 0.0648 0.11 0.1754 0.0648 0.0648 0.2526 0.2339 0.3629 0.9821 0.8477 2.3169 7.3482 1.27 1.5308 1.7489 2.6959 13.1803 15.5567 12.7501 16.1582 14.802 7.4732 8.6213 3-hydroxylaurate 1.0733 0.6128 1.1281 0.8931 0.711 0.867 1.2172 0.6651 0.8088 0.9021 0.7456 1.0183 0.5867 1.0958 0.6845 1.2925 0.9928 0.934 0.9095 1.1179 0.8149 0.6583 1.0462 2.2797 1.4703 1.4348 1.0072 0.9576 1.4914 1.0784 3.3131 3-hydroxyoctanoate 1.4853 0.7358 0.7371 0.75 0.653 0.6943 1.121 0.5665 0.6435 0.5551 0.7776 0.5551 0.7513 0.8689 0.5551 0.8548 0.879 1.2394 0.5551 1.2406 1.2612 0.7338 0.5551 2.1136 1.9963 2.2496 1.245 2.3109 2.2557 1.4045 2.0267 3-hydroxypalmitate 0.5713 0.7817 0.9146 0.809 1.4854 0.9987 0.5562 0.8394 1.0051 0.5294 0.8174 0.4622 1.903 1.0013 0.854 2.4865 1.5117 0.7479 1.0574 1.9574 0.5999 0.8525 0.7905 38.9049 1.7573 1.4487 1.4556 1.7042 1.6592 0.9749 3.0569 3-hydroxysebacate 0.929 0.9852 1.1632 1.1799 0.8231 1.2025 1.3001 1.308 1.2135 1.2659 0.7542 1.0539 1.2869 0.9703 0.7754 1.0006 0.9555 0.6269 1.2295 0.692 1.0056 1.3094 1.0163 1 0.6686 0.4567 0.7573 0.7028 0.7577 0.7587 0.4567 3-ketosphinganine 1.1324 1.6217 0.5204 0.5204 0.5204 0.5204 1.0711 0.6197 0.5726 0.5204 0.9383 0.5204 125.0837 0.7521 0.5204 120.9221 0.6066 0.8222 1.3165 0.5204 0.5204 0.5204 1.0617 261.5148 0.665 0.5204 1.1963 0.916 0.5204 0.6302 0.5204 4-cholesten-3-one 1.3869 1.6704 0.999 0.7038 0.7222 0.8133 1.2843 2.5224 0.9885 1.001 1.5567 1.5943 1.4786 0.5351 0.896 1.9747 1.7701 0.6967 1.169 0.8189 0.8652 0.8135 1.0724 2.0708 0.6959 1.2741 1.3903 0.8853 0.571 0.7247 0.3605 4-hydroxybutyrate (GHB) 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 6.0329 0.9185 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 11.1533 1.0815 0.6118 0.6118 0.6118 0.6118 0.6118 0.6118 5-dodecenoate (12:1n7) 0.8731 0.5535 0.9227 0.5219 1.1326 4.7135 0.9621 0.8095 2.452 2.0787 0.7275 0.9826 0.6711 0.8151 0.8891 1.4546 0.8441 11.4852 0.9009 1.6072 0.9603 0.8705 0.8876 1.0174 36.3358 1.3035 1.1934 11.9036 10.099 1.1421 2.4216 7-alpha-hydroxy-3-oxo-4-cholestenoate (7-Hoca) 0.7657 0.9291 0.3812 0.4364 0.4234 0.3652 1.8443 1.2287 0.9549 0.9734 1.2684 2.2245 0.3431 0.4414 1.1705 1.1938 1.3369 2.2641 2.1404 2.0475 0.8577 0.887 3.2137 2.0874 1.1911 2.0394 0.9812 0.599 0.7856 1.0312 1.0188 7-ketodeoxycholate 0.2939 0.2743 0.048 0.546 0.1228 0.0498 1.6099 0.1724 0.3707 0.0417 0.0417 0.2658 9.3965 0.0417 0.0475 46.6804 4.7332 2.483 3.1002 0.7846 5.8828 5.8253 10.6735 12.0038 1.4408 1.3464 1.1556 0.2467 0.8444 2.028 0.1521 9,10-DiHOME 0.838 0.7224 0.8749 0.7921 0.7036 0.6666 1.216 0.8638 1.1271 1.0785 0.9998 1.1028 1.0096 0.8522 1 1.6343 0.7292 1.0587 1.2131 0.861 0.6514 0.9376 1.0096 2.393 1.0046 1.5513 0.4351 0.4351 1.9234 0.9496 2.8343 acetylcarnitine 1.0159 1.7493 0.6211 0.8473 1.3592 1.3915 2.0749 1.0111 0.6653 0.8089 0.7649 0.6403 0.0545 0.9946 0.6071 0.3777 0.9922 0.7473 0.9877 2.2765 1.0054 2.2523 0.7216 0.2466 3.6672 5.1919 3.8729 6.2816 10.7763 2.8859 3.9064 adrenate (22:4n6) 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.2696 0.8171 0.2696 0.2696 0.2696 2.3006 0.5072 0.6005 0.7885 1.2415 2.1316 0.2696 1.1829 alpha-muricholate 0.2353 0.2353 0.2353 0.2856 0.2353 0.2353 1.2189 0.2353 0.2353 0.2353 0.2353 0.2353 8.0099 0.2353 0.2353 139.9757 1.4385 0.8504 1 0.4033 1.4141 1.8218 2.9639 11.582 0.9134 0.8611 0.6942 0.2353 0.3495 0.7631 0.2353 arachidate (20:0) 0.6848 0.6649 0.8162 1.0039 1.2855 1.0508 0.7682 0.7871 0.8155 0.7668 0.8063 0.483 1.2994 0.9961 0.6348 0.6431 0.6637 0.7602 1.085 1.9026 1.0195 0.9275 0.8165 2.2592 2.2015 2.0173 2.2497 2.2406 3.9835 1.7402 2.8405 arachidonate (20:4n6) 0.4382 0.9942 0.2958 0.534 1.3851 1.0357 1.0058 0.3151 0.3784 0.1336 0.1778 0.068 1.8309 0.3799 0.1437 0.6278 0.3679 0.6219 0.94 7.1365 1.1664 2.6787 0.7366 26.5094 8.0105 13.1932 14.1694 12.9823 28.5534 5.8777 18.4102 azelate (nonanedioate) 0.7498 0.5642 0.7263 1.0684 1.0006 0.9994 1.0774 1.2338 0.9551 1.5871 1.2222 1.1524 0.5555 1.1674 1.537 0.6577 1.0421 1.2916 1.3962 0.7527 1.5802 1.3985 1.3257 0.4694 0.4999 0.4413 0.4567 0.6916 0.4219 0.8698 0.2777 behenate (22:0) 0.7269 0.841 0.7811 1.0038 1.2026 1.1403 0.8579 0.9089 0.8504 0.7627 0.6306 0.4397 1.4977 0.8785 0.7176 0.7173 0.6346 0.6633 1.0567 1.6674 1.034 0.9962 0.8918 2.9928 1.913 2.3052 2.5719 2.2728 3.6028 1.8679 2.6773 beta-muricholate 0.531 0.6366 0.351 1.0577 0.5216 0.4466 2.25 0.4038 0.4634 0.3208 0.2966 0.6916 16.5545 0.2524 0.2782 255.8623 2.1365 2.4131 1.9948 1.5841 2.4959 2.7602 3.8269 26.8585 1.7677 1.2115 0.8711 0.9423 0.8474 1.3893 0.2482 beta-sitosterol 0.9333 0.8447 1.2385 1.015 0.8929 0.9847 0.9371 0.985 1.2895 1.0793 0.8063 0.7771 1.0197 0.7144 1.1266 1.4167 1.0721 0.8404 0.8551 0.9734 0.8028 0.9253 0.9493 1.5392 1.4385 1.3307 1.1904 1.24 1.0794 1.1216 0.4387 butyrylcarnitine 0.3305 0.6067 0.4758 0.2811 0.2811 0.6666 0.9627 0.2811 0.2811 0.72 0.2923 0.2811 0.2811 0.2811 0.2811 1.4798 1.9464 0.821 1 5.4653 0.582 3.1959 0.4568 0.3759 9.9081 11.1028 12.9502 16.1874 13.0995 5.2348 6.3382 butyrylglycine 0.5059 0.3285 0.3285 0.3285 0.3285 0.3285 0.3285 0.3285 0.3285 0.3285 0.3285 0.3285 0.55 0.3285 0.3285 0.71 0.3285 0.7912 0.3285 0.3285 0.3285 0.3285 0.3285 2.6703 0.3285 1.7691 1.2088 1.2333 1.5062 0.3285 0.6991 campesterol 1.0614 0.9575 1.0352 0.9343 0.8776 1.0775 0.7999 0.9704 1.1018 1.0593 0.7116 0.7094 1.0355 0.796 0.9754 1.3829 1.0757 0.9699 0.9104 1.1808 0.8469 1.1622 0.7153 1.5698 1.2429 1.4088 1.0246 1.2084 0.9044 0.9487 0.4063 caprate (10:0) 0.8891 0.7946 0.7527 0.6875 0.8102 1.8818 0.6611 0.8608 1.2288 1.2886 0.6672 0.6927 0.4276 0.8337 0.7537 1.0321 0.7174 3.7845 0.9679 1.3243 0.963 0.7423 1.0399 1.4954 10.3441 1.5605 1.1914 3.7857 3.6845 1.2063 1.4286 caproate (6:0) 0.7523 0.6056 0.6056 0.9646 0.6056 0.6056 0.8609 0.6056 0.6056 0.6883 0.6056 0.6056 0.6056 0.6056 0.6608 0.6056 0.6056 0.6056 0.6056 0.6056 0.6056 1.105 0.6056 0.6056 0.6779 2.263 1.8207 4.1152 1.2545 1.8504 0.6056 caprylate (8:0) 1.2096 0.7164 1.107 0.9496 0.7886 0.52 1.2937 0.52 0.7766 0.8673 1.0192 0.5533 1.3365 0.7671 1.1961 0.6901 0.9808 1.431 0.9704 1.2006 0.52 0.52 0.8278 0.52 2.3563 1.3884 2.298 1.4678 1.6603 0.8332 1.7131 carnitine 1.1669 1.4329 0.7059 0.9669 0.7324 0.5775 1.4902 0.9106 0.7597 0.5786 1.412 1.2549 0.0901 1.0314 0.3985 0.4811 0.9686 0.5225 0.7624 1.6303 0.9461 1.7913 0.7224 0.4676 2.6551 3.4966 3.514 3.5728 3.532 1.2658 2.4177 chenodeoxycholate 1.5406 1.0911 0.3772 0.8961 1.6801 0.185 3.9325 0.4174 0.185 0.3636 1.0596 1.0518 3.5558 0.7349 0.4745 43.0641 1.6069 0.7483 1.3015 0.9252 0.6804 0.7396 5.1796 3.7803 1.7899 1.5317 0.5639 0.3837 0.6879 0.9482 5.4042 chiro-inositol 0.3198 0.9167 0.8233 0.8476 0.8563 1.0728 1.1369 0.9013 1.1172 1.0616 0.4099 0.9875 4.8684 0.7367 0.892 1.406 1.8774 1.703 2.1349 1 1.8851 2.0452 2.1695 2.8247 1.1209 0.5407 0.8158 0.9124 0.1339 1.4364 0.0278 cholate 2.3218 2.7366 0.5258 2.5172 0.8724 0.3433 13.9943 0.3843 0.6103 0.2422 0.1501 1.3658 2.4101 0.144 0.1978 42.7189 4.7255 1.7349 2.1101 0.5841 3.6293 3.7043 15.9152 2.8709 0.6916 1.1276 0.5981 0.1439 0.7631 0.8078 0.3632 cholate sulfate 0.3151 0.483 1.713 1.8876 0.7571 1.8975 0.3809 0.499 3.7528 4.4931 0.2878 0.5657 4.2757 1.0443 4.5644 1.3344 0.2272 1.0736 0.2233 1.507 0.8043 0.7231 0.7895 3.9858 1.3725 0.233 0.1379 1 0.0815 1.7944 0.0815 cholesterol 0.694 1.1274 1.1817 1.0832 1.2458 0.8891 1.0282 0.5926 0.7658 0.714 0.787 0.4433 1.0056 0.5914 0.6061 0.6664 1.0919 0.5534 0.6081 0.8069 0.6947 1.3371 0.814 1.366 11.0023 1.9535 1.6494 1.9121 2.5976 1.5883 2.0162 choline 0.7267 0.7254 1.0359 0.5877 0.8824 1.7704 1.0122 1.0952 0.8538 1.2973 0.6549 0.6155 1.0846 0.7013 1.5272 0.5757 0.8188 1.4381 1.0516 1.0722 0.7862 0.9189 1.0325 0.9572 1.0795 0.9878 1.0158 1.3188 1.1522 1.5779 0.8577 choline phosphate 0.8563 1.4198 0.6549 0.5263 0.7436 0.9358 2.3207 0.8751 0.3607 1.1117 0.5587 0.6122 0.7584 2.0917 0.9904 3.4924 2.3476 0.616 0.6409 0.8611 0.4581 14.1133 0.5012 1.8055 1.0286 2.3749 1.5964 1.0159 3.4495 1.0096 5.8497 deoxycarnitine 0.8191 1.0516 0.7438 0.7875 0.7487 1.0008 1.2734 0.8596 0.616 0.6306 0.7125 0.6138 43.0686 0.6883 0.6242 23.9267 0.7872 0.8247 0.7721 1.5298 0.9992 1.9317 0.8356 63.1657 1.8483 2.6595 2.7479 2.5266 3.687 1.53 1.8113 deoxycholate 1.3491 0.5733 0.559 0.4371 1.1666 2.0265 0.4371 0.4371 0.4371 0.4371 0.6104 0.9713 0.4371 0.4371 0.6541 0.4371 0.4371 0.7637 0.4371 6.6517 0.4371 1.1204 0.4371 7.0731 0.4371 1.0287 0.4371 0.4371 0.6551 0.7892 4.1672 diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1]) 1.2172 0.6895 0.9632 1.0764 1.2997 0.9008 1.2084 1.2076 1.0063 0.9937 0.8862 0.8234 0.7796 2.1512 1.4162 1.1577 0.8137 1.0945 1.1844 0.4158 0.9089 1.0073 1.1354 0.3854 0.7837 0.7115 0.7061 0.8159 2.8634 0.3854 1.88 dihomo-linoleate (20:2n6) 0.4751 0.5865 0.5194 0.8429 1.585 0.9303 0.9356 0.4667 0.4033 0.3445 0.5117 0.2217 1.3534 1.0644 0.4073 0.6224 0.5186 0.8298 1.0909 2.6961 1.1903 1.0984 0.8101 6.4918 2.8927 2.7345 2.9009 2.5641 7.2045 1.4348 6.4184 dihomo-linolenate (20:3n3 or n6) 0.4779 0.9178 0.3459 0.7386 1.4314 1.0712 1.0378 0.2894 0.2803 0.1965 0.2154 0.0935 2.2474 0.5912 0.1969 0.6528 0.4715 0.7296 0.9622 4.4981 1.1808 2.0685 0.8207 27.0372 5.1137 8.3372 9.5062 7.3351 19.5394 3.6487 15.9933 docosadienoate (22:2n6) 0.5055 0.6843 0.6457 0.7858 1.3932 1.0417 0.8355 0.436 0.5863 0.4621 0.5413 0.1905 1.344 0.9583 0.398 0.5522 0.6017 0.7956 1.2083 2.3529 1.0636 1.2367 0.8157 4.6854 2.29 2.6917 2.7056 2.6391 5.6517 1.6226 5.0239 docosahexaenoate (DHA; 22:6n3) 0.5985 0.8191 0.3679 0.6561 1.4198 0.9995 0.8965 0.4694 0.4806 0.1743 0.2276 0.1028 1.9611 0.672 0.2281 0.7514 0.4331 0.7641 1.0382 5.9314 1.1447 2.1909 1.0005 33.633 8.8748 10.2184 10.7883 11.3949 24.0944 5.4393 21.7291 docosapentaenoate (n3 DPA; 22:5n3) 0.5914 0.6925 0.4747 0.7438 1.644 0.9569 1.0331 0.3594 0.4476 0.228 0.2262 0.2262 1.6918 0.8524 0.3703 0.5476 0.6149 0.884 1 3.7101 1.2149 1.8881 0.9443 21.6543 4.8104 5.6137 6.4858 4.993 11.1937 2.8863 12.7861 docosapentaenoate (n6 DPA; 22:5n6) 0.6142 0.5825 0.5379 0.664 1.2264 1.1242 0.8512 0.1442 0.4052 0.3633 0.1032 0.1032 1.3265 1.2998 0.4044 0.5393 0.5355 0.7485 0.9722 3.1324 1 1.4859 0.6661 13.7159 3.5422 4.412 4.5981 4.5665 10.8149 2.4708 10.6174 dodecanedioate 0.8307 0.5364 0.7526 0.8578 1.3224 0.8777 1.1129 0.5449 0.7719 1.0386 0.5364 0.5364 0.5364 0.5364 0.8956 1.4551 1.0155 1 0.6723 0.7473 0.9521 0.7979 1.079 2.0304 1.3519 0.5364 1.0617 1.2038 1.5742 0.8831 1.8531 eicosapentaenoate (EPA; 20:5n3) 0.6626 0.7888 0.4369 0.5718 1.2624 0.9384 1.0616 0.5853 0.7758 0.2764 0.2772 0.1452 1.345 0.5687 0.2994 0.5626 0.5809 0.8422 1.0685 5.8612 1.404 1.8891 0.8799 11.7258 6.3123 8.3384 8.046 7.0273 15.9913 3.4223 12.7854 eicosenoate (20:1) 0.5019 0.4836 0.5875 0.7892 1.5217 1.0141 0.7874 0.5343 0.5805 0.397 0.627 0.265 1.5333 1.2131 0.4755 0.5534 0.4965 0.7368 1.1082 2.3934 0.9859 1.016 0.7383 2.8788 2.0431 1.9912 2.0767 1.8634 5.0099 1.3065 3.5509 erucate (22:1n9) 0.6182 0.5452 0.6447 0.7909 1.4407 1.2914 0.6025 0.5218 0.6823 0.4785 0.882 0.2781 1.9493 1.073 0.5114 0.4817 0.5316 0.5897 1.3239 1.6624 1.0618 0.9382 0.6879 2.9314 1.7483 2.0899 2.4191 2.1968 3.9723 1.8361 3.864 glycerol 1.6108 0.6113 1.0998 1.3305 1.1222 0.8685 0.7257 0.5833 0.2904 1.1582 1.8444 1.3393 0.4014 0.6751 0.8285 0.3825 0.4985 0.69 0.9881 1.4503 0.6105 0.8974 0.6564 1.0119 1.4394 1.6322 1.5357 1.4316 2.0929 1.0846 0.9424 glycerol 3-phosphate 0.693 0.468 0.6435 0.8712 0.6724 1.088 1.1134 0.7899 0.8283 0.9074 0.5367 0.9311 0.4036 0.8622 0.7839 0.5469 1.2502 1.4168 0.8163 1.3935 0.9151 1.546 1.1289 1.0689 1.4338 2.7618 2.6343 2.7344 3.4781 1.8281 4.9369 glycerophosphoethanolamine 0.6472 0.4639 0.7399 0.8446 0.6685 0.8667 0.9082 0.6954 0.6586 0.9599 0.3865 1.0401 2.0859 0.5407 0.7992 3.7651 1.5645 1.6917 0.8572 1.3689 1.5775 1.7322 1.0979 4.6059 0.8897 3.1732 2.329 2.7174 5.3 1.2396 12.119 glycerophosphoglycerol 1.0079 0.4376 1.0199 1.1364 0.9921 0.7958 0.698 1.0314 1.4104 2.0025 0.5442 1.1216 0.4884 0.8245 1.7455 1.5203 1.5969 1.4531 0.7825 0.662 1.7481 1.2627 1.3419 0.7222 0.234 0.8707 0.8353 1.0838 1.3438 0.5439 0.695 glycerophosphoinositol 0.4386 0.3737 0.687 0.635 0.6749 0.71 0.6478 0.5431 0.4356 0.9903 0.3842 1.0826 1.5878 0.8773 0.88 1.5801 0.7466 1.3473 0.774 1.5641 1.3022 1.2022 1.0097 2.1467 1.0204 2.5458 2.2199 2.5144 3.1217 1.7093 1.3737 glycerophosphorylcholine (GPC) 0.5751 0.2829 0.4761 0.4406 0.5839 0.6491 0.5814 0.8413 0.3688 1.0462 0.2781 1.3981 0.7087 0.9609 1.0391 1.4186 1.7108 1.5873 0.7553 1.6101 1.3823 1.7286 0.684 1.53 0.5612 2.8116 2.6574 3.5633 3.6683 1.9663 6.1814 heptanoate (7:0) 1.3721 1.0239 1.7875 1.0269 0.4757 0.9746 1.3378 1.087 1.1683 2.159 1.4341 2.8631 1.4841 1.3543 1.4061 0.9761 1.6431 1.2561 0.8856 0.6571 0.5648 0.5671 0.8089 0.4533 0.5472 1.1493 0.7128 0.681 0.5786 0.8614 0.656 hexadecanedioate 0.6674 0.6732 0.6358 0.6481 0.6751 0.7286 0.9963 0.622 0.6889 0.4797 0.766 0.7939 0.7716 0.6228 0.676 1.0852 1.1814 1.2692 1.2308 1.2673 1.0037 0.8703 1.378 1.7575 1.4826 1.9263 1.8928 1.9517 2.1559 1.2139 2.5693 hexanoylcarnitine 0.724 1 0.5855 0.5384 0.5952 0.9602 0.926 0.4192 0.6174 0.4921 0.4332 0.3203 0.2404 0.4661 0.3504 0.2404 6.4664 4.4476 8.2711 7.9998 3.6382 8.9392 5.5531 0.2404 12.7546 9.4335 11.0032 16.5839 9.2773 10.4621 4.4078 hyocholate 0.5847 0.4834 0.2413 0.661 0.4787 0.2413 1.9859 0.2413 0.2413 0.2413 0.2413 0.2413 1.741 0.2413 0.2413 12.9835 1.7231 0.6719 1.1419 0.5269 2.4091 2.147 3.166 1.3312 1.1173 0.7963 0.8118 0.2413 0.2413 0.7391 0.8827 hyodeoxycholate 0.7298 0.6802 0.2852 0.6581 3.0128 0.2829 1.7999 0.3683 0.2829 0.2829 2.3048 0.3984 2.9887 1.5264 0.2829 19.8961 1.2154 0.922 0.8083 1.078 0.8106 0.8734 2.5232 4.1194 3.2157 1.1539 0.6381 0.2829 0.6777 0.8748 9.8159 isocaproate 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.1372 0.2679 0.5872 4.4504 0.696 0.5186 1 0.1866 8.2037 8.7173 9.7653 9.7479 6.108 6.0483 0.3397 linoleate (18:2n6) 0.4557 0.5355 0.4192 0.6655 1.9082 0.9094 0.9665 0.5676 0.6049 0.221 0.3838 0.1404 1.5242 0.868 0.3387 0.6923 0.4491 1.0335 1.2549 5.0078 1.6024 1.6052 0.9003 6.6262 5.4566 5.0946 5.2933 4.6899 13.7279 2.581 8.3278 linolenate [alpha or gamma; (18:3n3 or 6)] 0.4376 0.4917 0.3983 0.5534 1.463 0.8817 0.876 0.6299 0.7496 0.2499 0.4294 0.1209 1.1183 0.7244 0.3227 0.6766 0.5217 1.1262 1.2397 3.7019 1.5377 1.5026 0.8626 4.3293 5.3124 3.9739 3.4971 3.485 11.2579 1.9623 5.7906 linoleoyl ethanolamide 0.5645 0.926 0.4798 0.7333 1.1461 0.7925 0.9894 0.9727 0.4929 0.3676 0.3764 0.4355 0.9202 0.7771 0.7412 0.9769 0.7591 1.0106 1.5627 3.2977 1.402 1.488 1.9464 2.8623 2.6237 2.2534 2.5626 2.4964 2.4311 2.3871 1.5512 linoleoylcarnitine 0.7878 1.2705 0.1571 0.392 0.5304 0.8406 1.1594 0.3099 0.2596 0.1571 0.1571 0.1571 0.1571 0.1571 0.1571 0.4044 0.1571 0.2793 0.1571 1.98 0.1571 1.2138 0.1571 0.6992 4.7229 4.3153 4.2879 4.5927 17.786 3.2029 5.6424 linoleoyl-linolenoyl-glycerol (18:2/18:3) [1] 0.8831 0.4964 1.1273 1.1995 1.0473 0.5257 0.8359 0.972 1.0024 0.8623 0.8991 0.6761 1.0886 1.0267 1.2878 1.954 1.1057 0.9478 1.234 0.4964 0.6189 0.5784 0.4964 0.4964 0.9976 1.1219 0.9791 1.725 2.7209 0.8709 1.4517 linoleoyl-linolenoyl-glycerol (18:2/18:3) [2] 1.485 1.0591 1.1061 1.0604 1.0251 0.9816 1.2542 1.032 0.9468 0.7059 1.1728 0.7457 1.6179 1.246 1.2692 1.8371 1.0126 0.7469 1.3233 0.2767 0.9874 1.0245 0.8218 0.2112 0.6913 0.6246 0.6764 0.8089 2.6064 0.4961 0.8931 linoleoyl-linoleoyl-glycerol (18:2/18:2) [1] 0.7629 0.753 1.0565 0.7998 1.0041 0.6179 1.066 1.0841 1.6284 0.7377 0.7296 0.506 1.061 0.9441 1.0701 1.5915 0.9457 0.6668 1.0385 0.6316 0.9959 1.0934 0.7242 0.5703 1.1098 1.2828 1.5439 1.7435 4.9983 0.7847 2.9006 linoleoyl-linoleoyl-glycerol (18:2/18:2) [2] 1.3723 0.998 1.1707 1.1584 1.2248 0.8489 1.1814 1.0546 1.3552 0.5702 0.9579 0.8923 1.9699 1.4523 1.364 1.7219 0.9885 0.7271 1.4628 0.3564 1.002 1.0275 0.8917 0.2021 0.7546 0.7054 0.7515 0.5967 2.1458 0.3718 1.0336 maleate 1.4244 0.4714 0.4904 0.9481 0.8279 1.0238 0.9914 1.8773 1.2733 1.6717 1.0086 1.6915 0.3556 1.5924 1.3081 1.2287 0.9534 3.1671 1.32 1.1531 3.552 3.3267 1.5375 0.6867 0.7132 0.4458 0.7765 0.8085 0.6925 0.5237 0.3634 malonate 1.0221 0.8108 0.781 0.9592 1.0533 1.0916 1.0513 1.0713 0.9779 1.0431 1.0985 1.0902 0.3509 1.1815 1.0746 0.6167 1.035 1.2728 1.1983 0.7982 1.4157 1.2665 1.0645 0.5782 0.5916 0.4896 0.5253 0.6569 0.3668 0.938 0.1651 margarate (17:0) 0.7023 0.7074 0.7141 0.8808 1.2467 1.0177 0.9794 0.6242 0.6924 0.605 0.7811 0.4564 2.1413 0.9761 0.5422 1.0165 0.6089 0.7653 1.1202 2.1205 1.0625 0.9835 0.7726 8.8186 2.3401 2.2058 2.3868 2.1507 3.8935 1.4622 3.8729 mevalonate 0.7663 1.2255 1.3186 0.9744 0.6635 1.0699 1.023 1.34 1.4105 1.2957 0.6682 0.3541 1.9614 0.6917 1.2563 2.1889 1.3765 1.6386 1.7386 0.716 0.977 1.7558 2.0617 1.1914 0.3942 0.184 0.2036 0.4699 0.0653 0.7338 0.016 mevalonolactone 0.7646 1.1569 1.2866 0.8742 0.7069 1.156 0.8469 1.2374 1.3766 1.1213 0.6194 0.3325 1.7744 0.7605 1.0731 1.9172 1.4196 1.5998 1.6525 1.0029 0.9971 1.6334 1.596 1.3251 0.4821 0.1986 0.2879 0.5309 0.0902 0.7909 0.0264 myo-inositol 0.7769 1.3116 1.3281 1.7127 1.3144 1.1847 1.4249 1.0696 0.8131 1.4676 0.5919 2.0013 2.8286 1.3033 1.0859 2.3467 0.9256 0.8595 1.1136 0.7579 0.9304 1.3398 0.8457 2.1102 0.5822 0.5087 0.6347 0.5313 0.6287 0.6729 0.4191 myristate (14:0) 0.7472 0.67 0.7699 0.8314 1.478 1.0068 0.9929 0.9349 0.8957 0.6784 0.9171 0.5152 0.9932 1.3357 0.6362 0.8647 0.7763 0.9345 1.1525 2.2889 1.2721 1.0337 0.7852 4.4689 2.4538 2.2311 2.1351 2.078 4.0155 1.3196 4.1228 myristoleate (14:1n5) 0.9461 0.6342 0.9112 0.8261 0.7975 1.408 0.9364 0.4709 1.1369 1.1033 0.9521 0.5895 0.7249 1.0986 0.7178 0.6439 1.0638 3.4688 0.7735 1.487 0.7874 0.6871 0.694 1.0479 7.8618 1.2514 1.1254 3.0364 3.4567 1.091 2.6654 myristoleoylcarnitine 1.9166 3.119 0.8554 0.6982 0.8124 0.9097 2.1521 1.9373 0.9754 0.6207 0.922 0.4362 0.0695 0.4423 0.711 0.0695 2.0947 0.9439 1.3593 1.4098 0.6818 0.9496 1.6859 0.0695 2.8954 2.4769 3.0047 3.9699 2.3581 2.547 1.0246 myristoylcarnitine 1.7239 2.4782 0.7893 0.5788 0.76 0.9911 1.9118 1.4869 1.0984 0.7683 0.8409 0.4655 0.1532 0.4099 0.8425 0.4426 1.6509 0.8015 0.9609 1.4598 0.504 1.2861 1.0089 0.3097 2.7148 2.7642 3.6099 3.3243 3.6907 1.9775 1.5629 nervonate (24:1n9) 0.7 0.6441 0.7594 0.9882 1.0672 1.1606 0.7814 0.8447 0.758 0.6956 0.5679 0.3349 1.5351 0.8146 0.6429 0.7489 0.5848 0.7145 1.0529 1.6085 1.0118 0.9475 1.0527 2.6589 1.7839 1.8365 1.8923 2.1541 2.6288 1.6891 2.0322 N-oleoyltaurine 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.1934 0.8183 0.1934 1 1.0278 0.5682 3.5918 0.1934 4.0833 nonadecanoate (19:0) 0.6498 0.7676 0.6858 1.095 1.3299 1.224 0.7436 0.6323 0.7499 0.745 0.7083 0.4868 1.3483 0.883 0.6235 0.6987 0.8246 0.6453 1.0759 1.8021 0.9855 1.0145 0.7482 2.9307 1.8712 1.7481 2.1695 1.834 3.0759 1.5867 2.3524 N-palmitoylglycine 0.3506 0.3506 0.3506 0.3506 1.2277 0.3506 0.4777 0.3506 0.3506 0.3506 0.3506 0.3506 0.5503 0.7043 0.3506 0.3506 0.3506 0.3506 0.3697 1.0681 0.3506 0.3506 0.3506 0.7509 0.3506 1.2964 1.2633 1.1442 1.3058 0.9319 3.2586 N-palmitoyl-sphinganine (d18:0/16:0) 1.0606 1.922 0.8353 0.9824 1.0176 1.2575 1.4935 0.8725 0.7633 0.7237 0.6837 0.5003 1.4844 0.6501 0.5784 0.4548 0.7433 0.4636 0.5878 1.4484 0.7236 1.297 0.4889 1.2652 1.858 3.6097 3.1958 2.6886 8.613 1.4514 6.8167 N-palmitoyl-sphingosine (d18:1/16:0) 0.9336 1.6412 1.0184 0.9126 0.9816 1.2518 1.5802 0.7433 0.8175 0.8081 0.5998 0.46 1.1699 0.8136 0.6908 0.8097 1.1113 0.6489 0.6937 1.4316 0.8453 4.359 0.5851 1.8819 1.5442 3.6418 3.0011 2.5737 6.7333 1.5863 6.9369 N-stearoyl-sphingosine (d18:1/18:0) 0.8139 1.3978 0.6509 0.3904 1.0344 1.6047 1.9818 0.2596 0.6688 0.3923 0.2596 0.2596 0.8963 1.1206 0.3578 0.6208 0.9656 0.3073 0.5258 0.7034 0.8016 14.734 0.3422 1.8042 1.6119 3.7211 2.9057 2.4775 6.4224 1.8899 5.6395 octanoylcarnitine 0.9213 1.3337 1.0043 0.9017 0.9051 1.4576 1 0.7571 1.2615 0.9181 0.5133 0.4644 0.1856 0.7074 0.5165 0.1856 1.4428 0.8508 1.1333 1.1462 0.8231 2.6036 0.8388 0.1856 2.2338 1.1664 1.4585 2.5799 1.5397 2.0799 0.6577 oleate/vaccenate (18:1) 0.5012 0.493 0.4916 0.7293 1.8553 0.8506 0.97 0.5199 0.4544 0.2997 0.5199 0.2264 1.3874 1.288 0.4258 0.6668 0.4761 0.8891 1.03 3.5241 1.1607 1.0735 0.8354 5.5369 3.3308 3.3719 3.3032 2.6435 8.056 1.6429 7.2585 oleoyl ethanolamide 0.5964 0.9119 0.6095 0.8195 0.9174 0.8943 0.9851 0.8665 0.5525 0.4166 0.6468 0.3955 1.5114 0.9395 0.5934 0.8904 1.0404 0.6966 1.428 2.078 1.0149 1.5191 1.087 3.5617 2.2933 2.9135 2.034 2.749 3.0102 2.2 2.6428 oleoylcarnitine 1.014 1.5799 0.2251 0.2289 0.5842 0.9769 1.3601 0.3506 0.1421 0.2255 0.2126 0.1421 0.206 0.986 0.1421 0.5844 2.6987 0.2073 0.6157 1.7977 0.2766 3.5479 0.2063 1.8596 4.1622 7.2529 5.6693 4.2217 23.353 2.9562 9.2071 oleoylcholine 0.4267 0.4267 0.4267 0.4267 0.7239 0.4267 1.2204 0.4267 0.4267 0.4267 0.4267 0.4267 0.4267 0.8028 0.4267 0.4267 0.4518 0.4267 0.4267 0.4267 0.4267 1.1991 0.4267 1 0.6019 3.9561 1.6677 1.3659 7.915 0.7522 13.487 oleoyl-linoleoyl-glycerol (18:1/18:2) [1] 0.7187 0.593 1.0587 0.7713 0.9734 0.6394 1.3822 1.138 1.4048 0.7341 0.8744 0.5376 1.1046 1.2003 1.1625 1.3554 1.0536 0.5476 1 0.3124 0.8542 0.7251 0.8416 0.1898 1.391 1.1495 1.0225 1.3789 4.1334 0.6635 3.0746 oleoyl-linoleoyl-glycerol (18:1/18:2) [2] 1.2718 0.9571 1.0433 1.0548 1.2914 0.828 1.3513 1.1461 1.1887 0.8411 1.0328 0.8098 2.0826 1.6845 1.2123 1.5891 0.9672 0.775 1.2695 0.4006 0.8892 1.0927 0.9059 0.2308 0.9326 0.6706 0.7523 0.6271 2.9154 0.4367 1.1735 palmitate (16:0) 0.6663 0.6534 0.7577 0.8436 1.5169 1.0184 0.9474 0.6079 0.6564 0.6006 0.8296 0.4444 1.1976 1.35 0.5449 0.6441 0.6632 0.8549 1.1021 2.3695 1.0485 0.9816 0.8087 2.211 2.2117 2.135 2.2425 2.1867 3.7245 1.6288 3.4997 palmitoleate (16:1n7) 0.5738 0.6199 0.4934 0.5943 1.7054 0.8754 1.0478 0.6426 0.6817 0.3633 0.4918 0.2312 0.9489 1.1241 0.4838 0.7451 0.6861 1.1739 0.9522 3.2789 1.1471 1.3335 0.911 6.941 5.7165 5.0865 4.7327 3.8854 10.2062 1.8974 11.037 palmitoleoylcarnitine 1.9756 2.8735 0.843 0.6985 0.7397 1 1.8088 1.1624 0.7637 0.427 0.5749 0.2823 0.2823 0.4526 0.5593 0.5864 1.8183 0.9961 0.7353 2.0396 0.6944 1.4567 1.2989 0.4499 4.8531 5.5305 6.4791 5.5062 9.9566 3.3808 4.0963 palmitoleoyl-linoleoyl-glycerol (16:1/18:2) [1] 0.9879 0.5195 0.8261 0.807 0.9286 0.8989 1.0121 1.0725 1.0903 1.0131 0.8865 0.7978 0.5823 1.3086 1.3855 0.7798 0.5336 0.7527 1.0914 0.7121 0.3946 1.3297 1.2239 0.3946 1.1683 1.1044 1.3352 1.1092 2.7551 0.7316 2.5903 palmitoyl dihydrosphingomyelin (d18:0/16:0) 1.1126 2.21 0.886 0.8731 0.9833 1.1489 1.3637 1.0167 0.8914 0.806 0.763 0.5354 1.6868 0.648 0.6567 0.7079 0.8575 0.4554 0.6468 1.5207 0.6678 1.8748 0.4964 1.9937 2.2914 3.5526 3.41 2.926 9.0971 1.6547 4.8411 palmitoyl ethanolamide 0.9109 0.8188 0.4906 0.5854 0.8179 0.9959 1.065 0.6482 0.5489 0.6306 0.8131 0.5828 0.9055 1.5847 0.5324 0.9641 1.745 1.0041 1.1244 1.4509 0.9311 2.3187 0.7692 1.7193 1.8951 2.9531 2.1394 2.2407 3.9056 1.7558 3.9894 palmitoyl sphingomyelin (d18:1/16:0) 0.9298 1.7447 0.9457 0.7861 0.9497 1.1675 1.3893 0.7974 0.8447 0.7617 0.5901 0.4485 1.3645 0.803 0.6795 1.0436 1.0632 0.5643 0.7351 1.8517 0.7248 5.166 0.53 3.3255 3.2567 5.9215 5.3682 4.124 12.0605 2.8848 8.2871 palmitoyl-arachidonoyl-glycerol (16:0/20:4) [2] 1.0955 0.9653 0.9125 0.8394 0.2305 0.432 0.7767 1.26 1.1613 1.8783 0.9305 1.4077 1.0065 1.6193 1.6718 1.4858 1 0.372 0.5527 0.2305 1.2864 1.3547 0.9894 0.4035 0.2305 0.5361 0.2305 0.2305 2.2306 0.2305 1.461 palmitoylcarnitine 1.2136 2.1184 0.3726 0.5087 0.7284 1.1064 1.7259 0.6608 0.4505 0.3934 0.4089 0.2707 0.2532 0.8936 0.3068 0.6261 2.1604 0.2767 0.6456 1.4109 0.4051 4.6796 0.2215 1.8048 3.768 5.9271 4.8851 3.4325 18.5866 2.5884 8.6991 palmitoylcholine 0.6794 0.4879 0.6904 0.4879 0.8338 0.4879 1.2193 0.9009 0.7562 0.4905 0.5393 0.4879 0.4879 1.0698 0.9277 0.9119 1.0874 0.764 0.5256 1.4186 0.4879 1.0379 0.4879 1.7738 1.7472 4.9677 2.9582 2.2674 9.2665 2.151 17.5894 palmitoyl-linolenoyl-glycerol (16:0/18:3) [2] 1.2685 0.516 0.9445 1.061 0.9213 0.6023 1.3356 0.6649 0.5237 0.687 1.0705 0.5684 1.4764 1.3586 1.4147 1.9464 1.0607 0.516 1.4534 0.516 0.7913 0.516 0.8973 0.516 1 0.516 0.516 0.516 2.7682 0.516 0.6088 palmitoyl-linoleoyl-glycerol (16:0/18:2) [1] 0.5337 0.2046 1.0082 0.7464 0.9896 0.5735 1.7055 0.8344 1.0274 0.7441 0.4503 0.7866 1.1068 1 1.0327 1.803 1.5263 0.9419 0.6993 0.2046 0.9489 0.4684 1.407 0.2046 1.7518 1.0962 1.3176 1.7369 5.4424 0.2932 4.1589 palmitoyl-linoleoyl-glycerol (16:0/18:2) [2] 1.1403 0.9237 1.0381 1.0505 1.2739 0.7334 1.3505 1.0039 0.9286 0.8811 0.9632 0.8898 1.6137 1.5438 1.2559 1.4995 1.1338 0.8384 0.9961 0.3562 1.0608 1.115 1.2534 0.2441 0.9163 0.6379 0.5953 0.5983 2.7987 0.3615 1.1433 palmitoyl-oleoyl-glycerol (16:0/18:1) [2] 1.1705 0.9685 1.2003 1.2424 1.1857 0.9666 1.6935 1 1.0127 0.7498 0.8986 0.8001 1.292 1.5062 1.1638 1.4502 1.2954 0.8954 0.9591 0.3635 1.3397 0.9999 1.6446 0.111 0.7898 0.595 0.495 0.5166 2.8388 0.3001 1.3324 pentadecanoate (15:0) 0.7261 0.8744 0.7665 0.9298 1.1582 0.9648 0.8334 1.0231 0.9462 0.728 0.8355 0.5974 3.9516 1.038 0.6902 2.7533 0.7842 0.7192 0.9893 1.7142 0.9708 1.0107 0.8887 21.7194 1.7455 1.5662 1.7077 1.6756 2.5055 1.3043 2.5104 phytosphingosine 2.1899 2.7279 1.0044 1.5766 1.4316 1.5652 2.1309 0.9956 1.5313 0.8891 0.5049 0.5224 1.7648 0.5691 0.8702 1.7635 1.5983 0.8056 1.0514 0.7703 1.3097 1.3033 1.2085 1.6846 0.9831 0.7309 0.9382 0.7915 0.737 0.7577 0.1953 pinitol 0.8302 0.9932 0.9804 1.2216 0.9392 1.0442 1.048 1.0762 0.9545 1.0929 1.0068 1.1868 1.4006 0.875 1.0133 1.1335 1.2058 1.1315 1.2917 0.5862 1.2648 1.3144 1.3405 0.6947 0.4621 0.1953 0.3167 0.3725 0.0666 0.7035 0.0032 propionylcarnitine 1.1425 1.4613 0.9425 0.9158 0.9911 1.0562 1.5307 1.0444 0.8033 1.13 1.1041 1.0451 0.7849 1.2148 0.9959 1.1828 0.4892 0.5953 0.7112 0.9254 0.5057 0.8236 0.4652 0.547 1.673 1.3471 1.6402 2.6999 2.0358 0.9754 1.0041 sebacate (decanedioate) 0.809 0.6494 0.9345 0.888 0.7573 0.6672 1.136 1.0202 0.9282 1.1409 0.8417 1.2392 0.66 1.15 0.8044 0.7255 0.777 0.8137 0.966 0.8707 1.1916 1.0646 1.6174 1.2951 0.9798 1.7431 1.403 1.8905 1.5092 1.0343 1.1903 sphinganine 1.3788 1.7942 0.6145 1.0888 1.2092 1.2726 1.8576 0.5339 0.6667 0.4341 0.3968 0.2992 1.2046 0.4411 0.3592 0.6979 0.9641 0.5692 0.8723 0.9951 0.8804 1.0793 0.7682 1.8337 1.0098 1.2829 1.6143 1.1361 1.7063 0.8978 1.0049 sphingomyelin (d18:1/14:0, d16:1/16:0) 0.4851 0.6055 0.4083 0.4083 0.4083 0.9333 0.5238 0.4083 0.5413 0.4083 0.4083 0.4083 0.5755 0.5748 0.4083 0.4083 0.6704 0.4083 0.4083 1 0.4083 1.591 0.4083 1.6828 2.0721 3.2209 3.0325 2.5958 5.4839 1.3452 5.7429 sphingomyelin (d18:1/15:0, d16:1/17:0) 0.4162 1 0.4495 0.3816 0.5174 0.8431 0.5291 0.3816 0.5958 0.3816 0.3816 0.3816 0.9554 0.4058 0.3816 1.2627 0.3816 0.3816 0.3816 1.3969 0.5093 2.7521 0.3816 3.8476 2.6521 4.0461 4.0214 3.2313 6.1731 1.9068 3.7002 sphingomyelin (d18:1/17:0, d17:1/18:0, d19:1/16:0) 0.1965 0.1965 0.1965 0.1965 0.1965 0.1965 0.1965 0.1965 0.1965 0.1965 0.1965 0.1965 0.1965 0.1965 0.1965 0.4502 0.1965 0.1965 0.1965 0.1965 0.1965 1.162 0.1965 1.4336 0.5196 1.3647 1.2112 0.838 2.7432 0.7188 1.4761 sphingomyelin (d18:1/20:0, d16:1/22:0) 0.276 0.6338 0.1977 0.1977 0.9327 0.7261 1.149 0.1977 0.1977 0.1977 0.1977 0.1977 0.1977 0.9348 0.1977 1.0652 0.6455 0.4252 0.1977 0.3329 0.4069 11.1552 0.1977 1.2057 2.7222 2.5569 2.2926 1.7938 6.4438 1.0758 3.204 sphingomyelin (d18:1/24:1, d18:2/24:0) 0.938 0.8308 0.6104 0.4119 1.7095 1.6029 1.8802 0.8953 0.4874 0.5081 0.5809 0.2306 0.5127 1.9949 0.4863 1.5682 0.773 0.7447 0.2306 3.2002 0.6786 16.3033 0.2493 11.4652 16.3453 14.2464 15.3977 12.8753 37.5563 13.008 14.8612 sphingomyelin (d18:2/16:0, d18:1/16:1) 0.0934 0.0934 0.0934 0.0934 0.0934 0.0934 0.0934 0.0934 0.0934 0.0934 0.0934 0.0934 0.0934 0.0934 0.0934 0.1158 0.0934 0.0934 0.0934 0.3049 0.0934 0.8749 0.0934 0.6219 1.2154 1.0704 1.2498 1.3998 2.0053 0.9296 1.6715 sphingomyelin (d18:2/24:1, d18:1/24:2) 0.0622 0.0622 0.0622 0.0622 0.1691 0.116 0.1828 0.0622 0.0622 0.0622 0.0622 0.0622 0.0622 0.1997 0.0622 0.1652 0.0622 0.0622 0.0622 0.4325 0.0862 1.8799 0.0622 1.6097 1.9233 1.8111 1.9204 1.5675 6.2154 1.6494 1.8676 sphingosine 1.1643 1.4949 0.6281 1.0686 1.1881 1.5128 1.3455 0.3606 0.9008 0.4118 0.291 0.1888 1.8016 0.3944 0.3252 0.6502 0.9188 0.6053 0.6599 0.8089 0.9426 1.1069 0.7746 1.0949 1.1877 1.1894 1.278 1.2774 1.5619 1.0574 0.8623 stearate (18:0) 0.6685 0.7861 0.8221 0.9717 1.1842 1.106 0.7916 0.6509 0.6849 0.7187 0.822 0.5487 1.2924 0.9963 0.5562 0.6751 0.705 0.7971 1.1259 1.8896 1.042 1.0037 0.7499 2.095 1.7556 1.8744 2.0865 2.024 2.972 1.5033 2.4964 stearidonate (18:4n3) 0.9038 0.313 0.4849 0.6393 1.193 0.759 0.7644 0.6715 0.865 0.2894 0.4689 0.1276 0.7854 1.0161 0.2923 0.6032 0.6715 1.3331 1.2247 2.7793 1.4048 1.0668 0.9839 1.6851 3.6452 2.6798 2.1065 1.9085 6.3639 1.3557 6.7836 stearoyl ethanolamide 0.8766 0.6707 0.5893 0.485 0.7277 0.9884 1.0768 0.5531 0.5282 0.6212 0.726 0.6404 1.0424 2.0797 0.5808 0.7458 1.4688 0.7787 0.9653 1.0116 0.8031 2.1537 1.0288 2.0183 1.4906 2.2069 1.8243 2.2347 2.7673 1.3625 2.5228 stearoyl sphingomyelin (d18:1/18:0) 0.677 1 0.2564 0.2188 1.2509 1.1062 1.7237 0.6467 0.3579 0.4394 0.4929 0.2408 0.561 1.4305 0.2233 1.2823 0.8869 0.5039 0.3877 0.9327 0.528 15.8832 0.2188 1.9859 2.6992 3.6178 3.4667 2.4458 6.7731 2.1433 3.0273 stearoylcarnitine 1.1291 1.9048 0.6641 0.8709 0.6655 1.1911 2.1199 0.6701 0.5966 0.5343 0.3866 0.2422 0.5539 0.6615 0.4312 0.4494 1.2439 0.3356 0.7248 1.6086 0.659 3.6066 0.5187 2.6408 3.7747 5.7375 5.3253 3.9901 16.6136 2.5684 8.5474 stigmasterol 0.4506 1.3807 1.4633 0.8431 0.7355 0.7918 0.6684 1.091 1.534 1.1164 0.6624 0.7336 1.3385 0.4506 1.1429 1.0782 1.0191 1.2618 1.0833 0.6521 0.6885 0.8554 0.6448 2.2633 0.9909 1.8201 1.0091 1.5385 0.8664 0.8158 0.4506 suberate (octanedioate) 0.7724 0.7926 0.8642 1.1937 1.0029 0.9971 1.1613 1.4426 1.0924 1.4369 1.2034 1.6994 0.853 0.9547 1.4597 0.6814 1.054 1.3103 1.1669 0.7586 1.3918 1.4067 1.1958 0.6393 0.5128 0.4277 0.4476 0.7538 0.3686 0.8058 0.1834 suberoylcarnitine 1.071 1.1367 1.0282 1.0191 1.2616 2.625 0.6224 0.8989 1.9353 1.9032 0.7229 1.0203 0.872 1.0622 1.8457 0.3674 0.8016 1.8263 0.8077 0.3674 0.9689 0.6825 0.942 0.8891 0.3674 0.3674 0.3674 0.444 0.3674 0.9809 0.3674 tauro-alpha-muricholate 0.8331 0.0143 1.2128 2.1084 1.1609 0.7589 0.0143 0.4467 1.6809 1.9052 0.9794 0.7749 0.0914 0.8908 1.8049 0.2055 0.0143 1.0206 1.151 1.784 3.0569 2.244 0.0143 0.0143 1.7204 0.4877 0.2389 0.9228 0.6382 1.7508 0.0143 tauro-beta-muricholate 4.2528 5.8067 0.664 3.0563 1.3765 0.6448 21.2581 1.1168 1.0947 0.4245 1.2964 1.9849 0.0453 0.3929 0.5057 0.242 5.4279 2.5548 2.2775 0.9053 4.3462 6.3554 30.7226 0.0348 0.6906 0.6999 0.5231 0.3494 1.4859 0.6634 0.5215 taurochenodeoxycholate 3.6641 4.0143 0.7262 2.5591 1.8271 0.7594 10.528 0.6779 0.837 0.4254 1.3074 1.3394 0.0441 0.5852 0.5322 0.2957 2.593 2.4067 1.3285 1.163 1.7897 2.6683 17.0819 0.019 0.6677 0.7755 0.4259 0.3149 1.6702 0.5596 1.6652 taurochenodeoxycholate sulfate 0.9377 1.3571 3.2364 2.5281 1.4933 2.1888 0.6372 0.6843 2.3864 3.7797 0.8123 0.415 0.7759 1.9533 2.9737 0.2995 0.453 1.1051 0.3771 0.8712 1.7251 1.7964 1.2172 0.4678 1.2717 0.2775 0.217 1.0623 0.3741 1.6396 0.016 taurocholate 3.4716 4.8989 0.7695 3.2753 2.0828 0.7475 15.4387 0.9042 1.3325 0.6087 1.063 1.3773 0.0319 0.5681 0.6456 0.2768 4.0289 2.6307 1.4198 0.942 4.0044 5.2412 19.6169 0.0318 0.6121 0.4755 0.3832 0.3939 1.8688 0.6744 1.058 taurocholenate sulfate 3.6921 4.3912 0.7885 0.949 0.5386 0.6348 4.7258 4.0485 1.051 1.2585 3.6363 3.2305 2.3253 0.659 0.8614 1.3754 3.5303 0.3693 2.7959 0.438 0.555 0.7318 2.9162 3.7569 0.5075 2.2883 3.2383 0.5051 0.3432 0.6309 0.2073 taurohyodeoxycholic acid 3.2321 4.4049 0.4827 3.004 1.973 0.6018 13.2973 0.3948 0.8519 0.2143 0.8943 1.3161 0.0955 0.448 0.3122 0.0955 4.7266 3.1458 1.2637 1.2954 2.7435 4.826 21.6121 0.0955 0.286 0.4506 0.398 0.1403 1.8316 0.3826 0.381 tauroursodeoxycholate 3.9492 4.4421 0.7606 2.4055 2.0237 0.9041 14.6055 0.9946 0.9789 0.5389 1.7365 1.925 0.0513 0.566 0.6888 0.1855 3.5181 2.8576 2.0031 1.5369 2.4204 3.2424 21.8296 0.0275 1.0054 0.9292 0.6479 0.5217 1.6406 0.7758 0.8194 tetradecanedioate 0.518 0.6913 0.7811 0.518 0.518 0.5488 1.2533 0.518 0.518 0.518 0.5903 0.518 0.755 0.6902 0.8243 1.0255 0.7643 0.9018 0.518 0.518 0.518 0.9745 1.2739 2.1615 1.6375 1.668 1.3956 1.7812 2.5693 0.518 3.4607 tricosanoyl sphingomyelin (d18:1/23:0) 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 0.6358 1 0.6358 0.6358 1.9638 1.1358 1.3228 0.8536 1.7283 0.8295 0.9923 trimethylamine N-oxide 2.0942 2.9217 0.8864 1.0361 1.0144 0.9329 2.4544 2.318 0.8275 1.0222 2.1668 2.8846 0.3442 0.791 0.6971 2.438 1.1116 0.9088 0.6433 0.0589 1 0.6099 1.31 2.6701 0.1747 0.0551 0.0564 0.08 0.0551 0.0551 0.0551 undecanedioate 0.8635 0.4736 0.6801 0.7689 0.487 0.9892 1.251 0.8741 1 0.9901 0.9891 0.7933 0.9346 1.188 1.0667 1.5123 0.956 1.2319 1.2031 1.1266 0.8414 1.1375 0.4736 1.5737 0.8296 1.8385 1.0428 1.2613 1.2234 0.9195 1.8227 valerate 0.2095 0.2095 0.2095 0.2095 0.2095 0.2095 0.2095 0.2095 0.2095 0.2095 0.2095 0.6063 0.2095 0.2095 0.2095 0.2095 0.2095 0.2095 0.2095 0.8719 0.2095 0.2095 0.2252 0.2095 0.6618 1.685 1 1.4212 1.0076 1.108 0.2095 1-methyladenine 0.8414 0.8904 0.9264 1.1062 0.9192 0.9391 0.9752 1.0621 1.0248 1.1427 1.0795 1.2203 1.0446 1.0431 1.1044 1.2058 1.1097 1.4177 1.2718 0.8264 1.1744 1.2301 1.177 0.783 0.6597 0.487 0.4978 0.6484 0.3915 0.9241 0.1414 1-methylguanine 0.9995 0.7843 1.1273 1.4155 0.8904 0.9937 0.7414 1.3203 1.5528 1.7181 1.2407 1.7501 0.6825 1.3466 1.4697 1.0005 0.9124 1.1496 1.073 0.5475 1.0421 1.0341 1.2465 0.3457 0.2707 0.1151 0.1612 0.2184 0.1151 0.4915 0.1151 2'-deoxyadenosine 1.2753 1.4317 0.7519 0.6673 1.0669 1.6258 2.2479 1.2346 0.2411 0.9331 1.8744 0.7577 66.3422 0.3978 0.9072 270.9539 1.461 0.2411 0.4132 0.2568 0.2828 1.5852 0.6997 246.666 0.2411 0.3831 0.2411 0.2411 0.3542 0.2411 0.2411 2'-deoxyadenosine 5'-monophosphate 0.1051 0.1051 0.1051 0.1051 0.1051 0.1051 0.2084 0.1051 0.1051 0.1051 0.1051 0.1051 0.1051 0.1051 0.1051 1.5319 0.1051 0.1051 0.1051 0.1051 0.1051 0.4681 0.1051 2.7072 0.1051 0.1051 0.1051 0.1051 0.1051 0.1051 0.1051 2'-deoxycytidine 2.2277 5.3554 0.6039 0.5233 1.8205 3.6459 10.8178 1.001 0.2147 0.6256 2.9621 0.3719 0.4573 0.5241 1.5586 1.6328 4.5624 1.5131 1.1737 0.8695 0.999 4.8845 1.3654 1.864 0.5562 0.6822 0.6588 0.7244 0.693 0.4603 0.1634 2'-deoxycytidine 5'-monophosphate 0.073 1.3282 0.073 0.073 0.073 0.453 2.304 0.073 0.073 0.073 0.126 0.073 0.073 0.073 0.2211 2.7487 1 0.073 0.073 0.073 0.073 2.4182 0.073 3.7534 0.2148 0.073 0.073 0.0934 0.073 0.073 0.073 2'-deoxyguanosine 0.3501 2.2494 0.3501 0.3501 0.6853 1.0278 4.9407 0.3962 0.3527 0.5601 1.6513 0.6184 1.6766 0.3501 0.5089 6.1549 2.7894 0.7086 0.7002 1.6049 0.552 1.9831 0.9722 21.0385 1.2543 0.6624 0.7398 1.4262 0.4032 1.7094 0.3501 2'-deoxyinosine 1.0445 5.1846 0.3916 0.2472 0.9492 2.2829 11.3193 0.4481 0.2472 0.3877 2.0327 0.6114 0.9771 0.349 0.8579 8.6231 6.2524 1.7308 1.4208 0.529 1.0392 5.8417 1.9677 21.3706 1.0229 0.9338 0.3389 0.6247 0.807 0.3538 0.2472 2'-deoxyuridine 0.3441 0.838 0.3441 0.3441 0.3441 0.5739 3.6447 0.3441 0.3441 0.3441 0.3865 0.3441 2.1971 0.3441 0.3441 21.0196 1.2592 0.7057 0.7243 0.3589 0.3441 2.091 0.5455 79.0087 0.8838 2.401 0.9247 1 3.5521 0.3441 1.5696 3-ureidopropionate 0.5532 0.9502 0.4 0.7017 1.007 1.176 0.993 0.6834 0.7675 0.5654 0.6039 0.4818 1.6072 0.6546 0.7448 0.3964 0.9612 3.072 1.3341 0.6924 0.9637 1.7958 2.4542 5.6524 1.3664 4.5448 3.4054 2.8404 11.7897 1.9063 12.4844 5,6-dihydrothymine 0.9196 0.9801 0.3787 1.8936 1.9215 0.7575 1.0672 0.7554 0.3943 0.3787 0.7979 0.7465 1.1345 1.9896 0.7516 1.7429 0.8401 0.5342 1.1491 0.7277 2.4444 2.5087 1.0006 7.7605 0.8788 1.6165 1.8432 0.9994 2.9968 0.7054 4.3586 5-methyl-2'-deoxycytidine 1.2601 1.8878 1.0486 1 0.8904 1.1266 3.5874 1.1657 0.6998 0.716 1.8491 1.3245 0.7555 0.8768 1.3621 1.7478 2.5905 1.5068 0.9011 0.6828 0.8936 2.0288 1.2153 0.9458 0.463 0.4148 0.4142 0.2877 0.4934 0.6499 0.2877 5-methyluridine (ribothymidine) 0.7122 0.8693 0.8578 1.2636 0.619 1.8047 1.1472 0.96 1.089 1.1733 0.619 0.9832 3.5119 0.6482 0.6615 0.619 1.1927 2.0083 1.7226 0.9454 1.6755 1.4639 1.1925 0.619 0.619 0.8241 0.619 1.0168 0.9688 0.8651 0.7091 7-methylguanine 1.0985 0.9635 1.2008 1.18 1.0412 1.0927 0.8521 1.2732 1.3813 1.329 1.1701 1.3056 0.8712 1.2453 1.2489 1.0398 0.8473 1.0495 0.9894 0.6435 1.0724 0.9751 1.0106 0.7873 0.4407 0.2691 0.3218 0.3815 0.1605 0.6696 0.0588 8-hydroxyguanine 1 1.1876 0.9561 1.2035 0.8508 1.1979 1.1832 1.4985 0.8595 1.2118 1.3833 1.1555 1.8769 1.2146 1.089 0.7079 0.8257 1.1593 0.4107 0.157 2.2741 0.6914 0.8614 0.4976 0.0973 0.0973 0.1511 0.0973 0.0973 0.0973 0.0973 adenine 0.7921 0.988 0.8442 1.0642 1.012 1.1394 0.9589 0.6168 0.3707 0.7595 0.6491 0.791 42.0801 1.1839 0.434 26.8692 0.2608 0.2686 0.3172 1.7671 0.4701 0.5626 0.3789 35.0759 2.1707 3.8925 3.4237 4.4201 4.014 1.5728 2.4206 adenosine 1.1124 1.0024 1.0837 0.878 0.8588 1.0351 1.0246 1.1094 0.9052 0.9976 1.2119 0.9427 2.6534 0.9866 1.0459 31.1745 1.049 0.8803 0.9598 0.9447 0.8488 0.9164 0.862 40.0894 0.9162 1.2459 0.9356 0.8503 1.338 0.817 1.1021 adenosine 3',5'-cyclic monophosphate (cAMP) 0.5176 0.5656 0.7518 1.6222 0.5634 0.7198 0.5176 0.9137 1.1612 2.6381 1.2847 2.1477 0.5176 1.3628 1.9117 0.7126 0.5176 1.3709 0.5465 0.5176 1 0.5848 1.6085 0.5176 0.5176 0.5176 0.5176 0.5176 0.5176 0.5176 0.5176 adenosine 5'-monophosphate (AMP) 0.1304 0.1304 0.1304 0.1304 0.1304 0.1304 0.1304 0.1304 0.1304 0.1304 0.1304 0.1304 0.3505 0.1304 0.1304 1.4784 0.1304 0.1304 0.1304 0.1304 0.1304 0.1304 0.1304 3.3281 0.2604 1.4078 0.85 0.6763 1 0.1304 1.8592 allantoin 1.0503 1.173 0.9491 0.9092 0.9117 1.2061 1.2332 1.2913 1.0586 0.9909 1.0091 1.1679 1.1929 0.7761 0.9281 0.9603 1.0492 1.6891 1.1246 0.7334 1.0385 1.1159 1.2981 1.1348 0.7944 0.5841 0.7133 0.8041 0.5483 0.9534 0.3389 beta-alanine 0.7068 0.8346 1.0039 0.7831 1.0802 1.1367 1.3259 1.0204 0.914 0.9961 0.8456 0.9359 2.5704 0.7718 0.9953 1.7289 1.0144 1.2752 1.4287 0.9579 1.6106 1.6816 1.3142 2.3001 0.9359 0.5256 0.6251 0.7033 0.6786 1.2206 0.7384 cytidine 0.8802 1.0021 0.3548 0.5784 0.9979 0.7612 1.2988 0.5626 0.4529 0.4542 1.0376 0.5272 0.594 1.0282 0.6386 2.3266 0.8254 0.8744 0.57 2.276 0.7007 2.5074 0.7094 2.7259 3.042 4.4896 5.1452 3.9617 11.1945 2.0377 1.7037 cytidine 2',3'-cyclic monophosphate 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 0.1489 1.1288 0.1489 0.1489 0.1489 0.1489 0.5784 0.1489 1 cytidine 5'-monophosphate (5'-CMP) 0.2919 0.9812 0.2707 0.4168 0.2707 0.7218 1.649 0.3597 0.2707 0.5491 0.522 0.3494 1.4856 0.4394 0.4369 6.5088 1.2768 0.7363 0.7884 2.5898 0.4499 1.0188 0.822 14.2456 4.2413 9.7387 9.0399 6.0459 15.2701 1.9807 3.5183 cytosine 0.915 1.2815 0.8738 0.9767 0.9221 1.0699 1.4296 0.7247 1.0469 0.8712 0.5131 0.5479 2.1972 0.4827 0.6562 0.4315 1.2601 0.8281 1.1645 0.711 1.1695 1.2682 1.2325 0.8231 0.4066 1.0592 1.0556 1.0035 1.311 0.9965 1.086 dihydroorotate 0.4628 0.1279 0.2984 0.2419 0.1707 0.1279 0.5949 1.8793 0.1907 1.2355 0.1279 75.2781 1.1806 0.2571 5.8661 1.2433 1.6791 0.4075 9.1582 0.2803 0.2913 2.1147 1.2531 1.5293 1.0316 1.1179 1 0.865 0.9456 0.3911 0.1279 guanine 0.9895 1.1841 0.9164 1.0608 0.9492 0.9114 1.661 0.9657 0.8724 1.0388 1.0755 1.3699 0.8422 1.0105 1.1892 3.0162 1.5004 1.1597 1.055 0.8294 0.8298 1.2173 1.5164 1.8922 0.5312 0.4708 0.4563 0.4847 0.2222 0.527 0.061 guanosine 1.1654 0.3619 0.3619 0.4564 0.3619 0.3619 0.3619 0.3619 0.8952 0.7088 0.3619 1.0653 1 0.8065 0.8768 52.9054 0.8785 1.248 1.9003 0.3619 0.878 0.3619 0.5668 62.3214 0.5894 1.9269 1.2714 0.3619 5.6028 0.7831 9.0738 guanosine 5'- monophosphate (5'-GMP) 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 0.2561 2.4041 0.2561 0.8662 0.3535 0.2561 1.4168 0.2561 1 hypoxanthine 0.4374 0.9538 0.3867 0.5238 0.5922 0.8587 1.3516 0.4719 0.3094 0.4868 0.3638 0.7174 0.4183 0.5928 0.5183 1.0082 1.3577 1.1165 1.298 0.9017 1.1661 2.2389 1.3202 2.0539 1.0644 1.4717 1.2268 1.192 1.9372 0.9918 1.3481 inosine 1.0432 0.803 0.305 0.3577 0.3448 1.0297 1.1106 0.3749 0.4491 0.481 0.305 0.305 1.5819 0.317 0.305 12.2621 1.25 1.1194 1.475 0.6292 0.8312 1.3153 0.6947 12.123 0.5917 1.7346 1 0.8926 5.9197 0.8116 15.7312 methylphosphate 0.6538 0.949 0.7576 0.7575 0.6582 0.6236 0.7944 0.95 0.7363 0.8433 0.6114 1.05 5.0793 0.7266 0.8573 2.5902 1.3958 0.6096 1.2577 8.5288 0.5885 1.3779 0.6212 41.7405 8.3257 13.5148 13.5951 5.4588 8.2118 3.5017 2.6762 N6,N6-dimethyladenosine 4.4181 2.581 1.4362 1.7271 1.5706 1.8309 2.9014 0.9637 0.253 0.8504 3.708 1.0363 0.5195 0.5653 0.7023 0.253 1.8654 0.7863 0.3936 0.253 0.253 0.5957 0.7205 0.253 0.253 0.253 0.253 0.253 0.253 0.253 0.253 N6-carbamoylthreonyladenosine 3.7639 4.0996 3.6374 3.6998 2.2101 3.5718 2.4633 2.4834 2.8562 1.9552 3.1917 0.7256 0.965 1.8705 2.225 3.0001 0.4775 0.3215 0.3285 0.3873 0.156 0.6542 0.1729 1.0194 0.6287 0.6432 0.585 0.5325 1.0735 0.9806 0.6772 N6-methyladenosine 0.9088 1.4852 0.2309 0.2309 0.2309 0.2309 2.381 0.4219 0.2309 0.2309 1.9307 0.2309 0.2309 0.2309 0.7406 3.1783 1.3584 0.7715 0.3473 0.2309 0.2309 1.0912 0.5273 6.3977 0.2309 0.2309 0.2309 0.2309 0.2309 0.3977 0.2309 N6-succinyladenosine 1 1.2051 1.0087 1.2441 1.1835 1.081 1.4137 1.0837 1.1272 1.2812 0.8013 0.9554 0.6495 0.9469 1.3727 0.7889 0.98 0.948 1.1439 0.7627 1.0587 1.3196 1.2545 1.1758 0.7846 0.6581 0.7963 0.6555 0.6529 0.8269 0.3456 N-acetyl-beta-alanine 0.4718 1.0382 0.706 0.5179 0.6662 0.6586 1.1268 0.7326 0.8357 0.5668 0.3147 0.8442 1.0486 0.3147 0.3147 0.7301 0.9494 0.9837 1.2091 0.52 1.3044 1.1739 1.11 1.6157 1.4726 1.4189 1.0603 0.7768 1.0163 1.1854 1.2361 N-carbamoylaspartate 0.3088 0.2379 0.3605 0.7594 0.524 0.3912 1.2111 0.9928 0.3272 0.5848 0.2164 30.6846 0.4239 0.3251 2.7005 0.8123 2.4014 1.0072 8.6699 1.0196 1.2685 5.4184 5.7009 1.2101 1.5931 0.8356 1.5968 1.8314 0.4861 2.1775 0.041 orotate 0.9612 0.8594 0.954 1.1145 1.0388 1.143 1.368 1.2404 0.9597 1.105 1.0967 2.7994 0.8804 1.1383 1.2721 0.8965 1.6033 1.535 2.3667 0.7317 1.4932 2.0655 1.7079 0.1079 0.5683 0.2653 0.3651 0.4868 0.1098 0.8637 0.0223 orotidine 1.0646 1.4968 1.193 1.1933 1.1823 1.5602 1.304 1.3933 1.368 1.2063 0.8608 0.942 1.4287 0.8216 0.957 0.8929 0.9439 1.8344 1 0.5512 1.2742 1.4125 1.1647 0.5727 0.7482 0.3319 0.469 0.5509 0.3182 0.8069 0.1341 pseudouridine 2.9269 0.6528 0.5379 0.7501 0.4233 0.2772 0.8633 1.431 0.6999 1.8272 2.276 1.4198 0.2715 0.9922 1.8101 2.3628 0.4474 0.639 0.3533 1.0078 0.3747 0.8665 0.8246 5.1531 1.2706 3.6532 2.7181 2.1508 7.908 0.9084 5.9952 thymidine 1.739 3.8378 0.3137 0.4373 0.8144 1.7424 10.1635 0.7839 0.1977 0.6848 2.2892 0.6676 1.2611 0.3677 1.9024 15.7288 3.5451 0.9944 1.2494 0.5375 0.3933 4.5995 1.0056 27.3606 0.7116 1.2548 0.7249 0.5871 1.5398 0.4666 0.9539 thymidine 5'-monophosphate 0.5947 0.9483 0.5947 0.5947 0.5947 0.5947 1.0321 0.5947 0.5947 0.5947 0.5947 0.5947 0.7967 0.5947 0.5947 4.1105 0.5947 0.5947 0.5947 0.5947 0.5947 0.5947 0.5947 6.723 0.5947 0.609 0.5947 0.5947 1 0.5947 0.5947 thymine 0.618 1.6869 0.4857 0.9447 1.0126 1.3971 4.061 0.4496 0.2613 0.4811 0.4885 0.5065 1.5559 0.3172 0.5518 2.9992 2.2816 1.549 1.8987 0.9874 1.5291 3.3777 1.9794 9.0224 0.788 1.2228 0.7019 0.81 1.1682 0.8116 0.3672 uracil 0.399 0.7042 0.1378 0.3473 0.4685 0.5676 1.5591 0.5562 0.2256 0.5619 0.3733 0.4878 1.2732 0.66 0.6753 3.3052 0.9921 0.74 1.0529 1.0079 0.6808 2.3225 1.1438 11.2464 1.9709 4.4161 3.0461 3.0374 5.9308 1.482 2.482 urate 0.9493 1.0701 0.9964 1.9549 1.893 1.0003 1.2048 0.9578 0.9595 1.1329 1 1.0285 1.1145 1.8223 1.0218 0.1498 0.1111 0.1868 0.1111 0.1695 0.2306 0.3442 0.1749 1.0636 0.4714 1.3133 1.2866 0.8323 2.2154 0.453 1.4471 uridine 0.5887 1.0182 0.2796 0.4598 0.5996 0.4845 1.2047 0.4513 0.3382 0.4015 0.7201 0.3595 3.1973 0.3826 0.6665 22.5028 0.9818 0.7466 1.0896 2.3534 0.284 1.1674 0.5727 90.191 2.5535 16.6106 7.2833 3.0762 34.7345 1.3928 25.8305 xanthine 0.0989 0.6486 0.0756 0.305 0.3653 0.9397 1.4772 0.0713 0.0545 0.0737 0.0515 0.0831 1.7252 0.1767 0.0877 1.6764 0.4249 0.5193 1.0755 2.3508 1.0603 1.8621 0.8685 11.1015 2.9547 8.5713 6.0153 5.4873 9.9165 2.829 6.1261 xanthosine 0.1919 0.1919 0.1919 0.1919 0.1919 0.1919 0.1919 0.1919 0.1919 0.1919 0.1919 0.1919 0.1919 0.1919 0.1919 0.399 0.1919 0.1919 0.1919 0.4471 0.1919 0.1919 0.1919 2.4413 0.4641 1.6091 1.1814 0.8186 3.7805 0.5693 3.8952 alanylleucine 1.2533 0.6799 1.7235 0.5359 0.3907 0.4588 0.4825 3.0711 0.9356 3.1663 1.3689 4.3118 0.2799 0.8445 2.9301 2.7704 0.8998 0.7176 0.6948 1.2344 0.4446 0.7364 0.5292 0.3335 1.0882 1.1644 1.0644 1.424 1.4662 1.6087 0.1814 anserine 0.9715 0.9794 1.1202 1.2097 1.1153 1.08 0.9178 0.9479 0.9949 1.149 1.0311 0.9978 0.9227 0.9824 0.9073 0.8314 0.9932 1.2601 1.0022 1.0658 1.3183 1.3999 1.1585 0.877 1.1851 0.6705 0.7696 1.0812 0.5485 1.1408 0.1237 carnosine 1.0429 1.0025 1.2611 1.322 1.1796 0.9975 0.9311 0.8528 0.9404 1.1028 1.2877 1.0593 1.1367 1.0084 0.9147 0.8316 1.0465 1.2625 1.2948 0.7583 1.179 1.0855 1.2511 0.7622 0.8892 0.6009 0.5527 0.6825 0.2985 0.8425 0.5635 gamma-glutamylalanine 0.577 0.9638 0.4894 0.7692 0.8605 1.0808 2.086 0.6197 0.4239 0.3948 0.7064 0.3822 0.854 0.6646 0.3665 0.4949 1.0362 1.4823 0.9573 2.0501 1.8338 2.749 1.3033 1.7684 2.6515 3.9403 4.2423 3.2671 3.4902 1.1081 0.5049 gamma-glutamylcysteine 1.1359 1.2143 1.1703 1.4422 1.1545 1.3068 1.2968 1.15 0.9825 0.9192 1.0258 0.8735 0.8694 0.9585 0.9559 1 1.3501 1.18 1.2543 0.76 1.4402 1.2201 1.3352 0.4669 0.6159 0.3905 0.3975 0.5971 0.1607 0.8565 0.1607 gamma-glutamyl-epsilon-lysine 0.7389 0.844 1.2348 1.1796 1.1723 2.0513 1.0447 1.0096 2.1963 1.6814 0.9579 0.9617 1.0359 0.9382 1.0316 0.9904 1.0814 1.6187 1.29 0.7228 2.1282 1.7628 1.2095 0.6507 0.8596 0.3325 0.3948 0.5817 0.1986 0.8795 0.0145 gamma-glutamylglutamate 0.5757 1.1222 0.6566 0.7321 0.6418 0.9358 1.377 1.045 0.4634 0.8373 0.8858 0.955 0.2535 0.6113 0.7823 0.3722 1.5908 1.8277 1.9063 1.683 1.406 3.0606 1.7955 0.2546 1.975 2.8633 2.4693 2.6631 3.068 1.8254 0.8266 gamma-glutamylglutamine 0.2184 1.0409 0.1861 0.4269 0.6952 1.2875 3.5811 0.1055 0.1332 0.3165 0.5595 0.3691 0.1055 0.6668 0.2952 0.3213 0.9186 1.7355 1.9852 5.256 1.6849 3.8119 2.0183 1 8.2093 14.8593 12.718 13.9369 10.9181 5.3334 0.7462 gamma-glutamylglycine 1.1316 1.2491 1.353 1.5539 1.2654 1.5277 1.1908 1.1283 1.2457 1.4937 1.1905 0.9112 1.06 0.9911 1.0915 0.7379 0.7326 1.0089 0.7618 0.7406 1.2298 1.1561 0.8692 0.5257 0.613 0.3784 0.5204 0.6664 0.477 0.6215 0.0712 gamma-glutamylhistidine 0.6396 0.9828 0.7402 0.9898 0.7622 1.1625 1.4665 0.9169 0.6507 0.8587 0.8654 0.7143 0.9601 0.4135 0.6706 0.745 1.1428 1.2255 1.5977 1.4781 1.347 1.8459 1.3732 0.9133 2.2076 3.7575 3.3239 3.1005 4.8375 1.4 1.0102 gamma-glutamylisoleucine 1.9021 1.4325 2.4707 2.0552 1.8026 2.3511 1.1758 1.2701 1.0375 1.4381 1.0721 0.9798 0.5378 2.0357 1.3529 0.5843 1.3657 1.3267 0.7074 0.205 0.6258 1.0202 0.5604 0.1913 0.1552 0.1057 0.1356 0.1752 0.0814 0.1175 0.0117 gamma-glutamylleucine 0.7299 0.9578 0.6626 0.9129 1.0211 1.2317 2.3709 0.9495 0.5676 0.8447 0.8114 1.1756 0.2496 1.7635 0.9199 0.9789 1.4764 1.3876 0.8805 3.5099 0.8456 3.4837 0.9617 0.6046 4.3745 6.1247 5.7002 5.6313 6.7739 3.0969 0.3164 gamma-glutamylmethionine 0.4131 1.0314 0.3679 0.6741 0.7518 1.2816 2.5477 0.4088 0.2935 0.3882 0.5262 0.3046 0.5064 0.6832 0.4041 1.7613 0.9579 1.2609 0.6407 2.8364 1.2713 3.9773 1.175 0.9686 4.809 7.7773 7.2422 5.8408 5.9873 2.089 0.5164 gamma-glutamylphenylalanine 0.763 0.7462 0.9785 1.0857 0.9124 1.1925 1.2317 0.923 0.7788 1.2468 0.7865 0.9365 0.4057 0.9994 0.9992 0.901 1.1427 2.0066 0.8995 1.3182 1.1811 1.5432 1.0006 0.4556 1.6369 2.2134 2.3171 1.9078 2.628 0.7528 0.5429 gamma-glutamyltryptophan 0.4473 0.9981 0.4782 1 0.7219 1.3021 3.0037 0.7035 0.2076 0.3556 0.8496 0.3999 0.1976 0.4779 0.1285 0.1285 0.574 1.1836 1.0608 3.6303 1.9482 2.4297 1.8304 0.9858 5.1047 10.4708 8.1437 8.5692 18.2436 2.7414 10.4764 gamma-glutamyltyrosine 0.5536 1.0571 0.7404 0.8262 0.789 1.3062 2.3947 0.8212 0.4796 0.9429 0.8049 0.721 0.2765 0.5956 0.7344 0.4535 0.575 1.2834 0.5933 3.0774 1.0796 2.1049 1.1694 0.3832 5.2009 10.0665 8.8281 6.499 12.3061 1.597 4.665 gamma-glutamylvaline 0.4458 0.6448 0.741 0.5875 0.5522 0.4588 0.6696 1.0193 0.4539 1.6188 0.6687 2.0924 0.5463 0.7164 1.5279 0.3902 1.2117 0.9807 0.9131 2.299 0.5911 2.1707 1.1082 0.5114 3.0615 6.1435 4.1913 4.6618 5.756 2.75 2.0688 glutaminylleucine 0.6943 0.7537 0.9096 0.5055 0.2392 0.3192 0.6766 1.7621 0.6055 1.7798 0.8774 1.6546 0.1599 0.488 1.4014 1.634 1.9577 0.9074 2.1338 1.9774 0.3637 1.0904 0.593 0.2135 2.167 4.8905 4.0976 2.9964 2.83 1.955 0.079 glycylisoleucine 0.6972 1.2548 0.6039 0.7806 0.8434 0.8308 1.7142 0.7823 0.543 0.6474 0.9163 0.9124 0.157 1.0434 0.6921 0.7044 1.0722 1.2102 1.2447 2.1304 0.9566 4.0296 1.3662 0.1378 2.2473 2.9738 2.7812 2.7308 2.9093 1.4923 0.0281 glycylleucine 0.7335 1.0652 0.59 0.722 0.7447 0.8622 1.8382 0.7924 0.3603 0.6118 1.094 1.0521 0.1497 1.1417 0.6927 0.9362 0.8886 1.1577 0.8049 1.9893 0.9479 2.478 1.0789 0.2267 2.1579 2.5652 2.6003 2.5675 2.1557 1.3802 0.1592 glycylvaline 0.7314 0.9864 0.7253 0.6855 0.6529 0.7745 1.7566 1.2138 0.4956 0.8926 0.9252 1.3927 0.1441 1.0613 0.8854 0.5595 1.1031 1.2573 1.166 1.2623 1.0002 2.7091 0.9998 0.1241 1.2971 2.2382 1.928 1.6756 2.1263 0.8946 0.0905 histidylalanine 1.1084 1.6336 0.6808 0.4342 0.649 0.9513 1.6218 1.3079 0.4685 0.8644 0.9085 0.8255 0.0959 1.8707 0.6676 0.0959 1.0487 0.5058 0.7677 2.4269 0.5588 2.876 0.4014 0.0959 4.5548 5.1336 6.9303 6.2937 4.4786 2.6087 0.0959 isoleucylglycine 0.723 0.7549 0.7014 0.5418 0.4778 0.5257 0.906 1.1071 0.5343 1.0135 0.9253 1.4214 0.3042 0.7104 1.0823 1.6548 1.036 0.9865 1.038 1.5188 0.6147 1.4063 0.699 0.3281 1.3796 2.1076 1.7193 1.909 2.8514 1.386 0.1584 leucylalanine 1.0192 0.573 0.9808 0.4178 0.2927 0.3627 0.5263 1.9191 0.6523 2.3829 0.8182 2.2779 0.1436 0.7299 1.9405 1.4874 1.2883 0.8959 1.2171 1.6145 0.4504 0.7512 0.6036 0.1836 1.3383 1.9949 1.6846 2.2343 1.8526 2.4003 0.3335 leucylglutamine 0.8436 0.4126 0.7331 0.3219 0.2403 0.2904 0.4743 1.7272 0.4532 1.6766 1.1424 2.8796 0.146 0.5761 1.7548 1.0199 1.1587 0.9801 1.4536 1.7872 0.3905 0.6033 0.8324 0.1005 1.1556 1.3089 1.0366 1.7628 1.334 2.6901 0.0628 leucylglycine 1.2831 0.9113 0.6923 0.5177 0.4792 0.5435 0.9389 1.0611 0.4676 0.8198 0.8813 1.096 0.267 1.3661 0.9076 1.4792 1.2641 0.8714 0.9165 1.7346 1.1059 1.6552 0.548 0.1532 1.8059 2.3337 2.193 2.6282 2.2579 2.2924 0.1535 lysylleucine 0.8486 0.7441 0.6528 0.4913 0.4396 0.5555 0.5497 1.133 0.4233 1.0491 0.8685 2.0192 0.6102 1.2262 1.1011 4.2854 1.2881 1.1292 1.2111 0.9744 0.6046 1.7385 0.3573 0.4743 1.0256 3.3928 2.5824 1.7339 4.0337 0.8958 0.1018 N-acetylcarnosine 0.928 0.9592 0.9319 1.2823 1.0963 1.0955 0.9078 0.9187 0.9236 1.0287 1.2286 1.1916 1.0334 1.0537 0.9296 1 1.1204 1.3883 1.4271 0.6053 1.3602 1.4153 1.4035 0.4063 0.5681 0.1561 0.2502 0.4712 0.1561 0.8121 0.1561 phenylacetylglycine 0.6296 0.8239 0.5613 0.6535 0.5744 0.6375 0.455 0.7326 0.9152 0.6437 0.4651 0.4889 1.0848 0.4913 0.63 0.8611 1.686 2.2221 2.52 6.2808 1.1524 1.6097 2.7409 20.7935 12.6552 27.6354 27.6822 21.5616 5.0959 14.9133 4.3009 phenylalanylalanine 1.3793 1.3778 0.9249 0.5321 0.5426 0.6222 1.3002 1.2749 0.6431 1.4383 0.8146 1.0751 0.0892 2.1846 1.1518 0.4155 0.7347 0.3342 0.521 2.8962 0.4152 1.542 0.2517 0.0584 5.129 10.2825 9.9151 7.6911 8.1175 3.6164 0.2479 phenylalanylglycine 0.8389 1.0879 0.7526 0.4999 0.4494 0.5438 0.9651 1.0474 0.4028 1.1603 1.0349 1.2343 0.1324 1.1778 1.0467 0.6994 0.7927 0.6336 0.7063 2.5148 0.3534 2.0196 0.3698 0.0725 2.5073 4.9599 4.4656 3.9122 5.3788 2.1624 0.3099 prolylglycine 2.1062 2.1675 2.5894 2.957 2.4939 2.4969 2.6609 2.2955 1.2295 2.2448 2.6208 1.9067 1.0901 1.968 1.9287 0.39 0.2011 0.4562 0.2034 0.7269 0.5561 1.0634 0.5327 0.266 0.7341 0.7675 0.8056 0.9366 0.6689 0.5423 0.059 threonylphenylalanine 1.0106 0.6281 0.9093 0.7189 0.7414 0.6922 0.7803 1.5449 0.6252 1.4053 0.8641 1.7206 0.7828 0.8028 1.3547 3.0049 1.6694 1.0934 1.8264 1.2191 0.7663 0.9871 0.8404 0.418 1 1.3852 1.3043 1.1295 0.6972 1.4842 0.418 tryptophylglycine 1.282 0.9324 1 0.7966 0.6588 0.8768 0.9451 1.5518 0.5548 1.5486 1.1923 2.175 0.2478 2.2096 1.3763 0.4907 1.0644 1.1944 0.9062 1.031 0.7175 1.194 0.6565 0.1216 0.8501 1.2053 1.5712 1.2517 1.0846 0.7054 0.1216 tyrosylglycine 1.3337 1.7597 0.9818 0.8411 0.8163 0.9638 2.0997 0.8657 0.4738 1 1.2785 1.2289 0.1402 1.7303 0.8794 0.3914 0.8226 0.6609 0.7631 3.6068 1.0611 3.3422 0.4182 0.1402 5.4526 7.6156 8.3532 8.725 8.8794 4.2025 0.5092 valylglutamine 0.8601 0.5093 0.7475 0.3341 0.3133 0.4206 0.5347 1.2794 0.4779 1.2166 1.0414 2.2844 0.1535 0.7615 1.299 0.7848 1.2098 1.1383 1.1524 1.8834 0.6848 0.5992 0.9586 0.1106 1.2004 1.3557 1.2487 2.8274 1.1776 2.4611 0.0751 valylglycine 1.0655 1.1026 0.6141 0.6705 0.7383 0.799 1.4346 0.7442 0.4888 0.6302 1.0521 0.916 0.4065 1.4386 0.6476 1.7625 0.9479 1.0716 0.8422 2.0583 0.8815 3.3074 0.8615 0.308 2.4785 2.9478 2.8957 3.1462 4.1797 1.6297 0.2299 valylleucine 0.993 0.6691 1.3392 0.7855 0.5478 0.4919 0.7222 2.1923 0.9791 2.9615 1.0021 4.8673 0.8958 0.56 2.8258 4.422 1.5696 1.0188 1.7394 1.11 0.57 0.6408 1 0.501 0.7548 0.095 0.781 1.1388 1.0959 1.9949 0.095 1-(3-aminopropyl)-2-pyrrolidone 1.6148 2.315 1.3949 0.7245 0.6996 1.7889 1.66 1.4744 1.5019 1.0994 1.0904 0.9613 1.4678 0.4047 1.0299 0.913 1.022 2.5318 0.8172 0.689 0.5695 0.7145 1.2504 1.0049 0.7363 0.2628 0.3519 0.6512 0.2244 1.0688 0.05 1H-quinolin-2-one 0.3596 0.6764 0.599 0.7205 0.642 0.8279 1.0012 0.4747 0.5705 0.4708 0.4831 0.7869 0.7195 0.5216 0.473 1.1877 5.1103 6.5031 9.8547 1.8588 7.3273 7.5162 8.8489 2.04 1.7511 1.6881 1.8558 1.9165 0.9988 1.439 0.4713 1-kestose 2.0729 1.3712 1.0692 2.4638 0.9126 0.9494 1.8646 1.5918 1.5802 2.0463 1.8211 1.2607 0.9033 1.2051 1.5979 0.9383 0.9806 0.9292 1.223 0.5392 0.8527 1.0194 2.6136 0.104 0.429 0.2866 0.2908 0.347 0.1532 0.7659 0.104 2,3-dihydroxyisovalerate 0.3382 0.5345 0.3953 0.8871 0.489 0.3382 0.786 0.3382 0.3382 0.4216 0.3382 0.3382 44.9631 0.3382 0.3382 49.0986 0.8944 2.2243 1.0606 0.9394 1.3184 1.5871 2.0439 33.9175 1.3383 0.7921 0.8579 1.745 0.6238 1.2606 0.3382 2,8-quinolinediol 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2,8-quinolinediol sulfate 0.9271 0.7006 0.5419 1.0647 1.1324 0.868 1.2962 0.9524 0.7693 1.1716 1.131 1.3042 0.2086 1.1359 1.4742 1.0476 1.1823 1.3453 1.0731 0.4779 1.6022 1.425 1.4554 0.0876 0.2811 0.1168 0.1463 0.1975 0.1384 0.4116 0.0876 2-isopropylmalate 0.0739 0.0739 0.0739 0.0739 0.0739 0.0739 0.0739 0.0739 0.0739 0.0739 0.0744 0.0739 26.0309 0.0739 0.0739 16.1431 0.0739 0.0739 0.1184 0.0739 0.0739 0.0739 0.0739 5.804 0.0739 0.0739 0.0739 0.0739 0.0739 0.0739 0.0739 2-keto-3-deoxy-gluconate 1.0419 0.9612 0.8136 0.7206 0.5045 0.963 1.0735 1.207 0.9972 1.3209 0.663 1.1763 16.5389 1 0.7227 7.0261 1.1171 1.1522 1.4401 0.7337 1.4109 1.4805 1.4244 2.0523 0.8026 0.242 0.5259 0.572 0.1797 0.9011 0.1797 2-ketogluconate 1.1667 1.4056 1.7797 1.6784 1.1198 1.1249 1.4461 1.1265 1.1819 1.2333 1.5152 0.9578 1.6768 0.7626 1.341 1.1505 0.8878 0.8108 0.3401 0.5896 0.6067 0.9232 1.0422 0.4533 0.6239 0.1554 0.1641 0.2861 0.0572 0.452 0.0572 2-oxindole-3-acetate 0.9203 0.8453 0.8554 0.985 0.8264 0.9283 1.1802 1.0172 0.9807 1.0368 1.015 1.0538 1.1915 0.7507 1.1122 2.7253 1.0163 1.2294 1.1447 0.7628 1.3251 1.3317 1.4159 3.4545 0.5709 0.4642 0.5249 0.6443 0.2882 0.9367 0.1085 3,4-dihydroxybenzoate 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3,5-dihydroxybenzoic acid 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3-deoxyoctulosonate 0.995 1.1748 1.097 1.1841 1.1021 1.1887 1.04 1.1719 1.005 1.1432 1.0436 1.0304 1.4989 0.9928 1.0812 1.2179 0.3059 0.3881 0.3475 0.2048 0.0225 0.262 0.2998 1.1436 0.1108 0.0258 0.0737 0.0616 0.0225 0.1609 0.0225 3-hydroxypyridine sulfate 0.8428 0.4314 0.4314 0.9908 2.6593 1.0224 1.2354 0.9938 0.4314 0.4796 1.2073 0.9533 0.4314 1.5023 1 1.6841 1.4153 4.4964 0.4314 0.636 3.8267 2.6535 3.2498 0.744 0.4378 0.4314 0.7568 0.6105 0.8846 0.4314 1.8858 4-hydroxybenzoate 0.5432 0.5805 1.1629 1.043 1.1839 1.3329 0.9126 0.7899 0.827 0.9131 0.7475 1.1306 1.4778 0.8969 0.9341 1.8395 1.3657 1.9451 1.8672 0.8517 2.0065 1.6898 1.3451 4.9028 0.9921 0.7467 0.6055 0.9556 0.6155 1.0079 0.2313 4-hydroxyhippurate 1.2309 1.7448 1.5464 0.8898 1.122 2.3287 1.6141 1.411 2.483 2.4301 0.8495 0.8272 0.9389 0.467 2.1434 0.9906 0.7441 3.142 0.7149 1.2328 0.649 0.8742 1.4477 0.2947 1.0094 0.2402 0.2312 0.887 0.1685 1.917 0.1685 4-hydroxymandelate 0.2354 0.6795 1.035 0.3914 0.7736 1.2869 0.2291 0.6953 0.6347 1.2257 0.2368 0.564 1.4951 1.1101 0.5463 1.8175 1.5103 1.8531 1.6341 0.965 1.5014 1.1156 1.5548 1.3437 0.6662 0.3994 0.6904 0.6826 0.2291 1.6382 0.2291 4-vinylphenol sulfate 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.5231 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.2482 0.2254 0.1983 1.4828 0.4523 0.5559 0.5282 1 2.8914 2.1756 1.5353 2.8114 1.4881 1.5277 2.2766 afromosin 0.7307 0.5756 1.4967 0.8804 0.4226 0.7627 1.0675 0.3862 2.0361 1.0473 0.3901 0.3373 5.596 0.3286 0.4359 5.2294 0.7437 1.4026 1.1958 3.299 0.395 0.9527 0.7583 18.7662 5.6981 2.3407 2.0948 3.5396 4.273 2.1795 0.2747 apigenin 0.7236 0.9271 0.975 0.6518 0.7599 0.6916 1.0098 0.4819 1.2813 0.784 0.667 0.5134 8.8258 0.3911 0.5575 5.8019 0.9891 0.5304 2.043 2.1798 0.7887 0.9902 1.0117 31.6005 3.5914 5.4348 5.2654 5.8274 4.5475 4.0336 1.7169 benzoate 0.6442 0.6608 0.6296 0.6358 0.6173 0.8214 0.8759 0.6877 0.8888 0.8133 0.6009 0.9216 0.8064 0.9773 0.6774 0.9508 1.6139 2.9629 2.3587 1.5539 1.772 2.7929 2.1322 1.4697 1.6086 2.1352 2.4451 2.2052 1.5578 1.4688 1.0227 beta-guanidinopropanoate 1.1356 0.7015 0.5476 0.6655 0.9587 0.9923 0.7994 0.6585 1.1052 0.5476 0.5476 0.5476 1.4768 0.778 0.5496 0.9324 0.652 0.568 0.8727 1.5216 1 2.0337 0.9522 2.1251 2.3302 3.4273 3.0449 2.7211 4.3308 2.174 2.5565 biochanin A 0.8077 0.4998 1.3802 1.349 0.4399 0.522 0.4805 0.3821 1.191 0.8258 0.2275 0.2152 3.0563 0.2153 0.3614 5.5538 0.8404 1.7214 0.604 2.5985 2.4061 1.1596 1.4445 13.7183 5.204 2.1857 1.8655 2.3423 5.5679 0.7987 0.3835 caffeic acid sulfate 1.1567 1.949 1.3175 1.2494 1.3012 1.4011 1.3966 1.254 1.1721 0.9344 0.8121 0.7546 1.2345 0.7273 0.8468 0.9662 0.9458 1.9964 1 0.7652 1.2825 1.4292 1.4309 0.5005 0.9222 0.6691 0.6466 0.7324 0.4619 1.0681 0.128 chrysoeriol 0.7374 0.4934 0.6307 0.787 0.5887 0.8962 0.9165 0.5724 1.1058 0.9195 0.3196 0.358 9.2063 0.5921 0.543 5.6811 0.4919 0.9032 1.9606 2.168 1.0703 1.1609 0.9297 33.3108 3.5448 5.7502 4.8401 3.5267 4.9254 4.0154 1.7997 coumaroylquinate (4) 0.7681 0.494 0.741 1.2921 0.6126 0.7602 1.1418 1 1.049 0.9431 0.4107 1.5433 1.0645 0.8196 1.4252 0.8832 1.8126 1.9586 1.684 0.6925 1.8504 1.7634 2.6035 0.1043 1.1086 0.4861 0.4097 0.839 0.1043 1.4476 0.1043 coumaroylquinate (5) 0.8949 0.9472 0.9083 1.2691 0.7174 0.7529 1.5036 1.0435 0.9424 1.4457 0.7405 1.3406 1.448 0.8973 1.6179 0.9565 1.2306 1.6471 1.882 0.5725 1.5038 1.4109 2.1767 0.2753 0.6152 0.5219 0.2753 0.6525 0.2753 1.2115 0.2753 coumestrol 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 1.0989 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 0.5378 5.2944 0.5378 0.5378 0.5378 0.8222 0.5378 0.9011 0.5378 daidzein 0.7372 0.7782 1.0546 0.661 0.6985 0.8376 0.7507 0.768 1.3356 0.9781 0.8553 0.8435 4.5188 0.6649 0.9449 4.1787 0.9788 1.0212 1.8287 1.7767 0.7859 1.0901 1.0363 7.4979 1.7888 1.6807 1.4307 1.3916 1.7279 2.2555 0.1818 daidzein sulfate (1) 1.062 0.9685 1.2132 1.1197 0.9135 1.2408 1.2292 1.0508 1.1882 1.1452 0.9303 0.8644 1.5361 0.8333 1.1338 0.5688 1.1344 1.0184 1.0276 0.8867 0.8447 0.9586 1 1.0172 0.8016 0.7087 0.9198 0.8882 0.435 1.0793 0.1128 daidzein sulfate (2) 0.8869 1 1.0772 1.0719 0.9142 1.0881 0.9828 0.9718 1.1129 1.101 0.7964 0.9532 1.2546 0.8739 1.1023 1.3252 1.0832 1.0329 1.0207 0.9861 1.0654 1.1062 1.025 0.4805 0.9025 0.7083 0.8356 0.8953 0.4615 1.1926 0.1946 daidzin 0.8753 0.984 0.8617 0.9853 0.9027 1.0074 1.1095 0.7946 0.911 1.0994 0.9935 1.1049 2.0497 0.9645 1.1424 3.2804 0.8766 1.0463 0.9022 1.1379 1.1349 1.388 1.4565 3.4568 0.8745 1 0.9072 1.1309 0.7826 1.4254 0.1399 diaminopimelate 0.1792 0.1792 0.1792 0.1792 0.1792 0.1792 0.1792 0.1792 0.1792 0.1792 0.1792 0.1792 3.7511 0.1792 0.1792 1.9685 0.682 0.3303 1 0.7156 0.3745 0.5326 0.6153 2.9432 0.864 3.9542 2.8815 2.9629 2.4149 2.0614 0.2019 digalacturonic acid 0.7813 1.0459 1.1801 0.4801 0.7516 1.0335 1.1805 1.0046 0.5907 0.8862 0.9954 0.572 41.5339 1.1269 0.7448 9.5885 1.1788 1.079 1.1086 0.4497 0.6955 0.4956 1.0966 13.3556 0.2678 0.2542 0.2542 0.2542 0.2542 0.6697 0.2542 dihydroferulic acid 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 1.173 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 6.0092 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 0.4834 ectoine 0.8497 0.6326 0.8769 1.0112 0.9114 1.1315 0.8528 1.0048 0.8116 1.1335 0.8813 0.9879 1.1018 1.0293 1.1578 0.8612 0.9952 1.507 1.4178 0.8763 1.6724 1.1079 1.2117 0.6885 0.6077 0.691 1.4866 1.0993 0.1771 1.1512 0.3755 equol 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.6273 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 4.3694 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 0.1404 equol glucuronide 0.0733 0.0733 0.0733 0.0733 0.0733 0.0733 0.0733 0.0733 0.0733 0.0733 0.0733 0.0733 0.7317 0.0733 0.0733 1.5106 0.0733 0.0733 0.0733 0.0733 0.0733 0.0733 0.0733 1.2683 0.0733 0.0733 0.0733 0.0733 0.0733 0.0733 0.0733 equol sulfate 0.0028 0.0028 0.0028 0.0028 0.0028 0.0028 0.0028 0.0028 0.0028 0.0028 0.0028 0.0028 1 0.0028 0.0028 2.3978 0.0028 0.0028 0.0028 0.0028 0.0028 0.0028 0.0028 6.5817 0.0028 0.0028 0.0028 0.0028 0.0028 0.0028 0.0028 ergothioneine 0.3736 0.4602 0.3077 0.3454 0.257 0.6375 1.0324 0.2876 0.34 0.3376 0.2555 0.3344 1.1368 0.2913 0.3423 0.6413 1.3706 0.9861 1.0139 1.4816 1.206 1.1784 1.2769 4.2342 3.2231 6.5129 4.9017 4.3229 15.0137 2.9332 5.1557 erythritol 0.6916 0.8252 0.9959 1.1606 0.9347 1.2411 1.1193 1.5635 1.0116 1.208 0.7977 1.2721 1.183 0.9398 1.0041 1.0419 1.14 1.5841 1.2522 0.681 1.2785 1.3045 1.3473 0.5936 0.524 0.2357 0.3269 0.5097 0.1783 0.7141 0.0426 ferulate 0.8345 1.167 0.7257 0.8626 1.1748 1.1813 1.763 0.9342 0.7803 0.6984 1.247 0.7923 2.5711 0.8512 0.6684 2.9547 0.8381 1.4216 1.6502 1.1598 1.1099 1.4729 1.5437 9.0335 1.0003 0.9867 0.9472 0.8846 0.8412 0.9997 0.2003 ferulic acid 4-sulfate 0.9718 1.4744 1.3972 1.1025 1.0393 1.1864 1.1958 1.0367 1.2524 1.0463 1 0.8524 1.5628 0.688 0.9821 1.0875 1.2101 1.1245 1.0366 0.716 0.7676 0.8959 1.2352 0.3669 0.6702 0.2961 0.4341 0.6206 0.1679 0.9638 0.0769 feruloylputrescine 1.1221 1.3982 0.924 0.9876 1.4486 1.1327 1.1663 9.6473 1.0893 0.9175 0.9776 2.636 0.0223 1 1.0643 0.0223 1.4951 1.1926 1.3505 0.6043 1.3057 1.1624 0.9439 0.0417 0.8527 0.868 0.8156 0.8127 0.4595 1.1343 0.156 ferulylglycine (1) 1.0193 1.7524 2.179 1.2161 1.1161 2.6607 0.962 1.0325 2.1815 2.1411 0.6639 0.6938 1.0719 0.4945 2.0659 0.8739 0.4607 2.2667 0.5114 0.9807 0.7203 0.6903 0.6352 0.1377 1.068 0.1377 0.2039 0.8076 0.1377 1.357 0.1377 ferulylglycine (2) 0.9408 0.6126 0.9835 0.5071 0.5409 2.0436 1.602 1.4613 1.9514 1.3573 0.3267 0.3267 0.5631 0.3267 2.803 1.2707 0.3267 1.2805 0.3267 0.6042 0.3267 0.3267 0.3267 0.3267 0.7712 0.3267 0.3267 0.3267 0.3267 1.0165 0.3267 formononetin 0.5518 0.4249 1.0994 1.1775 0.296 0.3871 0.254 0.2662 1.132 1.2003 0.1515 0.1386 2.8096 0.1404 0.224 6.3132 0.6707 1.3425 0.5725 2.8767 19.6934 1.0037 0.9963 12.2967 4.0594 1.4017 1.3411 1.7494 3.7509 0.7476 0.1357 galactarate (mucic acid) 0.6539 0.9434 1.794 1.9527 1.4393 0.71 1.8375 1.2558 0.5518 2.7638 1.1999 0.5904 2.0007 1.3572 0.592 0.0317 1.629 0.6007 1.1239 1.0566 0.5465 1.406 0.7973 0.1096 0.1796 0.2387 0.3569 1.8028 0.0593 1.5838 0.0317 genistein 0.6818 0.7307 0.9562 0.7004 0.7039 0.7433 0.7847 0.7602 1.4119 1.0624 0.7509 0.6583 6.3651 0.6206 0.9128 6.6916 0.9979 0.9234 2.0475 3.004 0.762 1.5416 1.0762 10.0812 3.0925 3.5826 3.2739 2.8202 4.0901 3.7117 1.0021 gluconate 0.8354 1.0704 1.0483 1.06 1.0122 0.973 1.2614 1.0793 0.9339 1.0231 1.0985 0.9999 1.0144 0.9043 1.0001 0.076 1.1084 1.0323 1.1426 0.6805 1.0539 1.4076 1.117 0.0668 0.5091 0.2767 0.4592 0.4764 0.0811 0.7317 0.0069 glycitein 0.6037 0.6709 1.1208 0.7799 0.5171 0.8206 0.7495 0.8308 1.332 1.0563 0.666 0.842 6.8166 0.5133 0.8299 9.0088 1.0976 0.9437 1.9613 1.9969 0.6968 1.1664 0.871 28.8582 1.8864 2.0658 2.0397 1.8729 1.8912 2.3779 0.2401 glycitin 0.8213 0.8456 0.9416 1.0593 0.8547 1.0084 0.9069 0.7906 0.991 1.0792 0.6996 0.8861 2.0003 0.6574 0.7165 2.6333 1.0199 1.3172 0.7884 1.2489 0.878 1.3094 1.5893 4.4717 1.1173 1 1.0076 1.2543 0.7784 1.2682 0.2162 indolin-2-one 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 methyl glucopyranoside (alpha + beta) 1.0778 0.6964 0.6001 0.3268 0.9862 0.7846 0.4687 0.3268 0.6834 0.3268 1.059 0.3268 0.3268 0.7269 1.0655 1.0138 0.3268 0.3268 0.7014 1.6642 0.8041 1.1156 0.5591 1.3103 2.4952 2.2688 2.7058 5.3268 1.9455 1.9289 0.7884 methyl indole-3-acetate 0.113 0.1758 0.113 0.1799 0.2291 0.2766 0.151 0.113 0.1237 0.113 0.113 0.113 0.113 0.1276 0.113 0.3953 1.1789 2.191 1.441 1.0594 2.247 1.2919 2.7137 0.9561 1 1.0451 1.3749 1.4388 0.4687 1.0765 0.113 naringenin 0.7709 0.6948 0.8954 0.7583 0.6361 0.7488 0.6825 0.6514 1.2982 1.2669 0.7978 1.0031 5.6169 0.7911 1.1634 5.4563 0.9969 0.9346 1.598 1.1935 0.4107 1.0146 1.051 16.6279 1.4592 1.4228 1.2875 1.1742 0.9932 1.7158 0.1218 naringenin 7-glucuronide 1 1.1131 1.1592 1.2276 0.9566 1.2155 1.251 1.0253 1.1088 1.2504 0.8192 1.0189 0.7645 0.8987 1.3584 0.8884 0.9889 1.0705 1.139 0.7512 1.0294 0.9701 1.3426 0.2671 0.6805 0.3949 0.4163 0.5833 0.1575 1.029 0.0201 N-glycolylneuraminate 0.9278 2.0658 1.5133 1.23 2.1733 1.3962 0.2091 1.005 1.1367 1.174 0.8233 0.663 11.3187 0.7372 1 1.5274 0.4621 0.2619 0.4828 0.6596 0.2091 0.6376 0.2091 4.7429 1.7235 0.836 0.2091 1.2508 2.1032 0.7887 0.6103 nicotianamine 0.9754 1.0237 1.056 1.0338 0.94 1.0869 0.9389 1.0196 0.869 1.0539 1.0376 1.1296 1.0399 1.01 0.9827 1.0091 1.0499 0.999 1.0797 0.5087 1.0641 1.001 1.0293 0.5385 0.3691 0.1787 0.2634 0.2998 0.0554 0.6458 0.0039 O-sulfo-L-tyrosine 1.3142 2.3651 0.9397 0.7659 0.9604 1.296 2.0119 1.5345 1.5108 1.2977 0.808 0.8282 1.6703 0.42 1.2936 0.0898 0.6965 1.9216 0.6808 1.0137 0.6107 1.0625 1.0086 0.363 1.9725 0.9101 0.9718 1.3797 0.9914 1.5495 0.627 pheophorbide A 1.329 1.4815 1.2686 1.1219 1.1449 1.3512 1.1808 1.1473 1.2996 1.1819 0.928 1.0013 1.4498 0.9987 1.2602 1.4073 1.1575 0.9167 0.8238 0.6688 1.0116 0.9529 0.7157 0.3211 0.329 0.4919 0.3827 0.3818 0.497 0.4386 0.4086 pyrraline 0.9544 0.8856 1.0995 1.1092 0.8666 1.2196 2.2611 1.0438 0.8742 1.0971 1.4284 1.1454 1.0002 0.784 1.1295 0.892 0.9443 1.8722 1.3612 0.9998 1.6553 1.1735 1.6909 1.0409 0.8551 0.9888 0.7236 0.6689 0.6631 0.7659 0.0979 quinate 1.0108 1.1056 1.0706 1.0698 1.1025 1.0671 1.0532 1.0996 0.9249 0.9828 1.1809 1.0391 1.1582 0.9915 0.9493 0.9191 1.0869 0.9992 1.0957 0.7689 1.0773 1.0008 1.0777 0.2808 0.6324 0.381 0.5716 0.5823 0.1722 0.8897 0.0112 S-(3-hydroxypropyl)mercapturic acid (HPMA) 0.6484 0.9137 1.2262 1.294 1.0276 0.8922 1.2477 1.1889 0.9921 1.184 0.7652 1.2257 1.4417 0.5135 1.0926 1.6892 1.7597 1.5884 1.1793 0.5882 1 1.6264 1.2667 0.8973 0.8948 0.3129 0.4747 0.5905 0.2032 0.6761 0.1533 salicylate 0.5214 0.459 0.6037 0.4429 0.5331 0.5741 0.5493 0.8318 0.8787 0.9922 0.6763 1.4035 1.8591 0.8749 0.786 1.8693 1.1645 1.1512 1.2383 0.8797 0.7622 0.8838 1.3196 3.7404 1.3553 1.1352 1.1886 1.4722 1.306 1.0078 1.2984 sinapate 0.7702 1 0.8889 1.1835 0.9232 0.8718 1.5581 0.7474 0.9673 1.0097 1.1097 0.8902 1.3439 0.6267 0.8271 5.751 0.9576 1.0944 1.5884 0.7933 0.9403 1.1738 1.005 14.876 1.0234 0.9711 0.6437 1.0365 0.262 1.1972 0.262 soyasaponin I 1.065 1.0097 1.0049 1.0952 0.8688 1.0338 1.2246 0.8869 1.0879 1.5059 0.7873 1.1033 0.8782 0.7813 1.6091 0.9527 0.9951 0.7754 1.2083 0.9129 0.7828 0.9121 1.4129 0.9694 0.8551 1.7258 1.1339 1.1893 0.9679 1.3507 0.354 soyasaponin II 1.1257 1.0255 0.9269 1.0112 0.8298 0.9123 1.3811 0.8989 1.0449 1.426 0.7665 1.1853 1.0439 0.8357 1.6085 0.9643 0.8675 0.785 1.1154 0.8979 0.798 0.8655 1.2986 1.2155 0.913 1.8003 1.0944 1.1201 0.9888 1.3181 0.3477 soyasaponin III 1.0687 0.9721 0.9044 0.9282 0.7364 0.8406 1.3792 0.823 1.0022 1.3398 0.6807 1.1279 1.0781 0.7737 1.5986 1.9755 0.834 0.7222 0.9978 0.9564 0.7108 0.8532 1.1581 4.9283 1.0152 2.0194 1.1929 1.2128 1.1446 1.3184 0.4161 stachydrine 0.4731 0.3932 0.4268 0.4154 0.5473 0.8735 0.6411 0.5176 0.3915 0.6471 0.5217 0.5683 0.7758 0.4835 0.5055 1.1656 1.3533 1.4203 1.7201 1.3726 1.4628 1.2926 1.2955 1.6273 1.4132 1.9925 3.0359 2.0862 1.1031 2.1698 0.8969 succinimide 0.9215 0.8186 0.8481 1.217 0.9623 1.358 1.3979 0.9976 0.9766 1.1715 1 1.2006 1.2257 1.0185 0.9934 2.0747 1.3272 1.7723 1.6421 0.8612 1.5047 1.3651 1.378 0.9398 0.6494 0.3388 0.4293 0.522 0.3309 0.8769 0.3309 sulfate 0.9299 0.9602 0.709 0.9432 0.7787 0.8598 1.2065 0.9024 0.7504 0.9216 0.6565 0.9284 3.7593 1.7646 1.1462 3.7337 0.7939 0.7318 0.6232 3.5811 0.858 1.0398 0.7637 9.6371 4.0835 6.5233 7.3837 6.5755 9.8491 3.0157 4.024 syringic acid 0.9101 0.8198 0.6487 1.2519 0.8301 1.0157 1.63 0.8117 0.7862 1.2474 1.3337 0.8278 1.0146 0.7042 1.5093 1.0712 0.7077 0.7177 1.2714 1.342 1.0212 0.9846 1.3634 4.4246 0.828 1.1079 0.7292 0.9854 0.483 1.0882 0.2548 tartarate 0.7084 1.1284 1.0123 1.2071 1.2055 0.8492 0.8106 0.9268 0.7892 1.3202 1.3273 1.2069 0.7717 1.0279 1 1.6296 1.0457 1.0464 1.0869 0.917 1.0273 1.0095 0.9601 1.5457 0.6854 0.5151 0.7804 0.7424 0.1194 0.8869 0.1824 tartronate (hydroxymalonate) 0.7917 1.0576 0.9099 0.9306 0.846 0.6485 0.9978 1.2067 0.6823 1.1269 1.1981 1.0022 0.4821 0.8361 1.1304 1.0254 1.0148 0.6611 0.971 1.1204 0.8007 1.2249 0.9113 2.0113 1.067 1.1122 1.4611 1.5885 0.473 1.3186 0.4377 vanillin sulfate 1.4656 0.9847 0.7322 1.5927 1.5336 1.3927 1.4707 1.3428 1.3026 1.7817 1.305 1.8093 0.7789 1.4427 1.4797 1 0.978 1.2547 0.8038 0.3106 1.4075 0.9643 1.2944 0.1178 0.2251 0.0932 0.1466 0.2302 0.0609 0.4492 0.0246 metabolite_name 1-methylguanidine 1-methylhistidine 1-methylimidazoleacetate 2-(4-hydroxyphenyl)propionate 2-aminoadipate 2-aminobutyrate 2-hydroxy-3-methylvalerate 2-hydroxybutyrate/2-hydroxyisobutyrate 2-methylbutyrylcarnitine (C5) 3-(4-hydroxyphenyl)lactate 3-hydroxyisobutyrate 3-methyl-2-oxobutyrate 3-methyl-2-oxovalerate 3-methylhistidine 3-sulfo-L-alanine 4-acetamidobutanoate 4-guanidinobutanoate 4-hydroxycinnamate 4-hydroxycinnamate sulfate 4-hydroxyglutamate 4-hydroxyphenylacetate 4-hydroxyphenylpyruvate 4-imidazoleacetate 4-methyl-2-oxopentanoate 4-methylthio-2-oxobutanoate 5-aminovalerate 5-hydroxylysine 5-methylthioadenosine (MTA) 5-oxoproline alanine alpha-hydroxyisocaproate alpha-hydroxyisovalerate arginine argininosuccinate asparagine aspartate beta-citrylglutamate betaine carboxyethyl-GABA cis-urocanate citrulline creatine creatinine cystathionine cysteine cysteine s-sulfate cysteine sulfinic acid cysteinylglycine cystine dimethylarginine (SDMA + ADMA) dimethylglycine ethylmalonate formiminoglutamate gamma-aminobutyrate (GABA) gentisate glutamate glutamate, gamma-methyl ester glutamine glutarate (pentanedioate) glutarylcarnitine (C5) glycine guanidinoacetate guanidinosuccinate histamine histidine homocitrulline homocysteine homogentisate hypotaurine imidazole lactate imidazole propionate indoleacetate indolelactate isobutyrylcarnitine isobutyrylglycine isoleucine isovalerate isovalerylcarnitine isovalerylglycine kynurenate kynurenine leucine lysine methionine methionine sulfoxide methylsuccinate N(1)-acetylspermine N1,N12-diacetylspermine N2,N6-diacetyllysine N2-acetyllysine N6,N6,N6-trimethyllysine N6-acetyllysine N6-carboxyethyllysine N6-formyllysine N-acetyl-1-methylhistidine N-acetyl-3-methylhistidine N-acetylalanine N-acetylarginine N-acetylasparagine N-acetylaspartate (NAA) N-acetyl-aspartyl-glutamate (NAAG) N-acetyl-cadaverine N-acetylcitrulline N-acetylcysteine N-acetylglutamate N-acetylglutamine N-acetylglycine N-acetylhistamine N-acetylhistidine N-acetylisoleucine N-acetylleucine N-acetylmethionine N-acetylmethionine sulfoxide N-acetylphenylalanine N-acetylproline N-acetylputrescine N-acetylserine N-acetyltaurine N-acetylthreonine N-acetyltryptophan N-acetyltyrosine N-acetylvaline N-alpha-acetylornithine N-delta-acetylornithine N-formylmethionine N-formylphenylalanine N-methyl-GABA N-methylglutamate N-methylproline N-monomethylarginine O-methyltyrosine ornithine p-cresol sulfate p-cresol-glucuronide phenylacetate phenylalanine phenyllactate (PLA) phenylpyruvate picolinate pipecolate pro-hydroxy-pro proline putrescine pyroglutamine S-1-pyrroline-5-carboxylate saccharopine sarcosine serine serotonin spermidine spermine taurine thioproline threonine trans-4-hydroxyproline trans-urocanate tryptamine tryptophan tyramine tyrosine urea valine xanthurenate 1,5-anhydroglucitol (1,5-AG) 2-ketogulonate 3-phosphoglycerate 3-sialyllactose arabinose arabitol/xylitol arabonate/xylonate erythronate fructose galactitol (dulcitol) galactonate glucose glucuronate glycerate isomaltose lactate lactobionate maltopentaose maltose maltotetraose maltotriose mannitol/sorbitol N6-carboxymethyllysine N-acetylglucosaminylasparagine N-acetylmuramate N-acetylneuraminate pyruvate raffinose ribonate ribose ribulose/xylulose sedoheptulose sucrose xylose 1-methylnicotinamide alpha-tocopherol alpha-tocopherol acetate alpha-tocotrienol bilirubin (Z,Z) biliverdin delta-tocopherol D-urobilin flavin mononucleotide (FMN) gamma-tocopherol/beta-tocopherol gamma-tocotrienol glucarate (saccharate) gulonate heme N1-Methyl-2-pyridone-5-carboxamide nicotinamide nicotinamide riboside nicotinate nicotinate ribonucleoside oxalate (ethanedioate) pantothenate pyridoxal pyridoxamine pyridoxate pyridoxine (Vitamin B6) quinolinate riboflavin (Vitamin B2) thiamin (Vitamin B1) threonate trigonelline (N'-methylnicotinate) 2-methylcitrate/homocitrate aconitate [cis or trans] alpha-ketoglutarate citraconate/glutaconate citrate fumarate isocitric lactone malate phosphate succinate succinylcarnitine tricarballylate 1-(1-enyl-oleoyl)-2-oleoyl-GPE (P-18:1/18:1) 1-(1-enyl-oleoyl)-GPE (P-18:1) 1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20:4) 1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20:4) 1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2) 1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2) 1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1) 1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1) 1-(1-enyl-palmitoyl)-GPC (P-16:0) 1-(1-enyl-palmitoyl)-GPE (P-16:0) 1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:4) 1-(1-enyl-stearoyl)-2-linoleoyl-GPE (P-18:0/18:2) 1-(1-enyl-stearoyl)-GPE (P-18:0) 1,2-dilinoleoyl-digalactosylglycerol (18:2/18:2) 1,2-dilinoleoyl-GPC (18:2/18:2) 1,2-dilinoleoyl-GPE (18:2/18:2) 1,2-dipalmitoyl-GPC (16:0/16:0) 1,2-distearoyl-GPC (18:0/18:0) 10-heptadecenoate (17:1n7) 10-hydroxystearate 10-nonadecenoate (19:1n9) 12,13-DiHOME 12-HETE 13-HODE + 9-HODE 13-methylmyristate 15-methylpalmitate 17-methylstearate 1-arachidonylglycerol (20:4) 1-dihomo-linolenylglycerol (20:3) 1-docosahexaenoylglycerol (22:6) 1-eicosapentaenoylglycerol (20:5) 1-lignoceroyl-GPC (24:0) 1-linolenoylglycerol (18:3) 1-linolenoyl-GPC (18:3) 1-linoleoylglycerol (18:2) 1-linoleoyl-GPC (18:2) 1-linoleoyl-GPE (18:2) 1-linoleoyl-GPG (18:2) 1-myristoylglycerol (14:0) 1-oleoyl-2-linoleoyl-GPC (18:1/18:2) 1-oleoyl-2-linoleoyl-GPE (18:1/18:2) 1-oleoylglycerol (18:1) 1-oleoyl-GPC (18:1) 1-oleoyl-GPE (18:1) 1-palmitoleoyl-2-linoleoyl-GPC (16:1/18:2) 1-palmitoleoyl-GPC (16:1) 1-palmitoyl-2-alpha-linolenoyl-GPC (16:0/18:3n3) 1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4) 1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4) 1-palmitoyl-2-linoleoyl-digalactosylglycerol (16:0/18:2) 1-palmitoyl-2-linoleoyl-galactosylglycerol (16:0/18:2) 1-palmitoyl-2-linoleoyl-GPC (16:0/18:2) 1-palmitoyl-2-linoleoyl-GPE (16:0/18:2) 1-palmitoyl-2-oleoyl-GPC (16:0/18:1) 1-palmitoyl-2-oleoyl-GPE (16:0/18:1) 1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1) 1-palmitoyl-2-stearoyl-GPC (16:0/18:0) 1-palmitoylglycerol (16:0) 1-palmitoyl-GPA (16:0) 1-palmitoyl-GPC (16:0) 1-palmitoyl-GPE (16:0) 1-palmitoyl-GPG (16:0) 1-palmitoyl-GPI (16:0) 1-palmitoyl-GPS (16:0) 1-pentadecanoylglycerol (15:0) 1-stearoyl-2-arachidonoyl-GPC (18:0/20:4) 1-stearoyl-2-arachidonoyl-GPE (18:0/20:4) 1-stearoyl-2-arachidonoyl-GPI (18:0/20:4) 1-stearoyl-2-linoleoyl-GPC (18:0/18:2) 1-stearoyl-2-linoleoyl-GPE (18:0/18:2) 1-stearoyl-2-oleoyl-GPC (18:0/18:1) 1-stearoyl-2-oleoyl-GPE (18:0/18:1) 1-stearoyl-2-oleoyl-GPS (18:0/18:1) 1-stearoyl-GPA (18:0) 1-stearoyl-GPC (18:0) 1-stearoyl-GPE (18:0) 1-stearoyl-GPG (18:0) 1-stearoyl-GPI (18:0) 1-stearoyl-GPS (18:0) 2-docosahexaenoylglycerol (22:6) 2-hydroxydecanoate 2-hydroxyglutarate 2-hydroxypalmitate 2-hydroxystearate 2-linoleoylglycerol (18:2) 2-myristoylglycerol (14:0) 2-oleoylglycerol (18:1) 2-palmitoleoylglycerol (16:1) 2-palmitoylglycerol (16:0) 2-palmitoyl-GPC (16:0) 2-stearoyl-GPE (18:0) 3-carboxyadipate 3-dehydrocholate 3-hydroxy-3-methylglutarate 3-hydroxybutyrate (BHBA) 3-hydroxydecanoate 3-hydroxyhexanoate 3-hydroxylaurate 3-hydroxyoctanoate 3-hydroxypalmitate 3-hydroxysebacate 3-ketosphinganine 4-cholesten-3-one 4-hydroxybutyrate (GHB) 5-dodecenoate (12:1n7) 7-alpha-hydroxy-3-oxo-4-cholestenoate (7-Hoca) 7-ketodeoxycholate 9,10-DiHOME acetylcarnitine adrenate (22:4n6) alpha-muricholate arachidate (20:0) arachidonate (20:4n6) azelate (nonanedioate) behenate (22:0) beta-muricholate beta-sitosterol butyrylcarnitine butyrylglycine campesterol caprate (10:0) caproate (6:0) caprylate (8:0) carnitine chenodeoxycholate chiro-inositol cholate cholate sulfate cholesterol choline choline phosphate deoxycarnitine deoxycholate diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1]) dihomo-linoleate (20:2n6) dihomo-linolenate (20:3n3 or n6) docosadienoate (22:2n6) docosahexaenoate (DHA; 22:6n3) docosapentaenoate (n3 DPA; 22:5n3) docosapentaenoate (n6 DPA; 22:5n6) dodecanedioate eicosapentaenoate (EPA; 20:5n3) eicosenoate (20:1) erucate (22:1n9) glycerol glycerol 3-phosphate glycerophosphoethanolamine glycerophosphoglycerol glycerophosphoinositol glycerophosphorylcholine (GPC) heptanoate (7:0) hexadecanedioate hexanoylcarnitine hyocholate hyodeoxycholate isocaproate linoleate (18:2n6) linolenate [alpha or gamma; (18:3n3 or 6)] linoleoyl ethanolamide linoleoylcarnitine linoleoyl-linolenoyl-glycerol (18:2/18:3) [1] linoleoyl-linolenoyl-glycerol (18:2/18:3) [2] linoleoyl-linoleoyl-glycerol (18:2/18:2) [1] linoleoyl-linoleoyl-glycerol (18:2/18:2) [2] maleate malonate margarate (17:0) mevalonate mevalonolactone myo-inositol myristate (14:0) myristoleate (14:1n5) myristoleoylcarnitine myristoylcarnitine nervonate (24:1n9) N-oleoyltaurine nonadecanoate (19:0) N-palmitoylglycine N-palmitoyl-sphinganine (d18:0/16:0) N-palmitoyl-sphingosine (d18:1/16:0) N-stearoyl-sphingosine (d18:1/18:0) octanoylcarnitine oleate/vaccenate (18:1) oleoyl ethanolamide oleoylcarnitine oleoylcholine oleoyl-linoleoyl-glycerol (18:1/18:2) [1] oleoyl-linoleoyl-glycerol (18:1/18:2) [2] palmitate (16:0) palmitoleate (16:1n7) palmitoleoylcarnitine palmitoleoyl-linoleoyl-glycerol (16:1/18:2) [1] palmitoyl dihydrosphingomyelin (d18:0/16:0) palmitoyl ethanolamide palmitoyl sphingomyelin (d18:1/16:0) palmitoyl-arachidonoyl-glycerol (16:0/20:4) [2] palmitoylcarnitine palmitoylcholine palmitoyl-linolenoyl-glycerol (16:0/18:3) [2] palmitoyl-linoleoyl-glycerol (16:0/18:2) [1] palmitoyl-linoleoyl-glycerol (16:0/18:2) [2] palmitoyl-oleoyl-glycerol (16:0/18:1) [2] pentadecanoate (15:0) phytosphingosine pinitol propionylcarnitine sebacate (decanedioate) sphinganine sphingomyelin (d18:1/14:0, d16:1/16:0) sphingomyelin (d18:1/15:0, d16:1/17:0) sphingomyelin (d18:1/17:0, d17:1/18:0, d19:1/16:0) sphingomyelin (d18:1/20:0, d16:1/22:0) sphingomyelin (d18:1/24:1, d18:2/24:0) sphingomyelin (d18:2/16:0, d18:1/16:1) sphingomyelin (d18:2/24:1, d18:1/24:2) sphingosine stearate (18:0) stearidonate (18:4n3) stearoyl ethanolamide stearoyl sphingomyelin (d18:1/18:0) stearoylcarnitine stigmasterol suberate (octanedioate) suberoylcarnitine tauro-alpha-muricholate tauro-beta-muricholate taurochenodeoxycholate taurochenodeoxycholate sulfate taurocholate taurocholenate sulfate taurohyodeoxycholic acid tauroursodeoxycholate tetradecanedioate tricosanoyl sphingomyelin (d18:1/23:0) trimethylamine N-oxide undecanedioate valerate 1-methyladenine 1-methylguanine 2'-deoxyadenosine 2'-deoxyadenosine 5'-monophosphate 2'-deoxycytidine 2'-deoxycytidine 5'-monophosphate 2'-deoxyguanosine 2'-deoxyinosine 2'-deoxyuridine 3-ureidopropionate 5,6-dihydrothymine 5-methyl-2'-deoxycytidine 5-methyluridine (ribothymidine) 7-methylguanine 8-hydroxyguanine adenine adenosine adenosine 3',5'-cyclic monophosphate (cAMP) adenosine 5'-monophosphate (AMP) allantoin beta-alanine cytidine cytidine 2',3'-cyclic monophosphate cytidine 5'-monophosphate (5'-CMP) cytosine dihydroorotate guanine guanosine guanosine 5'- monophosphate (5'-GMP) hypoxanthine inosine methylphosphate N6,N6-dimethyladenosine N6-carbamoylthreonyladenosine N6-methyladenosine N6-succinyladenosine N-acetyl-beta-alanine N-carbamoylaspartate orotate orotidine pseudouridine thymidine thymidine 5'-monophosphate thymine uracil urate uridine xanthine xanthosine alanylleucine anserine carnosine gamma-glutamylalanine gamma-glutamylcysteine gamma-glutamyl-epsilon-lysine gamma-glutamylglutamate gamma-glutamylglutamine gamma-glutamylglycine gamma-glutamylhistidine gamma-glutamylisoleucine gamma-glutamylleucine gamma-glutamylmethionine gamma-glutamylphenylalanine gamma-glutamyltryptophan gamma-glutamyltyrosine gamma-glutamylvaline glutaminylleucine glycylisoleucine glycylleucine glycylvaline histidylalanine isoleucylglycine leucylalanine leucylglutamine leucylglycine lysylleucine N-acetylcarnosine phenylacetylglycine phenylalanylalanine phenylalanylglycine prolylglycine threonylphenylalanine tryptophylglycine tyrosylglycine valylglutamine valylglycine valylleucine 1-(3-aminopropyl)-2-pyrrolidone 1H-quinolin-2-one 1-kestose 2,3-dihydroxyisovalerate 2,8-quinolinediol 2,8-quinolinediol sulfate 2-isopropylmalate 2-keto-3-deoxy-gluconate 2-ketogluconate 2-oxindole-3-acetate 3,4-dihydroxybenzoate 3,5-dihydroxybenzoic acid 3-deoxyoctulosonate 3-hydroxypyridine sulfate 4-hydroxybenzoate 4-hydroxyhippurate 4-hydroxymandelate 4-vinylphenol sulfate afromosin apigenin benzoate beta-guanidinopropanoate biochanin A caffeic acid sulfate chrysoeriol coumaroylquinate (4) coumaroylquinate (5) coumestrol daidzein daidzein sulfate (1) daidzein sulfate (2) daidzin diaminopimelate digalacturonic acid dihydroferulic acid ectoine equol equol glucuronide equol sulfate ergothioneine erythritol ferulate ferulic acid 4-sulfate feruloylputrescine ferulylglycine (1) ferulylglycine (2) formononetin galactarate (mucic acid) genistein gluconate glycitein glycitin indolin-2-one methyl glucopyranoside (alpha + beta) methyl indole-3-acetate naringenin naringenin 7-glucuronide N-glycolylneuraminate nicotianamine O-sulfo-L-tyrosine pheophorbide A pyrraline quinate S-(3-hydroxypropyl)mercapturic acid (HPMA) salicylate sinapate soyasaponin I soyasaponin II soyasaponin III stachydrine succinimide sulfate syringic acid tartarate tartronate (hydroxymalonate) vanillin sulfate