metabolite_name Fn_1 Fn_2 Fn_3 Fn-Sg_1 Fn-Sg_2 Fn-Sg_3 Fn-Vp_1 Fn-Vp_2 Fn-Vp_3 Fn-SgVp_1 Fn-SgVp_2 Fn-SgVp_3 N-Acetylornithine 0.000000 0.000000 0.000000 0.001700 0.000971 0.001944 0.000000 0.000000 0.000000 0.000000 0.000287 0.000327 Hypoxanthine 0.000000 0.000000 0.000000 0.000000 0.000000 0.000090 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 Tyramine 0.000000 0.000000 0.000000 0.000000 0.000000 0.000123 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 D-Alanyl-D-alanine 0.000000 0.000000 0.000000 0.000235 0.000204 0.000245 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 N-Acetyllysine 0.000000 0.000000 0.000000 0.000167 0.000195 0.000207 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 Trp 0.000000 0.000000 0.000000 0.000064 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 Ala 0.001197 0.001545 0.001298 0.002398 0.002909 0.004478 0.001419 0.001540 0.002027 0.002711 0.003243 0.003293 Nicotinamide 0.000632 0.000503 0.000367 0.001796 0.001037 0.000700 0.000451 0.000387 0.000222 0.000554 0.000597 0.001113 Putrescine 0.001012 0.004839 0.000000 0.010831 0.007550 0.006383 0.000502 0.000258 0.001038 0.007242 0.002780 0.000688 Cytosine 0.000085 0.000102 0.000087 0.000124 0.000140 0.000204 0.000129 0.000119 0.000118 0.000125 0.000127 0.000113 Guanine 0.000187 0.000323 0.000322 0.000386 0.000439 0.000566 0.000279 0.000306 0.000387 0.000176 0.000272 0.000250 Glu 0.000406 0.000563 0.000565 0.000659 0.000857 0.001044 0.000573 0.000720 0.000999 0.000896 0.001278 0.001529 Adenine 0.001024 0.001218 0.001254 0.001621 0.001946 0.001963 0.001298 0.001255 0.001218 0.001458 0.001608 0.001609 Thymidine 0.005108 0.006825 0.004472 0.006567 0.009453 0.007322 0.005142 0.006168 0.005132 0.005724 0.006030 0.006693 Carnitine 0.000000 0.000086 0.000000 0.000119 0.000124 0.000000 0.000141 0.000000 0.000141 0.000165 0.000000 0.000170 4-Guanidinobutyric acid 0.000000 0.000090 0.000000 0.000000 0.000147 0.000104 0.000000 0.000092 0.000079 0.000000 0.000000 0.000076 Asn 0.000188 0.000000 0.000207 0.000239 0.000000 0.000292 0.000000 0.000000 0.000000 0.000233 0.000265 0.000267 Agmatine 0.000064 0.000605 0.000000 0.000590 0.000449 0.000313 0.000000 0.000000 0.000075 0.000320 0.000127 0.000000 Benzimidazole 0.000000 0.000134 0.000000 0.000105 0.000000 0.000234 0.000117 0.000109 0.000091 0.000000 0.000000 0.000100 Adenosine 0.000966 0.001146 0.001025 0.001252 0.001427 0.001256 0.001271 0.001155 0.001168 0.001204 0.001367 0.001303 Gly 0.000801 0.000888 0.000703 0.001052 0.000785 0.000970 0.000639 0.000900 0.000807 0.000989 0.000841 0.000855 Methionine sulfoxide 0.000442 0.000712 0.000521 0.000411 0.000833 0.000720 0.000527 0.000672 0.000685 0.000541 0.000663 0.000679 Lys 0.001852 0.003023 0.002285 0.002654 0.002705 0.002922 0.003473 0.003247 0.004392 0.004300 0.004119 0.003974 Morpholine 0.000000 0.000239 0.000189 0.000000 0.000222 0.000269 0.000000 0.000000 0.000000 0.000000 0.000195 0.000000 Cadaverine 0.000000 0.000172 0.000000 0.000225 0.000203 0.000156 0.000050 0.000000 0.000195 0.001069 0.000390 0.000097 Deoxyadenosine 0.000254 0.000262 0.000297 0.000296 0.000323 0.000295 0.000353 0.000303 0.000263 0.000301 0.000344 0.000396 Val 0.001477 0.001710 0.001716 0.000000 0.000000 0.001797 0.000000 0.001349 0.001756 0.001520 0.001379 0.001574 Diethanolamine 0.005486 0.003696 0.005038 0.005372 0.004006 0.005957 0.004468 0.004122 0.007336 0.005524 0.004644 0.005985 Citrulline 0.000124 0.000080 0.000105 0.000107 0.000100 0.000119 0.000000 0.000180 0.000110 0.000147 0.000086 0.000093 Tyr 0.000308 0.000453 0.000314 0.000350 0.000361 0.000400 0.000357 0.000462 0.000459 0.000404 0.000379 0.000366 Asp 0.000447 0.000456 0.000421 0.000351 0.000475 0.000516 0.000000 0.000447 0.000502 0.000383 0.000417 0.000413 His 0.000082 0.000107 0.000068 0.000101 0.000073 0.000083 0.000000 0.000083 0.000076 0.000103 0.000000 0.000000 Mevalolactone 0.001394 0.001316 0.001486 0.001423 0.001420 0.001350 0.001786 0.001741 0.001436 0.001525 0.001294 0.001514 Arg 0.000874 0.001456 0.001087 0.001085 0.001103 0.001202 0.001387 0.001220 0.001563 0.000973 0.001051 0.001041 Met 0.001160 0.000959 0.001288 0.001294 0.001070 0.000986 0.001363 0.001075 0.001022 0.001225 0.001256 0.001357 Riboflavin 0.000573 0.000559 0.000864 0.000585 0.000505 0.000860 0.000672 0.000577 0.000742 0.000685 0.001022 0.000748 Pro 0.000366 0.000387 0.000273 0.000337 0.000306 0.000358 0.000281 0.000349 0.000291 0.000319 0.000257 0.000320 Urocanic acid 0.000164 0.000153 0.000142 0.000000 0.000000 0.000149 0.000204 0.000262 0.000160 0.000189 0.000000 0.000147 5-Aminoindole 0.000000 0.000000 0.000117 0.000099 0.000123 0.000000 0.000130 0.000117 0.000109 0.000204 0.000192 0.000152 Ile 0.000787 0.001557 0.001068 0.000952 0.001138 0.001020 0.000952 0.001062 0.001351 0.001097 0.001200 0.001237 Phe 0.000403 0.000721 0.000546 0.000449 0.000519 0.000541 0.000459 0.000642 0.000672 0.000636 0.000569 0.000544 Ethanolamine 0.000973 0.001708 0.002068 0.000940 0.001373 0.001769 0.001912 0.000971 0.002061 0.001222 0.002131 0.001026 Choline 0.000329 0.000394 0.000382 0.000351 0.000317 0.000264 0.000260 0.000258 0.000288 0.000360 0.000252 0.000235 11-Aminoundecanoic acid 0.000697 0.000654 0.000706 0.000611 0.000495 0.000586 0.000944 0.000658 0.000706 0.000670 0.000767 0.000691 Ser 0.001342 0.001206 0.001013 0.001042 0.000891 0.000989 0.000842 0.001248 0.001074 0.001200 0.000835 0.001109 Thr 0.000392 0.000345 0.000335 0.000364 0.000246 0.000244 0.000151 0.000374 0.000294 0.000417 0.000354 0.000318 Urea 0.005337 0.007376 0.004305 0.005505 0.004520 0.003316 0.005156 0.005980 0.004109 0.006400 0.004599 0.005205 Ornithine 0.000406 0.000443 0.000241 0.000307 0.000209 0.000223 0.000180 0.000280 0.000239 0.000365 0.000240 0.000261 Cyclohexylamine 0.000120 0.000152 0.000399 0.000000 0.000000 0.000150 0.000293 0.000127 0.000271 0.000154 0.000270 0.000114 Leu 0.001132 0.004551 0.002356 0.001272 0.001739 0.001853 0.001402 0.001639 0.002178 0.001567 0.001817 0.001862 Triethanolamine 0.000526 0.000748 0.000380 0.000342 0.000290 0.000255 0.000368 0.000539 0.000296 0.000370 0.000237 0.000416 Gln 0.000109 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000174 0.000000 0.000133 0.000000 0.000000 Ribavirin 0.000000 0.000000 0.000590 0.000000 0.000000 0.000000 0.000801 0.000000 0.000000 0.000000 0.000962 0.000000 Uridine 0.000000 0.000000 0.000590 0.000000 0.000000 0.000000 0.000000 0.000000 0.000585 0.000000 0.000961 0.000000 1-Methyl-2-pyrrolidone 0.000000 0.000000 0.002810 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 Thiamine 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000138 0.000095 0.000126 0.000000 0.000057 0.000074 Thymine 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000522 0.000000 0.000000 0.000000 0.000000 metabolite_name KEGG ID HMDB ID m/z MT N-Acetylornithine C00437 HMDB03357 175.10739 9.4308924 Hypoxanthine C00262 HMDB00157 137.0452 10.786189 Tyramine C00483 HMDB00306 138.09122 8.2844925 D-Alanyl-D-alanine C00993 HMDB03459 161.0907333 9.147895667 N-Acetyllysine C12989 HMDB00446 189.12248 9.634831 Trp C00078 HMDB00929 205.09642 10.764809 Ala C00041 HMDB00161 90.05512925 8.913873375 Nicotinamide C00153 HMDB01406 123.0549668 7.360236567 Putrescine C00134 HMDB01414 89.10758545 4.736842664 Cytosine C00380 HMDB00630 112.0511697 7.230034208 Guanine C00242 HMDB00132 152.0567542 8.235241167 Glu C00025 HMDB00148 148.0603108 10.69181529 Adenine C00147 HMDB00034 136.0614325 7.578604225 Thymidine C00214 HMDB00273 243.0872392 20.29413092 Carnitine C00318 HMDB00062 162.1125486 8.536784143 4-Guanidinobutyric acid C01035 HMDB03464 146.0923617 8.2206355 Asn C00152 HMDB00168 133.0596786 10.25693 Agmatine C00179 HMDB01432 131.12898 5.20133825 Benzimidazole C02009 119.0607514 7.160608286 Adenosine C00212 HMDB00050 268.1034475 9.70177625 Gly C00037 HMDB00123 76.0392545 8.235236333 Methionine sulfoxide C02989 HMDB02005 166.05293 11.52399283 Lys C00047 HMDB00182 147.1122192 6.868533692 Morpholine C14452 HMDB31581 88.075928 6.6193306 Cadaverine C01672 HMDB02322 103.1227122 5.015084356 Deoxyadenosine C00559 HMDB00101 252.10852 9.5298475 Val C00183 HMDB00883 118.0860323 9.8469045 Diethanolamine C06772 HMDB04437 106.0862033 7.606009075 Citrulline C00327 HMDB00904 176.1025764 10.79440164 Tyr C00082 HMDB00158 182.080525 11.06779121 Asp C00049 HMDB00191 134.0441427 11.22503473 His C00135 HMDB00177 156.0760644 7.262436278 Mevalolactone HMDB06024 131.07069 20.38325633 Arg C00062 HMDB00517 175.118755 7.091283883 Met C00073 HMDB00696 150.0582575 10.49095625 Riboflavin C00255 HMDB00244 377.1439858 20.18657542 Pro C00148 HMDB00162 116.0708242 10.56531775 Urocanic acid C00785 HMDB00301 139.0500878 8.166587778 5-Aminoindole 133.0757433 7.730951111 Ile C00407 HMDB00172 132.1018067 10.02844742 Phe C00079 HMDB00159 166.08573 10.83110988 Ethanolamine C00189 HMDB00149 62.06036983 6.3475439 Choline C00114 HMDB00097 104.1067767 6.852281442 11-Aminoundecanoic acid C19325 202.1797783 9.532430625 Ser C00065 HMDB00187 106.0497429 9.799276083 Thr C00188 HMDB00167 120.0654325 10.28579879 Urea C00086 HMDB00294 61.04034792 19.48782192 Ornithine C00077 HMDB00214 133.0970833 6.802580233 Cyclohexylamine C00571 100.1118706 7.659856 Leu C00123 HMDB00687 132.1019008 10.12249429 Triethanolamine C06771 150.1118542 8.178730667 Gln C00064 HMDB00641 147.07592 10.515503 Ribavirin C07234 245.0900233 20.27269667 Uridine C00299 HMDB00296 245.07693 20.145361 1-Methyl-2-pyrrolidone C11118 100.07619 20.041794 Thiamine C00378 HMDB00235 265.1111 6.60267816 Thymine C00178 HMDB00262 127.04963 20.304962