metabolite_name H1_D0_1 H1_D0_2 H1_D0_3 H1_D0_4 H1_D0_5 H2_D0_1 H2_D0_2 H2_D0_3 H2_D0_4 H2_D0_5 H3_D0_1 H3_D0_2 H3_D0_3 H3_D0_4 H3_D0_5 H1_D1_1 H1_D1_2 H1_D1_3 H1_D1_4 H1_D1_5 H2_D1_1 H2_D1_2 H2_D1_3 H2_D1_4 H2_D1_5 H3_D1_1 H3_D1_2 H3_D1_3 H3_D1_4 H3_D1_5 H1_D3_1 H1_D3_2 H1_D3_3 H1_D3_4 H1_D3_5 H2_D3_1 H2_D3_2 H2_D3_3 H2_D3_4 H2_D3_5 H3_D3_1 H3_D3_2 H3_D3_3 H3_D3_4 H3_D3_5 H1_D5_1 H1_D5_2 H1_D5_3 H1_D5_4 H1_D5_5 H2_D5_1 H2_D5_2 H2_D5_3 H2_D5_4 H2_D5_5 H3_D5_1 H3_D5_2 H3_D5_3 H3_D5_4 H3_D5_5 H1_D7_1 H1_D7_2 H1_D7_3 H1_D7_4 H1_D7_5 H2_D7_1 H2_D7_2 H2_D7_3 H2_D7_4 H2_D7_5 H3_D7_1 H3_D7_2 H3_D7_3 H3_D7_4 H3_D7_5 H1_NF_1 H2_NF_1 H2_NF_2 H2_NF_3 H2_NF_4 H2_NF_5 H3_NF_1 H3_NF_2 H3_NF_3 H3_NF_4 H3_NF_5 H1_EF_1 H2_EF_1 H2_EF_2 H2_EF_3 H2_EF_4 H2_EF_5 H3_EF_1 H3_EF_2 H3_EF_3 H3_EF_4 H3_EF_5 H1_D0_1_diluted H1_D0_2_diluted H1_D0_3_diluted H1_D0_4_diluted H1_D0_5_diluted H2_D0_1_diluted H2_D0_2_diluted H2_D0_3_diluted H2_D0_4_diluted H2_D0_5_diluted H3_D0_1_diluted H3_D0_2_diluted H3_D0_3_diluted H3_D0_4_diluted H3_D0_5_diluted H1_D1_1_diluted H1_D1_2_diluted H1_D1_3_diluted H1_D1_4_diluted H1_D1_5_diluted H2_D1_1_diluted H2_D1_2_diluted H2_D1_3_diluted H2_D1_4_diluted H2_D1_5_diluted H3_D1_1_diluted H3_D1_2_diluted H3_D1_3_diluted H3_D1_4_diluted H3_D1_5_diluted H1_D3_1_diluted H1_D3_2_diluted H1_D3_3_diluted H1_D3_4_diluted H1_D3_5_diluted H2_D3_1_diluted H2_D3_2_diluted H2_D3_3_diluted H2_D3_4_diluted H2_D3_5_diluted H3_D3_1_diluted H3_D3_2_diluted H3_D3_3_diluted H3_D3_4_diluted H3_D3_5_diluted H1_D5_1_diluted H1_D5_2_diluted H1_D5_3_diluted H1_D5_4_diluted H1_D5_5_diluted H2_D5_1_diluted H2_D5_2_diluted H2_D5_3_diluted H2_D5_4_diluted H2_D5_5_diluted H3_D5_1_diluted H3_D5_2_diluted H3_D5_3_diluted H3_D5_4_diluted H3_D5_5_diluted H1_D7_1_diluted H1_D7_2_diluted H1_D7_3_diluted H1_D7_4_diluted H1_D7_5_diluted H2_D7_1_diluted H2_D7_2_diluted H2_D7_3_diluted H2_D7_4_diluted H2_D7_5_diluted H3_D7_1_diluted H3_D7_2_diluted H3_D7_3_diluted H3_D7_4_diluted H3_D7_5_diluted H1_NF_1_diluted H2_NF_1_diluted H2_NF_2_diluted H2_NF_3_diluted H2_NF_4_diluted H2_NF_5_diluted H3_NF_1_diluted H3_NF_2_diluted H3_NF_3_diluted H3_NF_4_diluted H3_NF_5_diluted H1_EF_1_diluted H2_EF_1_diluted H2_EF_2_diluted H2_EF_3_diluted H2_EF_4_diluted H2_EF_5_diluted H3_EF_1_diluted H3_EF_2_diluted H3_EF_3_diluted H3_EF_4_diluted H3_EF_5_diluted Propionate 1.355 1.665 1.235 1.515 1.955 1.415 1.405 1.37 1.465 1.48 1.885 2.395 2.04 2.215 2.355 2.84 2.735 3.315 3.02 2.72 2.375 1.71 3.13 2.965 3.07 4.305 1.62 2.995 2.755 4.545 14.95 58.5 59.5 29.4 18 44.2 41.85 62 61 61 7.45 28.85 9.15 33.3 29.85 40.55 40 52.5 71.5 34.55 74 70 79.5 55 54 102.5 93 51.5 143 88.5 88.5 166.5 107.5 96.5 45.9 82.5 85.5 93 25.65 67.5 75 94 116 78.5 84 93.5 61 17.65 43.6 17.55 22.8 72.5 55.5 19.65 17.55 12.9 9.85 22.3 56 32.05 2.48 9.4 9.15 11.35 14.35 1.59 14.2 Acetate 16 97.5 13.4 12.75 21.95 18.3 10.1 10.55 10.6 9.8 66.5 46 13.9 20.85 22.05 109.25 322.5 362.5 427.5 492.5 647.5 68.25 520 287.5 690 702.5 183.5 615 522.5 475 900 1250 1542.5 1192.5 1545 1357.5 1317.5 1730 1477.5 1192.5 1240 1417.5 1067.5 1275 1155 967.5 1465 1810 1447.5 812.5 1762.5 1930 2102.5 1857.5 1160 2047.5 2015 1972.5 2092.5 1575 1447.5 1847.5 1787.5 1640 1327.5 1262.5 1345 1147.5 632.5 1322.5 1485 1695 1460 1367.5 1587.5 2220 1170 800 347.5 590 627.5 1035 1112.5 595 457.5 552.5 787.5 580 1485 617.5 159 367.5 700 512.5 557.5 98 485 Butyrate 16 97.5 13.4 12.75 21.95 18.3 10.1 10.55 10.6 9.8 66.5 46 13.9 20.85 22.05 109.25 322.5 362.5 427.5 492.5 647.5 68.25 520 287.5 690 702.5 183.5 615 522.5 475 900 1250 1542.5 1192.5 1545 1357.5 1317.5 1730 1477.5 1192.5 1240 1417.5 1067.5 1275 1155 967.5 1465 1810 1447.5 812.5 1762.5 1930 2102.5 1857.5 1160 2047.5 2015 1972.5 2092.5 1575 1447.5 1847.5 1787.5 1640 1327.5 1262.5 1345 1147.5 632.5 1322.5 1485 1695 1460 1367.5 1587.5 2220 1170 800 347.5 590 627.5 1035 1112.5 595 457.5 552.5 787.5 580 1485 617.5 159 367.5 700 512.5 557.5 98 485 Valerate 1.13 1.385 1.085 1.165 1.285 1.41 1.12 1.125 1.325 1.16 1.825 1.715 1.53 1.51 1.63 1.975 2.275 1.985 3.005 3.025 3.025 1.32 2.26 2.44 2.445 2.65 1.76 2.07 2.21 2.42 8 6.3 13.3 8.2 8.3 4.765 4.94 11.5 6.05 10.85 4.975 8.25 3.065 6.8 11.85 4.825 4.175 10.15 7.75 6.3 11.85 7.5 10.3 7.95 6.35 9.4 10.3 11.15 19.25 6.95 9.5 15.45 11.75 9.6 7.9 8.25 10.95 12 3.19 6.95 11.7 11.2 9.45 10.75 15.9 26.15 6.85 2.775 5.8 2.4 5.8 8.65 7.65 3.62 4.085 4.595 4.385 4.48 5.45 4.605 1.465 3.615 3.235 2.65 5.3 1.945 7.3 Isovalerate 0.94 0.915 0.905 0.89 0.92 0.91 0.925 0.935 0.94 0.915 0.925 0.975 0.985 1.015 0.945 0.935 0.965 0.945 0.995 1.135 1.05 0.89 0.935 1.08 0.915 1.12 0.935 0.97 0.98 1.05 1.295 1.495 1.63 1.375 1.32 1.14 1.415 1.48 1.275 1.625 2.63 2.065 1.535 1.905 1.67 1.34 1.16 1.345 0.97 0.795 1.185 1.12 1.255 1.195 1.38 2.6 2.865 2.87 3.14 3.075 0.765 1.43 1.58 1.46 1.01 1.725 1.795 1.735 1.375 2.085 1.965 2.045 1.67 1.59 2.115 1.585 1.585 1.56 1.82 1.795 1.775 1.535 1.47 1.38 1.085 1.445 2.855 1.94 2.005 2.58 1.82 1.63 1.325 1.255 1.365 1.675 1.18 Isobutyrate 0.313 0.262 0.424 0.955 0.64 0.835 0.062 0.436 0.655 0.302 0.208 0.098 0.202 0.131 0.76 4.775 19.35 6.7 3.215 9.3 5.25 4.47 5.9 8.05 6.6 3.75 1.94 0.7 4.38 2.19 7.25 6.05 6.1 17.6 15.2 14.3 14.6 20.15 11.8 11 14.9 13.4 20.8 16.4 10.4 12.4 14 18.85 10.35 13.9 9.75 10.95 11.9 3.985 16.45 7.2 12.15 8.35 10.55 13.35 25.35 9.05 4.855 10.6 2.795 2.97 7.3 8.9 5.3 4.075 7.35 2.38 2.475 9.5 3.56 0.83 1.88 4.43 4.07 6.45 1.58 5.35 Lactate 10.5 91 7.45 6.3 8.8 5.05 8 5 5.6 5.55 37.3 25.4 6.85 7.25 6.65 290 415 812.5 975 637.5 312.5 118 385 355 765 105.25 257.5 385 224.5 485 21.75 362.5 60 68 59 36 179.5 91.25 44.25 79.25 212.25 229.5 462.5 166 186.25 14.05 373 14.3 34.15 10.95 23.85 15.9 15.75 19.45 80.5 52 34.05 150 21.3 400 97.25 47.5 16.55 39.65 20.55 82 31.3 18.5 32.1 31.9 41.1 26.3 30.15 17.5 25.25 32.25 18.7 37 36.5 157 523 10.75 17.9 175 20.9 43.55 2182.5 1105 48.85 194.25 227.25 395 142.25 99.5 198.5 2.335 108 metabolite_name m/z KEGG Pubchem SID Pubchem CID Acetate 194 C00033 3335 176 Propionate 208 C00163 3463 1032 Butyrate 222 C00246 3545 264 Isobutyrate 222 C02632 5612 6590 Valerate 236 C00803 4061 7991 Isovalerate 236 C08262 10461 10430 Lactate 224 C00186 3486 107689