metabolite_name 181435 181749 181896 182346 183111 183112 183601 184585 184606 184721 185631 186289 186373 186385 186428 191485 193152 196356 196557 197265 197747 198715 199594 199917 200037 200215 200332 200433 200484 200912 200967 201343 201440 201676 202201 202463 203115 203467 203581 203777 203868 207652 208069 208554 208767 209037 209164 209363 209828 210061 210166 210190 212837 213304 214460 214880 Lactate 1110.76 698.32 909.17 1662.93 427.98 1067.92 1294.01 881.95 940.93 605.10 843.82 1336.73 1032.22 791.13 645.85 943.77 1110.92 516.79 785.74 1130.44 915.62 1045.80 1376.90 852.15 585.09 1017.11 1091.58 659.98 617.08 884.10 613.10 1011.90 1096.83 631.85 1165.02 1207.55 459.15 986.25 576.19 762.43 500.96 562.35 560.88 759.37 970.98 558.18 1347.09 1003.58 671.02 619.03 1286.48 1244.94 928.74 1244.98 908.64 545.97 Pyruvate 68.44 57.31 85.59 90.43 34.42 100.99 87.27 60.71 72.72 46.45 50.41 68.71 68.04 67.74 52.05 66.41 97.27 42.12 61.61 89.72 87.92 102.40 144.61 45.27 54.01 76.09 154.64 61.61 53.42 102.36 44.59 65.15 126.83 75.38 141.23 88.04 54.75 63.74 44.53 62.71 23.61 40.70 37.30 56.55 135.78 46.68 129.52 103.70 59.55 67.35 93.98 117.86 77.28 107.66 58.60 52.40 3-HBA 15.90 12.09 48.31 27.27 291.67 61.43 29.10 34.85 518.96 118.63 33.35 52.15 25.93 118.54 305.86 44.47 36.43 94.25 68.05 40.60 82.61 63.67 38.43 22.25 28.24 57.67 23.06 30.09 46.85 28.22 119.18 28.59 31.12 51.00 30.62 34.89 81.58 32.39 289.93 284.48 118.71 228.87 28.07 48.42 113.36 126.50 308.22 45.54 54.37 32.35 35.62 98.88 35.07 36.00 43.65 48.61 Succinate 3.83 3.80 3.46 4.09 4.40 3.42 2.92 2.67 3.71 4.09 4.02 3.45 3.64 3.48 4.81 5.25 2.76 2.37 4.01 2.05 3.73 3.31 2.43 2.28 4.13 3.43 2.22 1.96 2.54 2.10 3.21 2.83 2.33 2.75 2.33 3.61 2.73 3.32 3.20 4.44 3.35 3.29 6.35 2.73 3.57 2.94 2.86 2.06 2.16 2.22 3.07 2.51 2.60 2.58 3.13 1.56 Fumarate 0.15 0.20 0.19 0.18 0.14 0.23 0.14 0.20 0.26 0.19 0.16 0.14 0.16 0.18 0.17 0.20 0.19 0.17 0.16 0.19 0.22 0.14 0.18 0.16 0.13 0.20 0.19 0.12 0.17 0.17 0.15 0.13 0.17 0.35 0.17 0.29 0.16 0.15 0.15 0.22 0.16 0.15 0.11 0.15 0.21 0.15 0.16 0.14 0.13 0.09 0.15 0.16 0.17 0.14 0.22 0.11 Malate 2.28 3.09 3.07 3.89 2.50 3.96 2.35 2.72 4.49 2.93 2.50 2.48 2.35 2.90 2.91 3.29 2.98 2.26 2.95 2.92 3.71 3.77 2.31 2.19 2.27 3.24 2.40 1.72 2.60 2.05 2.66 2.21 2.21 2.94 2.32 4.39 2.62 2.34 2.53 3.81 2.55 2.90 1.84 2.57 3.10 2.63 2.55 2.16 1.97 2.00 2.75 2.73 2.35 2.48 3.61 2.18 a-KG 7.74 7.19 12.16 13.67 9.35 11.85 5.38 4.85 9.80 12.06 9.34 4.93 5.78 7.03 7.15 20.54 5.06 3.56 4.93 5.89 7.16 5.03 5.34 3.71 6.02 5.41 5.37 12.25 3.69 4.80 9.73 4.36 6.27 4.80 5.13 6.58 4.15 5.46 6.87 8.80 3.97 4.86 3.29 3.25 5.93 4.02 6.00 3.20 5.44 3.14 4.43 7.39 4.34 5.04 5.47 3.77 Citrate 70.64 56.00 90.39 87.23 108.07 81.97 108.90 107.30 149.06 69.05 89.24 78.17 91.90 128.37 105.86 88.61 87.65 79.15 83.33 92.99 119.82 116.35 80.28 61.32 82.90 113.02 68.88 48.06 78.23 71.81 89.84 74.39 96.91 76.12 95.27 107.02 93.39 80.44 122.14 132.60 87.11 76.88 67.56 81.08 90.74 59.26 98.84 65.74 65.43 58.78 82.91 102.90 85.43 96.60 116.69 69.48 metabolite_name Retention Index Moverz Quant PubChem CID Lactate 3.98 196.1, 91.062 107689 Pyruvate 6.68 299.1, 91.186 1060 3-HBA 4.21 210.1, 91.153 441 Succinate 5.44 329.1, 206.233 1110 Fumarate 5.59 327.1, 91.192 444972 Malate 5.28 345.1, 91.18 525 a-KG 6.59 462.2, 91.2 164533 Citrate 5.95 508.25, 385 311