Data for ST002517
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 | F10 | F11 | F12 | F13 | F14 | F15 | F16 | F17 | F18 | F19 | F20 | F21 | F22 | F23 | F24 | F25 | F26 | F27 | F28 | F29 | F30 | F31 | F32 | F33 | F34 | F35 | F36 | F37 | F38 | F39 | F40 | F41 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Pos_1-Methyl-1,3-dihydro-2H-benzimidazole-2-thione_164.04082... | - | 187763245.77 | 99750528.82 | 64898241.75 | - | 85686691.36 | 138252346.90 | 21894709.83 | 114972708.25 | 174829296.03 | - | 235050146.50 | 86939703.79 | 56090509.79 | - | 160560780.27 | 116743010.50 | - | 90361603.12 | 159994673.87 | - | - | 78331898.40 | 209470456.40 | 86531906.42 | - | 108383605.64 | 58038169.09 | 70117987.07 | 3000367.91 | 266915384.47 | - | 125734964.79 | 157499289.13 | 81023087.42 | - | 170026729.76 | 157792146.01 | 33190798.44 | 36410615.90 | 217248739.43 | |
| Pos_1-Methyl-1,3-dihydro-2H-benzimidazole-2-thione_164.04082... | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 53569.63 | - | |
| Pos_1-Methyl-1,3-dihydro-2H-benzimidazole-2-thione_164.04082... | - | 439164.72 | - | - | - | - | - | - | - | 359445.54 | - | 379492.45 | - | - | - | 164175.27 | 154755.39 | - | - | 130007.61 | - | - | 387002.75 | 689204.52 | - | - | - | - | - | - | 1207148.34 | - | 146764.39 | 447098.72 | - | - | 278020.39 | 125868.42 | - | - | 335746.20 | |
| Pos_3-(2-methylpropyl)-octahydropyrrolo[1,2-a]pyrazine-1,4-d... | - | 38253225.01 | - | 15329609.55 | - | 9493591.40 | - | 7055588.79 | 163396.84 | 26511214.20 | - | 12263459.55 | - | 11913387.34 | - | 13193156.13 | - | 11646871.85 | - | 17117396.99 | - | - | - | - | - | - | 23622469.01 | - | 173543.27 | - | 207249.29 | - | 12393083.28 | - | 19493234.58 | - | 6112113.52 | - | 23609387.70 | - | 15978092.06 | |
| Pos_3-(2-methylpropyl)-octahydropyrrolo[1,2-a]pyrazine-1,4-d... | - | - | 56241.15 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 46072.02 | - | - | - | - | - | - | - | |
| Pos_3-(2-methylpropyl)-octahydropyrrolo[1,2-a]pyrazine-1,4-d... | - | 303501.60 | - | - | - | - | - | - | - | 159813.71 | - | - | - | - | - | - | - | - | - | 59028.09 | - | - | - | - | - | - | - | - | - | - | - | - | 85459.65 | - | 121508.44 | - | - | - | - | - | - | |
| Pos_3-(2-methylpropyl)-octahydropyrrolo[1,2-a]pyrazine-1,4-d... | - | 177.83 | 113.23 | - | - | - | - | - | - | - | - | - | 108.37 | - | - | - | - | - | - | - | - | - | - | 137.40 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_3-(2-methylpropyl)-octahydropyrrolo[1,2-a]pyrazine-1,4-d... | - | 341082.86 | 217173.41 | - | - | - | - | - | - | - | - | - | 207844.44 | - | - | - | - | - | - | - | - | - | - | 263530.99 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_4-Guanidinobutyric acid_145.08513_146.0922_7.674_ExRate0 | 957617.97 | 278086903.00 | 2510314.75 | 306778104.74 | 3287940.48 | 156477881.07 | 4494669.78 | 336398922.73 | 6171203.95 | 318838024.63 | 2165969.44 | 119763484.13 | 2963258.52 | 174769575.13 | 3886466.50 | 131217306.59 | 4442060.91 | 158599896.03 | 3027502.95 | 292468997.63 | 714458.20 | 2636173.21 | 442428698.45 | 2759275.79 | 456433029.55 | 1808589.58 | 862042759.95 | 2127306.52 | 822203914.60 | 5221547.28 | 418801843.30 | 2923079.97 | 265193173.50 | 2131255.03 | 526912194.93 | 5443687.03 | 127807726.75 | 3345813.75 | 339181986.33 | 1628347.12 | 278137706.10 | |
| Pos_4-Guanidinobutyric acid_145.08513_146.0922_7.674_ExRate1 | - | - | - | - | - | - | - | - | - | - | - | 24147.95 | - | 309295.84 | - | - | - | - | - | - | - | - | - | - | - | - | 264643.72 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_4-Guanidinobutyric acid_145.08513_146.0922_7.674_ExRate2 | - | 53243.51 | - | 45943.96 | - | - | - | - | - | - | - | - | - | 47112.41 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_4-IMIDAZOLEACETIC ACID__PRJKNHOMHKJCEJ-UHFFFAOYSA-N_126.... | - | 1911565.25 | 43987.64 | 3194562.94 | - | 1237219.53 | 35428.31 | 4447273.82 | 236158.14 | 2366924.27 | 28248.00 | 846717.30 | 44155.45 | 2121917.28 | 59026.24 | 888437.72 | 68910.06 | 1890838.17 | - | 1939661.01 | - | 32320.29 | 1787710.64 | - | 4072217.27 | - | 5464001.07 | - | 6252848.86 | 33332.79 | 770597.71 | 33458.53 | 1746561.38 | 67396.90 | 7322446.07 | 66156.02 | 1043275.32 | 45185.50 | 3037521.00 | - | 2334935.07 | |
| Pos_Acetylarginine_216.12224_217.1293_8.109_ExRate0 | 121411.48 | 2536578.79 | 93354.86 | 2747272.81 | 319585.22 | 6472384.97 | 124609.54 | 2301082.19 | 1117320.38 | 3297572.35 | - | 1431508.41 | 143634.68 | 890728.70 | 526835.24 | 8828595.23 | 249204.70 | 725845.49 | 184083.52 | 4797258.11 | - | 373932.42 | 2565774.71 | 63306.23 | 2970699.55 | - | 11225866.57 | - | 6304695.46 | 1058907.94 | 5674995.10 | 176555.87 | 3816187.20 | 104296.77 | 5338877.99 | 984571.61 | 11149990.11 | 163335.01 | 2479004.00 | 109983.36 | 2782732.35 | |
| Pos_Acetylarginine_216.12224_217.1293_8.109_ExRate1 | - | 6833.23 | - | 136257.88 | - | - | - | 5392.93 | - | 2104.97 | - | - | - | 47262.72 | 36685.98 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 193621.09 | - | - | - | - | - | - | |
| Pos_Acetylarginine_216.12224_217.1293_8.109_ExRate2 | - | - | - | 6113472.92 | - | - | - | 661181.52 | - | - | - | - | - | 3464228.53 | - | - | - | 187472.22 | - | - | - | - | - | - | 834243.65 | - | - | - | 220927.21 | - | - | - | - | - | 13987467.50 | - | - | - | 474611.68 | - | - | |
| Pos_Acetylarginine_216.12224_217.1293_8.109_ExRate3 | - | - | - | - | - | - | - | 2293.44 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 4585.76 | - | - | - | - | - | - | |
| Pos_Adenosine_267.09675_268.1038_5.004_ExRate0 | - | 5249837.95 | - | 3113867.33 | 349296.10 | 2475281.99 | 432839.23 | 4246825.05 | 1215914.98 | 5485441.11 | 271274.24 | 4814298.84 | - | 408681.66 | 503474.49 | 928351.45 | 383526.10 | 903404.86 | 664265.86 | 5910062.41 | - | - | - | - | 780365.77 | - | 19620522.02 | - | - | - | - | 60704.92 | 6727799.38 | - | 7198935.82 | 324381.93 | 2935519.16 | 674558.10 | 3997799.06 | 503692.83 | 4610174.04 | |
| Pos_Adenosine_267.09675_268.1038_5.004_ExRate1 | - | - | 0.27 | - | - | - | - | 122189.85 | - | - | - | - | 108.22 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 239.19 | 681599.44 | - | - | - | 967521.84 | - | - | |
| Pos_Adenosine_267.09675_268.1038_5.004_ExRate2 | - | - | 356889.87 | 540501.96 | - | - | 409321.33 | 553204.06 | - | - | - | - | 135873.22 | - | - | - | 321988.27 | 177029.05 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 300310.09 | 1981740.07 | - | - | 1107566.64 | 2257295.76 | - | - | |
| Pos_Adenosine_267.09675_268.1038_5.004_ExRate3 | - | - | 35808.60 | 407289.41 | - | - | 106504.34 | 288386.20 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 1273135.37 | - | - | 207274.01 | 520569.98 | - | - | |
| Pos_Adenosine_267.09675_268.1038_5.004_ExRate4 | - | - | 82963.60 | 491273.01 | - | - | - | 199127.58 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 1115419.51 | - | - | 169717.20 | 975740.97 | - | - | |
| Pos_Adenosine_267.09675_268.1038_5.004_ExRate5 | - | - | - | 51418.69 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 558067.53 | - | - | - | 42079.05 | - | - | |
| Pos_Adenosine_267.09675_268.1038_5.004_ExRate6 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 45824.01 | - | - | - | - | - | - | |
| Pos_Agmatine_130.12185_131.1291_8.897_ExRate0 | 54002.91 | 3907136.36 | 57821.60 | 4663254.15 | 95642.15 | 1542378.11 | 95824.38 | 4469249.93 | 533558.08 | 3990726.05 | 52666.43 | 1278898.78 | 37767.11 | 1702931.67 | 34966.33 | 929349.04 | 103447.94 | 1615626.60 | 43122.05 | 2036567.37 | - | 29311.28 | 14475151.57 | 24925.18 | 14192853.24 | - | 29387998.46 | 55246.61 | 32849594.58 | 65602.12 | 19482470.21 | 49711.62 | 2849847.45 | 55969.56 | 8708735.40 | 133745.02 | 1259712.42 | 91728.04 | 4447193.86 | 48204.57 | 3761433.18 | |
| Pos_[Alanine_[M+H]+_QNAYBMKLOCPYGJ-REOHCLBHSA-N]_89.04768_90... | 656107.45 | 1382810.98 | 1163542.58 | 1328867.50 | 626173.39 | 1468450.04 | 834283.71 | 2491371.54 | 702472.84 | 2728231.72 | 671920.55 | 950062.62 | 1723064.79 | 967679.28 | 807068.36 | 1178420.27 | 704702.26 | 922497.71 | 883677.57 | 2412725.09 | 794535.03 | 225184.56 | 1971563.73 | 615835.74 | 2128525.74 | 355490.57 | 3641506.29 | 524838.46 | 3049430.62 | 1483621.14 | 2130680.78 | 647192.85 | 1635808.65 | 939142.81 | 1311610.16 | 2062055.10 | 990149.38 | 687448.63 | 1610519.12 | 2153413.30 | 1732585.93 | |
| Pos_[Alanine_[M+H]+_QNAYBMKLOCPYGJ-REOHCLBHSA-N]_89.04768_90... | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 17972.68 | - | - | - | - | - | - | |
| Pos_[Alanine_[M+H]+_QNAYBMKLOCPYGJ-REOHCLBHSA-N]_89.04768_90... | - | - | 42298.48 | 854863.30 | - | - | 82923.95 | 908305.87 | - | - | - | - | - | 205946.49 | - | - | 57503.62 | 124983.11 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 992332.31 | - | - | - | 493892.37 | - | - | |
| Pos_Choline_103.09971_104.1069_5.175_ExRate0 | 3222911.55 | 5219827.75 | 2602620.08 | 4866117.21 | 3264180.34 | 6149762.30 | 9066085.27 | 4261212.10 | 3803747.07 | 5687005.95 | 5157211.95 | 3381095.95 | 4743837.84 | 10631501.99 | 5031668.81 | 4868696.64 | 6624430.74 | 3851181.89 | 4275953.45 | 5607650.01 | 1132329.72 | 3840774.38 | 8053881.53 | 2459770.75 | 3898667.75 | 2553807.01 | 3948941.58 | 3192714.94 | 8283213.27 | 4175021.73 | 10678100.19 | 4650868.91 | 3824424.39 | 4872477.63 | 3080654.37 | 3201161.54 | 3651238.92 | 3411982.68 | 14248118.34 | 3464743.33 | 4205572.68 | |
| Pos_DL-Arginine_174.11168_175.1186_9.478_ExRate0 | 174307041.03 | 8822514254.67 | 414625192.70 | 8768846877.67 | 838518093.67 | 6537833953.67 | 364971008.57 | 6859440232.33 | 1155220808.73 | 9008436437.33 | 159125151.87 | 8287992932.67 | 538082919.80 | 4824458925.00 | 1158261586.67 | 5582124909.67 | 958927565.43 | 4500689237.33 | 496093114.01 | 7947651545.00 | 26825367.31 | 460399564.74 | 8241718102.00 | 627100891.75 | 8339673849.50 | 219081423.95 | 12511503000.00 | 345916212.80 | 9697083156.50 | 1138692531.15 | 7664585127.00 | 470151793.87 | 7645082868.00 | 287448402.09 | 9514185431.67 | 1436688188.23 | 5931440489.67 | 740219853.53 | 8830580953.33 | 189070447.57 | 7545331968.33 | |
| Pos_DL-Glutamine_146.06914_147.0763_8.666_ExRate0 | 321334.35 | 40839745.50 | 721653.21 | 24936284.45 | 3710826.65 | 80528688.96 | 1062010.63 | 35139016.97 | 1946724.48 | 93472130.48 | 1019667.22 | 38880328.16 | 1662479.18 | 21388594.23 | 2546319.85 | 77783402.65 | 1293949.02 | - | 556049.89 | 66693804.09 | - | - | 359666.45 | - | 398534.16 | - | 4167547.89 | - | 671960.41 | - | 710526.95 | 689229.76 | 17176381.93 | 895280.51 | 22158199.01 | 2374235.46 | 54978974.56 | 341326.50 | 23777417.10 | 816559.07 | 63119284.75 | |
| Pos_DL-Glutamine_146.06914_147.0763_8.666_ExRate1 | - | 304383.11 | - | 137387.89 | - | - | - | 734611.34 | - | - | - | - | - | 273939.80 | - | - | - | - | - | 582319.20 | - | - | - | - | - | - | - | - | - | - | - | - | 32030.14 | - | 161419.63 | - | 416135.75 | - | 790038.24 | - | 551544.16 | |
| Pos_DL-Glutamine_146.06914_147.0763_8.666_ExRate2 | - | - | 459617.80 | 19345698.81 | - | - | 1137582.88 | 34592044.01 | - | - | - | - | 597481.55 | 26926143.85 | - | - | 593784.95 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 288777.28 | 15519487.97 | - | - | 191647.05 | 25517170.49 | - | - | |
| Pos_DL-Glutamine_146.06914_147.0763_8.666_ExRate3 | - | - | 56164.64 | 2569138.77 | - | - | 20923.44 | 1203414.05 | - | - | - | - | 13251.71 | 941966.07 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 1493300.06 | - | - | - | 893696.82 | - | - | |
| Pos_DL-Glutamine_146.06914_147.0763_8.666_ExRate4 | - | - | 1701595.42 | 52499942.56 | - | - | 1639108.02 | 22159010.07 | - | - | - | - | 1336629.83 | 25358174.00 | - | - | 529187.16 | - | - | - | - | - | - | - | 113591.79 | - | - | - | - | - | - | - | - | 1329119.82 | 39135068.06 | - | - | 347242.93 | 15478745.56 | - | - | |
| Pos_DL-Glutamine_146.06914_147.0763_8.666_ExRate5 | - | - | - | 703714.56 | - | - | - | 106012.23 | - | - | - | - | - | 218915.84 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 379858.85 | - | - | - | 120206.71 | - | - | |
| Pos_DL-Homoserine_119.05824_120.0654_8.285_ExRate0 | 7732274.32 | 359667832.37 | 3155184.86 | 326143091.87 | 6599770.07 | 213049515.10 | 3869241.72 | 339016184.73 | 10459497.62 | 365479283.53 | 4166851.21 | 237701698.40 | 4716608.76 | 233845179.00 | 9231120.46 | 253472839.30 | 7632667.25 | 219837998.87 | 4456671.56 | 559769351.97 | 802073.68 | 4275852.73 | 492057241.80 | 3377775.44 | 518190120.05 | 2626937.03 | 969684013.05 | 2902421.15 | 615285212.30 | 9137372.66 | 556690041.35 | 5722022.26 | 435635048.90 | 3268287.83 | 527674035.77 | 11413674.83 | 182080527.47 | 5225325.36 | 344217172.80 | 2901265.06 | 296956476.93 | |
| Pos_DL-Homoserine_119.05824_120.0654_8.285_ExRate1 | 57426.37 | - | - | 569149.90 | - | - | - | 573089.62 | - | 374523.62 | 47112.35 | - | 2104.09 | 299266.53 | - | 383865.97 | - | - | - | 2442502.17 | - | 81618.91 | 32377.88 | - | - | 28508.23 | - | - | 947382.30 | - | 755383.58 | - | - | - | 11824536.50 | - | - | - | - | - | 226990.03 | |
| Pos_DL-Homoserine_119.05824_120.0654_8.285_ExRate2 | - | 134723.31 | - | 1353519.76 | - | 111731.80 | - | 873807.11 | - | 162109.63 | - | 93585.48 | - | 1179307.39 | - | 107936.35 | - | 633539.47 | - | 260597.16 | - | - | 226994.46 | - | 239525.22 | - | 396513.57 | - | 210348.68 | - | 263810.54 | - | 234092.89 | 29282.57 | 2738221.11 | - | 69826.55 | - | 1105012.85 | - | 181370.61 | |
| Pos_DL-Lysine_146.10553_147.1126_9.556_ExRate0 | 1277716.60 | 324581052.20 | 2826117.51 | 315071990.10 | 5292943.09 | 182909760.87 | 3673320.70 | 185193545.27 | 12071390.84 | 352224570.90 | 897620.77 | 199331305.37 | 3202404.36 | 199479178.23 | 9364918.33 | 218038206.03 | 8995039.49 | 182282212.13 | 4510701.77 | 350863938.17 | 929619.23 | 1816974.64 | 209253520.25 | 3368113.58 | 144009435.30 | 690673.61 | 533684736.90 | 1833768.29 | 428239545.40 | 6974716.63 | 370891580.70 | 2810915.75 | 327260153.34 | 2248398.59 | 316399415.87 | 10493757.35 | 162374533.83 | 6167987.96 | 334723359.87 | 1371953.24 | 280177544.17 | |
| Pos_DL-Lysine_146.10553_147.1126_9.556_ExRate1 | - | - | - | 430700.73 | - | - | - | 116296.04 | 76757.26 | 357219.10 | - | 528489.92 | - | - | - | - | - | - | - | - | - | - | - | - | 346729.32 | - | 150166.90 | - | - | - | - | - | - | - | 780632.44 | 25633.74 | - | - | - | - | 2448670.83 | |
| Pos_DL-Lysine_146.10553_147.1126_9.556_ExRate2 | - | 199127.29 | - | 1615602.89 | - | 136783.36 | - | 1670412.60 | - | 292439.67 | - | 123796.82 | - | 930959.70 | - | 110910.83 | - | 1018257.48 | - | 380322.08 | - | - | - | - | 49264.98 | - | 329576.82 | - | 178552.82 | - | 354840.32 | - | 341391.20 | - | 1371673.33 | - | 110322.44 | - | 2325339.60 | - | 141489.97 | |
| Pos_DL-Lysine_146.10553_147.1126_9.556_ExRate3 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 48801.90 | - | - | - | 68253.57 | - | - | |
| Pos_DL-Lysine_146.10553_147.1126_9.556_ExRate4 | - | - | - | 3761638.18 | - | - | - | 1240288.68 | - | - | - | - | - | 1293487.92 | - | - | - | 416521.03 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 3874940.32 | - | - | - | 2217453.78 | - | - | |
| Pos_DL-Serine_105.04259_106.0497_8.674_ExRate0 | 1148684.00 | 201625704.63 | 1678122.19 | 169210327.22 | 3501267.24 | 120990400.93 | 2128646.23 | 172153919.79 | 5431204.77 | 192110340.87 | 1379968.82 | 129623066.78 | 2483274.85 | 104893957.05 | 5455682.19 | 116937365.03 | 4366882.84 | 95238570.60 | 2770299.55 | 283068481.51 | 256294.47 | 2302340.36 | 266864047.50 | 1845872.20 | 222648769.70 | 1671952.79 | 535999362.00 | 1467262.43 | 367779262.35 | 5348457.97 | 331328411.35 | 2640876.19 | 225641439.39 | 1630950.99 | 273073381.07 | 6980605.23 | 98181118.55 | 2762784.58 | 196719598.80 | 1387548.13 | 176598845.86 | |
| Pos_DL-Serine_105.04259_106.0497_8.674_ExRate1 | - | 69467.21 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 94176.86 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_DL-Serine_105.04259_106.0497_8.674_ExRate2 | - | - | - | 279034.19 | - | - | - | 198452.87 | - | - | - | - | - | 284323.93 | - | - | - | 130492.80 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 583408.51 | - | - | - | 295759.90 | - | - | |
| Pos_DL-Tryptophan_204.08988_205.0969_6.87_ExRate0 | 759966.36 | 123905197.90 | 1435238.76 | 120708778.42 | 3422600.20 | 71067086.93 | 1696330.76 | 147816540.14 | 5870852.04 | 133089812.40 | 1077230.43 | 74082895.68 | 2260168.55 | 72010306.53 | 4960649.57 | 80538027.45 | 3830267.70 | 65786547.14 | 2199907.47 | 259102275.35 | - | 1640311.68 | 146500500.00 | 1465965.81 | 172218432.51 | 1107966.12 | 381704899.05 | 1032388.28 | 222435944.90 | 4575469.00 | 198859814.20 | 2128103.81 | 183401934.54 | 1322779.66 | 254133844.22 | 6135954.61 | 55966973.69 | 2469593.35 | 122999139.25 | 999686.84 | 106184276.71 | |
| Pos_DL-Tryptophan_204.08988_205.0969_6.87_ExRate7 | - | - | - | - | - | - | - | - | - | 2.86 | - | - | - | - | - | - | - | - | - | 4.72 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_DL-Tryptophan_204.08988_205.0969_6.87_ExRate8 | - | - | - | - | - | - | - | - | - | 57618.55 | - | - | - | - | - | - | - | - | - | 94896.65 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_D-(+)-Proline_115.06333_116.0704_7.783_ExRate0 | 49383308.74 | 2931473023.33 | 32082482.19 | 2025904937.03 | 63586705.93 | 1615172614.33 | 29773914.19 | 2628150192.33 | 84002632.63 | 2593309622.67 | 42479423.14 | 1928626312.00 | 52891835.96 | 1633971453.67 | 100188323.64 | 1938128824.67 | 61227915.74 | 1692314473.67 | 42896699.32 | 4322571305.67 | 27495400.22 | 32272441.35 | 3497049678.50 | 41450179.95 | 2773234257.50 | 34865926.19 | 5353095851.50 | 35035385.24 | 4027117293.50 | 104244019.34 | 3526682976.50 | 56730130.47 | 3012896188.23 | 35081524.96 | 3782808863.67 | 100190371.91 | 1329053624.00 | 55460940.76 | 2421858627.33 | 36361543.05 | 2097060528.67 | |
| Pos_D-(+)-Proline_115.06333_116.0704_7.783_ExRate3 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 25452.37 | - | - | - | |
| Pos_Guanine_151.04941_152.0566_6.497_ExRate0 | - | - | - | - | - | - | - | - | - | 62264.88 | - | - | - | 38904.95 | - | - | - | - | - | 253544.93 | - | - | 1847233.58 | - | 1798615.13 | - | 4634433.53 | - | 3065594.80 | 39489.12 | 2436932.78 | - | 2280641.37 | - | 3045973.59 | 51746.58 | 676296.29 | - | 1489353.16 | - | 1363392.69 | |
| Pos_Guanine_151.04941_152.0566_6.497_ExRate1 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 59311.79 | - | - | - | - | - | - | |
| Pos_Histamine_111.07965_112.0868_8.272_ExRate0 | 160148.47 | 5764667.53 | 116227.88 | 5901405.02 | 287634.32 | 3223759.40 | 259852.90 | 5647494.87 | 343943.43 | 5956235.50 | - | 3911187.97 | 189360.29 | 3771003.77 | 243172.61 | 3947783.59 | 279437.78 | 3434027.93 | 239408.07 | 8425387.13 | 104704.32 | 203781.48 | 6060829.18 | 324850.25 | 6382190.19 | 413015.84 | 10432804.63 | 220871.90 | 8729674.19 | 233852.73 | 8141620.28 | - | 5937081.19 | 200097.33 | 8618700.63 | 295309.87 | 2924570.21 | 216620.43 | 5459495.84 | - | 4777440.98 | |
| Pos_Histamine_111.07965_112.0868_8.272_ExRate1 | - | - | - | 796.46 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_L-(+)-Citrulline_175.09569_176.1027_8.839_ExRate0 | 18019899.26 | 1124540826.33 | 97599631.27 | 1344581348.00 | 114002475.76 | 1059537470.57 | 159278833.63 | 1386160675.33 | 87393374.17 | 1365947910.33 | 75733148.69 | 1029034478.93 | 262792125.13 | 1780006073.33 | 192252717.27 | 1532003029.00 | 246698205.83 | 1774375325.33 | 125146936.07 | 2670204189.67 | 742876.59 | 271094.78 | 2275625.20 | 79497.64 | 7468513.17 | 278884.16 | 155313014.64 | 471867.55 | 3625760.81 | 2917898.99 | 3245348.01 | 41242456.28 | 811548532.93 | 133894172.57 | 2034775406.00 | 118784463.16 | 1235353271.00 | 75934483.61 | 1559659325.33 | 43296259.63 | 1382555981.67 | |
| Pos_L-Cysteine-S-sulfate_200.97656_201.9837_8.024_ExRate0 | - | 876349.19 | - | 8835156.45 | 206327.30 | 2519878.06 | - | 4708910.85 | 526948.66 | 1398447.74 | - | 2928373.72 | 148667.71 | 4615549.06 | 391208.72 | 2983139.83 | - | 2617541.11 | 141435.67 | 4889102.28 | - | 95834.44 | 2681433.18 | - | 7721117.79 | 53307.56 | 2744110.55 | - | 16150024.59 | 377118.42 | 13890165.62 | 172975.76 | 6807500.40 | 173794.63 | 11326621.22 | 528255.17 | 2835385.54 | - | 7118498.90 | - | 2356843.10 | |
| Pos_L-Cystine_240.02385_241.0309_9.93_ExRate0 | 365621.08 | 58477569.54 | 546086.84 | 37204854.20 | 457453.37 | 32728727.83 | 452637.61 | 40729972.30 | 1787884.31 | 58420258.41 | - | 37862461.84 | 501260.50 | 14214220.60 | 543234.73 | 33745798.75 | 1053290.65 | 14539729.10 | 846885.37 | 101510675.14 | 448976.64 | - | 72770472.46 | 469420.34 | 33077099.34 | - | 208663694.18 | 454878.99 | 77123012.31 | 522043.96 | 116593561.31 | 115669.23 | 83439488.61 | 766480.59 | 60884768.51 | 984352.82 | 22592938.70 | 970382.70 | 37033794.30 | 228517.85 | 44116051.58 | |
| Pos_Leucine_131.09463_132.1017_7.035_ExRate0 | 22527254.61 | 2199709337.67 | 26758892.59 | 1993380903.77 | 90359351.34 | 1312060508.00 | 32039146.22 | 2226843250.73 | 105062354.55 | 2255733915.67 | 29737811.43 | 1435473805.10 | 46362086.27 | 1394224198.53 | 116714091.30 | 1519026405.67 | 67181444.15 | 1329955427.43 | 47048028.01 | 3381234874.00 | 1088635.39 | 40837079.78 | 2454156157.00 | 30813442.35 | 2613202227.00 | 38318057.67 | 4374094922.50 | 21489318.66 | 3546962062.50 | 90743313.00 | 3124239462.50 | 47318200.95 | 2449413257.53 | 31615109.19 | 3425364416.00 | 139405671.60 | 1145286245.67 | 48356148.47 | 2185772306.00 | 25561000.86 | 1687151384.33 | |
| Pos_L-Glutamic acid_147.05316_148.0603_8.786_ExRate0 | 819457.69 | 14385626.64 | 684768.76 | 8499620.97 | 3601438.68 | 31807458.14 | 1668185.01 | 12628432.26 | 2805102.25 | 28029950.07 | 3218748.15 | 16629565.57 | 3045495.75 | 17738799.61 | 5330153.86 | 54509304.53 | 3659167.20 | - | 4236111.64 | 48240890.93 | 45505.03 | - | 1947210.41 | - | 3621706.62 | - | 5224180.77 | - | 5229064.03 | 182115.19 | 998687.34 | 1397048.89 | 8392052.99 | 1353542.22 | 9683353.91 | 4006982.65 | 42664633.52 | 899285.91 | 14325046.26 | 1806414.21 | 51709624.91 | |
| Pos_L-Glutamic acid_147.05316_148.0603_8.786_ExRate1 | - | - | - | 37983.50 | - | - | - | 179180.12 | - | - | - | - | - | 66834.32 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 274991.13 | - | - | |
| Pos_L-Glutamic acid_147.05316_148.0603_8.786_ExRate2 | - | - | 396513.65 | 4762535.97 | - | - | 1824896.30 | 13531507.65 | - | - | - | - | 1050249.66 | 19175090.74 | - | - | 1798786.51 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 366279.09 | 5702373.74 | - | - | 583120.42 | 13627532.54 | - | - | |
| Pos_L-Glutamic acid_147.05316_148.0603_8.786_ExRate3 | - | - | 51081.67 | 453921.50 | - | - | 87456.90 | 366189.59 | - | - | - | - | 50188.30 | 566339.09 | - | - | 51648.93 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 47915.94 | 538974.17 | - | - | 29046.21 | 495284.43 | - | - | |
| Pos_L-Glutamic acid_147.05316_148.0603_8.786_ExRate4 | - | - | 1766731.98 | 16206270.66 | - | - | 2825615.19 | 8428335.89 | - | - | - | - | 2721080.38 | 21217171.34 | - | - | 1908449.29 | - | - | - | - | - | - | - | 113631.47 | - | - | - | - | - | - | - | - | 2062156.13 | 18137511.42 | - | - | 1044598.04 | 9096616.28 | - | - | |
| Pos_L-Glutamic acid_147.05316_148.0603_8.786_ExRate5 | - | - | - | 174982.10 | - | - | - | 67107.49 | - | - | - | - | - | 204897.25 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 29077.82 | 158595.37 | - | - | - | 84680.31 | - | - | |
| Pos_L-Histidine_155.06948_156.0766_9.565_ExRate0 | 1698448.00 | 205764741.87 | 2166133.96 | 234304012.23 | 2633218.21 | 139987119.40 | 1958990.62 | 258277804.03 | 7763563.03 | 233427122.70 | 862750.38 | 166650533.57 | 2071033.06 | 140316207.27 | 4564222.55 | 181408304.80 | 5505095.59 | 139425292.73 | 2390798.31 | 318103556.63 | 2756259.99 | 1703764.51 | 264714652.00 | 1622152.50 | 225204581.00 | 412574.26 | 469535899.55 | 982452.94 | 310989582.45 | 3529650.97 | 214805565.40 | 1350491.31 | 195968997.43 | 1019017.14 | 391227671.93 | 6891380.72 | 158913010.57 | 4227832.73 | 225545498.30 | 897270.97 | 182416690.40 | |
| Pos_L-Isoleucine_131.09463_132.1017_7.219_ExRate0 | 37277223.92 | 792749908.47 | 13105070.14 | 700048639.83 | 22100484.94 | 429996028.13 | 14892387.23 | 801474088.13 | 35818457.22 | 820161737.03 | 46301413.62 | 494297263.50 | 19135245.77 | 465011043.67 | 38798871.17 | 468960173.07 | 35989447.27 | 431849192.53 | 20772800.54 | 1449754864.70 | 19003513.75 | 21186457.89 | 1008341259.60 | 13323334.68 | 1118984299.05 | 20812386.20 | 1951014309.00 | 17666067.06 | 1404797637.00 | 51490133.39 | 1169138494.45 | 28722818.27 | 1047232669.87 | 18316911.83 | 1422790508.53 | 40936675.88 | 381094697.03 | 21586242.95 | 758404087.77 | 35968162.21 | 729809413.47 | |
| Pos_L-(-)-Methionine_149.05105_150.0581_7.447_ExRate0 | 1960601.81 | 150897436.17 | 1426464.88 | 178902105.06 | 4199373.16 | 93687465.59 | 1743437.18 | 209575032.96 | 5570856.70 | 148514904.10 | 1807158.68 | 107872393.02 | 2311472.86 | 104957137.44 | 5986324.63 | 110768529.10 | 3885308.18 | 92003171.56 | 2535761.19 | 331373448.35 | 889298.12 | 2286890.04 | 208107344.10 | 1362512.48 | 257291524.16 | 1484282.06 | 427636132.10 | 1307113.67 | 357262749.50 | 5797709.75 | 286721316.55 | 2919687.02 | 239319270.78 | 1402809.10 | 368724226.37 | 7399255.62 | 82250623.39 | 2695496.51 | 172621276.83 | 1047771.02 | 138243956.76 | |
| Pos_L-(-)-Methionine_149.05105_150.0581_7.447_ExRate1 | - | - | - | - | - | - | - | - | - | 77136.52 | - | - | - | - | - | - | - | - | - | - | - | - | 440857.58 | - | - | - | - | - | - | - | - | - | 1054319.73 | - | - | - | - | - | - | - | - | |
| Pos_L-(-)-Methionine_149.05105_150.0581_7.447_ExRate2 | - | - | - | - | - | - | - | 48559.70 | - | - | - | - | - | - | - | - | - | - | - | 155161.95 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 318894.65 | - | - | - | - | - | - | |
| Pos_L-Methionine sulfoxide_165.04596_166.0531_8.668_ExRate0 | - | 34002007.78 | - | 5604053.49 | - | 3911479.95 | - | 11103782.89 | 42120.56 | 41694336.74 | - | 13754025.77 | 66891.57 | 1913990.75 | 84064.14 | 6417401.95 | 85447.93 | 2581191.57 | - | 78059536.40 | - | 161868.49 | 25476498.89 | 133784.10 | 19818718.62 | - | 176313292.94 | 100754.16 | 40754281.70 | 349984.69 | 37641677.26 | 46630.65 | 33552487.57 | 47421.18 | 26193025.87 | 52429.77 | 1488387.16 | 59521.77 | 8308093.58 | - | 18866268.29 | |
| Pos_L-Methionine sulfoxide_165.04596_166.0531_8.668_ExRate1 | - | - | - | - | - | 4046.63 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 28061.79 | - | - | - | - | - | - | |
| Pos_L-Methionine sulfoxide_165.04596_166.0531_8.668_ExRate2 | - | - | - | - | - | 1284.93 | - | - | - | 2191.79 | - | - | - | - | - | 2078.79 | - | - | - | 3664.32 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 1666.77 | - | - | - | 2383.87 | |
| Pos_L(+)-Ornithine_132.08988_133.097_9.604_ExRate0 | 2860037.75 | 771876209.73 | 6236086.31 | 968061702.23 | 6688995.51 | 766709605.60 | 33763055.61 | 587520291.77 | 31268522.66 | 904488557.23 | 2088707.57 | 534842823.13 | 13559069.54 | 1353612946.33 | 22291804.63 | 1129351361.30 | 67953129.39 | 1092216001.67 | 27357203.23 | 947503384.43 | 3131079.36 | 125904.42 | 2069434.49 | 74809.01 | 4474080.16 | 99187.95 | 111658749.28 | 48410.58 | 2075364.66 | 445041.85 | 1980800.06 | 2133000.19 | 464188648.57 | 3660603.29 | 749863009.17 | 11240735.73 | 736516988.73 | 22700389.83 | 1051013707.07 | 5549641.02 | 1025633332.47 | |
| Pos_L(+)-Ornithine_132.08988_133.097_9.604_ExRate2 | - | 470382.70 | - | 491263.28 | - | 398188.79 | 40662.71 | 407364.76 | - | 565363.40 | - | 270720.55 | - | 946855.88 | - | 789429.37 | 50901.21 | 815572.88 | - | 595960.40 | - | - | - | - | - | - | - | - | - | - | - | - | 249573.59 | - | 421675.44 | - | 395176.54 | - | 694448.46 | - | 794821.70 | |
| Pos_L-Phenylalanine_165.07898_166.086_6.896_ExRate0 | 9604917.49 | 760610634.27 | 9747259.26 | 664569487.60 | 21311423.07 | 412884088.77 | 11860976.51 | 780678454.47 | 32751609.95 | 816801589.13 | 10451367.99 | 505618753.57 | 15715215.58 | 463813688.77 | 31773471.86 | 512906877.17 | 24307991.96 | 418702127.23 | 15370975.35 | 1447215140.40 | 2414192.61 | 14316816.15 | 840940224.25 | 11701756.54 | 865579472.70 | 10962637.22 | 1610113622.90 | 9135733.10 | 1258835535.65 | 30591028.16 | 1062803586.70 | 16492538.11 | 994948848.90 | 10146657.62 | 1125900865.03 | 39043376.72 | 362514215.83 | 17753064.70 | 774499625.60 | 7851357.33 | 668207479.87 | |
| Pos_L-Phenylalanine_165.07898_166.086_6.896_ExRate3 | - | 234407.97 | 244099.39 | - | - | - | 298812.20 | - | - | - | - | - | - | 113707.55 | 257234.29 | - | - | - | - | - | 400099.10 | - | - | 566175.55 | - | - | - | - | - | - | - | - | - | - | 356789.30 | 245172.29 | - | 298307.45 | - | - | - | |
| Pos_L-Phenylalanine_165.07898_166.086_6.896_ExRate8 | - | - | - | - | - | - | - | - | 57897.16 | - | 139280.59 | - | - | - | - | - | - | - | 38777.62 | - | 34209.89 | 43426.83 | - | - | - | - | - | - | - | - | - | 117805.66 | - | - | 51160.21 | 38182.66 | 35530.83 | - | - | 78528.37 | - | |
| Pos_L(-)-Pipecolinic acid_129.07898_130.0862_9.556_ExRate0 | 594840.88 | 96153156.52 | 1138900.72 | 96082803.74 | 1796842.41 | 54322154.54 | 1121554.57 | 58566379.43 | 3623758.33 | 96461137.03 | 527846.38 | 61554243.15 | 1057077.21 | 65206493.37 | 2853562.84 | 58865712.56 | 2996824.58 | 52783443.26 | 1471730.35 | 111489355.86 | 388424.98 | 571510.12 | 62905312.70 | 1072717.97 | 44058631.84 | 294741.66 | 166795447.34 | 766220.97 | 130755639.70 | 2336835.42 | 119555830.74 | 911685.13 | 99491346.55 | 783628.31 | 98436411.68 | 3052380.70 | 50260095.26 | 1828800.49 | 97876729.32 | 525333.33 | 90696859.50 | |
| Pos_L(-)-Pipecolinic acid_129.07898_130.0862_9.556_ExRate1 | - | 348774.17 | - | 211450.11 | - | - | - | 260372.87 | - | - | - | - | - | - | 25470.87 | - | - | - | 5876.56 | - | - | - | - | - | 65884.13 | - | - | - | - | 20042.15 | - | - | - | - | 26027.04 | 18450.99 | - | - | - | - | - | |
| Pos_L(-)-Pipecolinic acid_129.07898_130.0862_9.556_ExRate2 | - | - | 17.84 | 403400.85 | 6.12 | - | - | 445290.61 | - | - | - | - | - | 313996.78 | 3.05 | - | - | 276384.30 | - | 25.65 | 4.64 | - | 64.00 | - | 4.38 | - | 13.81 | - | - | - | 7.69 | - | - | 5.19 | 355660.34 | - | - | - | 669897.92 | - | - | |
| Pos_L(-)-Pipecolinic acid_129.07898_130.0862_9.556_ExRate5 | - | - | - | - | - | - | - | - | - | - | - | - | - | 108630.29 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 19475.52 | - | - | - | - | - | - | |
| Pos_L-Tyrosine_181.07389_182.081_7.707_ExRate0 | 152465.53 | 37938782.59 | 311957.33 | 34108535.90 | 721166.87 | 23256283.15 | 381497.17 | 45211872.73 | 983922.97 | 40626055.62 | 209662.20 | 24776007.14 | 534142.55 | 24968660.89 | 1046818.52 | 25891321.91 | 821409.48 | 22682668.20 | 479373.74 | 77834284.39 | - | 394829.24 | 47453867.99 | 367730.05 | 47984049.65 | 212174.77 | 94474850.25 | 199250.47 | 66331580.52 | 1000083.10 | 55803168.62 | 439568.27 | 44914942.82 | 310562.09 | 69238603.00 | 1333478.06 | 20616643.19 | 573781.49 | 39147465.55 | 234697.55 | 33401075.51 | |
| Pos_L-Tyrosine_181.07389_182.081_7.707_ExRate2 | - | - | - | - | - | 9.73 | - | - | 12.28 | 20.20 | - | - | - | - | - | - | 10.93 | - | - | - | - | - | - | 8.72 | - | - | - | - | - | - | - | - | 14.26 | - | - | - | - | - | - | - | - | |
| Pos_L-Tyrosine_181.07389_182.081_7.707_ExRate3 | - | - | - | - | - | 28947.54 | - | - | 36531.87 | 60108.38 | - | - | - | - | - | - | 32533.77 | - | - | - | - | - | - | 25951.92 | - | - | - | - | - | - | - | - | 42416.58 | - | - | - | - | - | - | - | - | |
| Pos_Maltitol_344.12599_367.1209_8.738_ExRate15 | - | - | - | 27.06 | - | 14.69 | - | 4.85 | - | 10.98 | - | 3.76 | - | 24.47 | - | 9.11 | - | 26.41 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 10.67 | - | 15.83 | - | 8.34 | - | 9.19 | - | 15.59 | |
| Pos_Maltitol_344.12599_367.1209_8.738_ExRate17 | - | 154278.66 | - | 502234.30 | - | - | - | - | - | 706791.83 | - | 103446.84 | - | - | - | 36196.76 | - | - | - | 165397.80 | - | - | - | - | - | - | 66622.55 | - | - | - | - | - | 666583.24 | - | 391431.28 | - | - | - | 514120.84 | - | 676679.40 | |
| Pos_Maltitol_344.12599_367.1209_8.738_ExRate18 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 39417.34 | |
| Pos_N3,N4-Dimethyl-L-arginine_202.14298_203.1501_8.98_ExRate... | - | 53330641.45 | - | 58327009.06 | - | 32123336.58 | 277970.16 | 73065966.94 | 1567467.05 | 66484120.09 | - | 34127017.03 | - | 37019272.32 | 298556.34 | 41703715.09 | 466283.15 | 33717857.94 | - | 150136641.00 | - | - | 28113254.82 | - | 50321173.58 | - | 147983732.03 | - | 92788283.55 | 132592.33 | 58494189.14 | - | 77565936.21 | - | 133851837.08 | 307134.68 | 28302011.32 | 269356.72 | 63826026.46 | - | 57114257.34 | |
| Pos_N3,N4-Dimethyl-L-arginine_202.14298_203.1501_8.98_ExRate... | - | - | - | - | - | - | - | 53703.29 | - | - | - | - | - | - | - | - | - | - | - | 97241.88 | - | - | - | - | 49056.59 | - | 110919.36 | - | - | - | 41043.86 | - | - | - | 120677.98 | - | - | - | - | - | 54938.36 | |
| Pos_N-Acetylornithine_174.10044_175.1076_8.4_ExRate0 | 215008.95 | 1176426.26 | 28517.67 | 736098.33 | 641064.69 | 2720564.74 | 773713.13 | 1673439.14 | 717070.00 | 3383003.24 | 382323.84 | 577997.36 | 79461.82 | 460299.35 | 825910.59 | 3890997.57 | 731651.98 | 1034622.71 | 2134813.34 | 6951481.65 | - | - | 191741.43 | - | 469316.52 | - | 1839525.42 | - | 653727.50 | 54835.02 | 340623.46 | 175613.36 | 830362.41 | - | 1662117.68 | 261113.79 | 3164998.76 | 168441.64 | 1010408.61 | 845141.78 | 2094384.84 | |
| Pos_N-Acetylornithine_174.10044_175.1076_8.4_ExRate1 | - | - | 103.19 | 96409.95 | - | - | 50581.14 | 81788.97 | - | - | - | - | - | 43541.90 | - | - | 23005.10 | 1486.89 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 73.34 | 80774.34 | - | 5209.68 | - | 6721.09 | - | - | |
| Pos_N-Acetylornithine_174.10044_175.1076_8.4_ExRate2 | - | - | 636285.38 | 3593532.60 | - | - | 2473184.32 | 2695063.88 | - | - | - | - | 974098.17 | 2831016.43 | - | - | 1515632.89 | 774481.24 | - | - | - | - | - | - | 124494.76 | - | - | - | - | - | - | - | - | 364089.60 | 7133736.13 | - | - | 427965.86 | 1294708.13 | - | - | |
| Pos_N-Acetylornithine_174.10044_175.1076_8.4_ExRate3 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 4213.04 | - | - | - | |
| Pos_N-Acetylornithine_174.10044_175.1076_8.4_ExRate4 | - | - | - | - | - | - | - | 94294.72 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_N-Acetylornithine_174.10044_175.1076_8.4_ExRate6 | - | - | - | 59196.42 | - | - | - | 61800.22 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 279283.01 | - | - | - | - | - | - | |
| Pos_Nicotinamide_122.04801_123.0552_1.732_ExRate0 | - | 17440000.29 | 557447.54 | 26402491.65 | 477373.37 | 12448683.99 | 739857.88 | 11720624.42 | 2442761.54 | 24333442.51 | 141373.97 | 10325291.27 | 760542.57 | 9126115.90 | 1154880.81 | 12737906.25 | 1163644.75 | 8949391.96 | 778601.41 | 28617988.15 | - | - | 3563737.30 | - | 2209149.70 | - | 7744180.21 | - | 4828353.75 | - | 5272644.86 | - | 11248260.06 | 218689.33 | 21118360.28 | 275206.45 | 9838076.05 | 322574.13 | 20114494.27 | - | 18402844.31 | |
| Pos_Nicotinamide adenine dinucleotide (NAD+)_663.10912_664.1... | - | 373839.55 | - | - | 189746.97 | 610096.09 | 287.96 | 257.39 | 680590.18 | 354263.08 | 87035.84 | 284804.82 | - | - | 446275.68 | 405210.38 | 385.93 | 192.93 | 327816.70 | 145594.95 | - | - | - | - | 49248.91 | - | - | - | 53961.61 | - | - | 30358.65 | 117298.85 | - | - | 79537.60 | 475436.03 | - | - | 40533.02 | 409191.20 | |
| Pos_Nicotinamide adenine dinucleotide (NAD+)_663.10912_664.1... | - | - | 152.41 | 104.99 | - | - | 31390.67 | 85742.26 | - | - | - | - | 149.72 | 293.47 | - | - | 132310.61 | 38795.98 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_Nicotinamide adenine dinucleotide (NAD+)_663.10912_664.1... | - | - | - | 242.11 | - | - | - | - | - | - | - | - | 95.81 | - | - | - | 7105.95 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_Nicotinamide adenine dinucleotide (NAD+)_663.10912_664.1... | - | - | 60252.94 | 95207.98 | - | - | 72484.23 | 80269.96 | - | - | - | - | 62472.68 | 116017.12 | - | - | 123820.86 | 42421.51 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_Nicotinamide adenine dinucleotide (NAD+)_663.10912_664.1... | - | - | - | 59170.53 | - | - | - | - | - | - | - | - | 21742.27 | - | - | - | 10915.04 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_Nicotinamide adenine dinucleotide (NAD+)_663.10912_664.1... | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 32360.93 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_N-Methylaniline_[M+H]+_AFBPFSWMIHJQDM-UHFFFAOYSA-N_107.0... | 2377656.06 | 3837375.83 | 2892389.24 | 4001991.27 | 3061834.67 | 2341767.45 | 2434366.59 | 3366673.11 | 3673436.22 | 3225555.74 | 2821914.51 | 3648727.85 | 3362206.27 | 2905314.31 | 2838349.77 | 3064234.63 | 3344263.94 | 2377512.63 | 2350291.45 | 1792700.60 | 1309773.93 | 2384188.43 | 3212395.57 | 2690502.12 | 2070767.54 | 2295528.53 | 3268746.85 | 2889027.21 | 3952338.37 | 2213365.89 | 3844086.81 | 2884587.67 | 3197023.91 | 2886081.09 | 2492800.91 | 2331069.45 | 2567182.32 | 2736908.79 | 4060012.52 | 1880121.78 | 3174866.94 | |
| Pos_N-Methylaniline_[M+H]+_AFBPFSWMIHJQDM-UHFFFAOYSA-N_107.0... | - | 205373.51 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 71842.63 | - | - | - | - | - | - | - | - | - | 42599.95 | - | - | - | - | |
| Pos_PEG n5_238.14164_239.1488_1.733_ExRate0 | 9411315.52 | 26983815.56 | 7522271.08 | 11386818.14 | 7626088.93 | 7117243.81 | 22811041.60 | 10479422.99 | 11348332.75 | 15595618.71 | 7882113.98 | 11115553.73 | 9176960.24 | 13860533.04 | 8353970.51 | 8632148.42 | 9891105.83 | 6991270.77 | 12180300.97 | 10740084.58 | 3226410.98 | 11352885.81 | 14796230.82 | 16631958.25 | 10803899.22 | 9343573.88 | 17667169.44 | 9156287.00 | 17403205.82 | 7379835.27 | 15158756.49 | 8878771.56 | 10942041.44 | 6739606.08 | 15774436.51 | 6531758.91 | 7724157.10 | 11221511.55 | 15994262.62 | 9717946.82 | 15724351.25 | |
| Pos_Prolinamide_114.07931_115.0865_7.238_ExRate0 | - | 112227682.69 | 2983998.79 | 168153590.01 | 4439530.63 | 82034248.74 | 5188865.19 | 79433821.59 | 3803342.57 | 207467990.82 | 50924004.27 | 62730097.91 | 50.59 | 145929912.99 | 8490396.52 | 105848595.63 | 24027956.15 | 147049835.09 | 3438009.72 | 192855935.42 | 122.34 | - | 34172742.05 | 24.32 | 29401817.09 | 110690696.60 | 80044464.43 | 44108481.93 | 57772145.01 | - | 40729975.10 | 247793978.80 | 88170657.71 | 5928041.48 | 209461782.14 | 9560860.55 | 80079142.94 | 72.44 | 237165362.96 | 139.06 | 154901864.90 | |
| Pos_Prolinamide_114.07931_115.0865_7.238_ExRate2 | - | 83639.89 | - | 157909.41 | - | - | - | - | - | 188665.73 | - | 49657.64 | - | 147117.46 | - | 48173.64 | - | 113684.51 | - | 218699.09 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 210453.79 | - | 70773.78 | - | 130769.87 | - | 156568.70 | |
| Pos_Pyridoxamine_168.08988_169.097_8.241_ExRate0 | 1762704.80 | 364547018.43 | 2979790.30 | 344470499.70 | 7271650.20 | 243978159.70 | 4021522.80 | 398495608.07 | 10648564.07 | 395154375.10 | 2218075.35 | 270228468.10 | 5431234.83 | 255140587.97 | 11999352.12 | 282521279.10 | 9075007.01 | 234494300.23 | 5653919.29 | 704949145.70 | 1265596.17 | 3767704.17 | 409479409.40 | 3591075.46 | 389017741.60 | 2818335.36 | 819007137.80 | 2346125.54 | 612099498.90 | 11479229.38 | 544733737.60 | 4299608.39 | 445396509.13 | 3124130.14 | 611379247.63 | 13349536.28 | 203569068.00 | 5332995.16 | 388268024.10 | 2476106.64 | 316437539.93 | |
| Pos_Pyridoxamine_168.08988_169.097_8.241_ExRate1 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 37015.24 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 50073.15 | - | - | - | - | - | - | - | - | - | |
| Pos_Pyridoxamine_168.08988_169.097_8.241_ExRate2 | - | 65573.99 | - | 186772.20 | - | 35.16 | - | 263650.47 | - | 167539.66 | - | 74630.39 | - | 60895.18 | - | 71765.45 | - | 87280.56 | - | 702148.39 | - | - | 91286.22 | - | 264665.04 | - | 138782.99 | - | 95160.94 | - | 115841.81 | - | 519960.49 | - | 341506.41 | - | - | - | 178999.91 | - | 120574.69 | |
| Pos_Pyridoxamine_168.08988_169.097_8.241_ExRate3 | - | 29660.59 | - | 89370.61 | - | 177556.86 | - | 150726.76 | - | 217442.93 | - | - | - | 1114750.54 | - | - | - | 115726.59 | - | 142395.93 | - | - | 1378683.71 | - | - | - | 198206.68 | - | - | - | - | - | 906228.10 | - | 206357.59 | - | - | - | 171576.49 | - | 310535.37 | |
| Pos_Triethanolamine_149.10519_150.1124_6.591_ExRate0 | 2556572.30 | 1399074.68 | 1533739.11 | 11116946.39 | 1496317.35 | 2004401.51 | 3085951.33 | 2342909.78 | 2981690.05 | 3584203.77 | 1937843.88 | 2478121.07 | 1647334.66 | 2662260.91 | 2677999.87 | 2398312.14 | 2204083.45 | 1773749.56 | 2616452.70 | 3274893.27 | 923329.71 | 8729747.21 | 2584708.90 | 1743469.79 | 2771466.45 | 1167247.55 | 2521805.52 | 2608200.31 | 2055072.41 | 2855244.31 | 4534596.48 | 3080049.25 | 2046693.17 | 1381780.06 | 2220851.66 | 2107188.13 | 2219707.94 | 2113689.70 | 1755977.20 | 2247064.67 | 2512868.78 | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate0 | - | 280541.80 | - | - | 218075.09 | 911609.68 | - | 0.05 | 348205.58 | 982813.32 | 145341.14 | 347329.74 | - | - | 585198.00 | 1756414.79 | - | 199521.62 | 319584.31 | 1102113.97 | - | - | - | - | - | - | - | - | - | - | - | 54278.00 | 71159.41 | - | - | 285843.39 | 1442809.94 | - | - | 93412.48 | 1079429.67 | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate1 | - | - | - | - | - | - | - | 5.90 | - | - | - | - | - | - | - | - | - | 7172.92 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate1... | - | - | - | 99697.98 | - | - | - | - | - | - | - | - | 154545.09 | 133029.83 | - | - | 53189.03 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 52240.94 | 111449.70 | - | - | - | - | - | - | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate1... | - | - | - | - | - | - | - | - | - | - | - | - | 43538.98 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 58099.05 | - | - | - | - | - | - | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate2 | - | - | - | 53.70 | - | - | - | 219485.25 | - | - | - | - | - | 173.44 | - | - | 74.08 | 429896.27 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 56.23 | - | - | - | 139.31 | - | - | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate3 | - | - | - | - | - | - | - | 29806.64 | - | - | - | - | - | - | - | - | - | 33620.38 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate4 | - | - | - | 17626.32 | - | - | 30.72 | 372328.22 | - | - | - | - | 34.43 | 187192.81 | - | - | 21262.93 | 341507.61 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 22614.75 | - | - | - | 159214.33 | - | - | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate5 | - | - | - | - | - | - | - | 67552.75 | - | - | - | - | - | 27973.35 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 10101.49 | - | - | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate6 | - | - | - | 148566.36 | - | - | 32485.34 | 318424.98 | - | - | - | - | 29847.17 | 357352.90 | - | - | 100386.06 | 105281.75 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 25.70 | 92160.87 | - | - | - | 181898.32 | - | - | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate7 | - | - | - | - | - | - | - | 24282.95 | - | - | - | - | - | 72627.50 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 28417.35 | - | - | - | - | - | - | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate8 | - | - | - | 224711.04 | - | - | - | 56351.29 | - | - | - | - | 151239.91 | 371191.16 | - | - | 148468.39 | 37108.45 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | 46556.44 | 246871.04 | - | - | - | 133075.06 | - | - | |
| Pos_UDP-N-acetylglucosamine_607.08157_608.0884_9.921_ExRate9 | - | - | - | 42888.36 | - | - | - | - | - | - | - | - | - | 29547.10 | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | - | |
| Pos_Valine_117.07898_118.086_7.78_ExRate0 | 88578022.19 | 925706918.13 | 202880605.60 | 869123443.43 | - | 576458145.47 | 155616839.13 | 898061332.63 | 155349338.28 | 987709422.07 | - | 611664813.23 | 176391499.27 | 599501897.70 | 219796526.67 | 690245281.17 | 228290823.70 | 551036850.07 | 156850627.60 | 1479039944.17 | 189137486.30 | 202430100.80 | 1000392607.65 | 149997725.40 | 871422604.65 | 190332557.50 | 1794758968.50 | 136267515.10 | 1327739285.50 | 222484914.40 | 1211554540.95 | 186572604.35 | 983100340.53 | 175473546.17 | 1587102305.53 | 201605437.60 | 515309106.40 | 151128761.57 | 908135911.43 | 177523564.50 | 785288797.57 |
Factors:
| F1 | Strain:2243 | AcetateGroup:0 | TimePoint:TP3 | Time:23 |
| F2 | Strain:2243 | AcetateGroup:0 | TimePoint:TP5 | Time:39 |
| F3 | Strain:2243 | AcetateGroup:10L | TimePoint:TP3 | Time:23 |
| F4 | Strain:2243 | AcetateGroup:10L | TimePoint:TP5 | Time:39 |
| F5 | Strain:2243 | AcetateGroup:10 | TimePoint:TP3 | Time:23 |
| F6 | Strain:2243 | AcetateGroup:10 | TimePoint:TP5 | Time:39 |
| F7 | Strain:2243 | AcetateGroup:1L | TimePoint:TP3 | Time:23 |
| F8 | Strain:2243 | AcetateGroup:1L | TimePoint:TP5 | Time:39 |
| F9 | Strain:2243 | AcetateGroup:1 | TimePoint:TP3 | Time:23 |
| F10 | Strain:2243 | AcetateGroup:1 | TimePoint:TP5 | Time:39 |
| F11 | Strain:AB8n2 | AcetateGroup:0 | TimePoint:TP3 | Time:23 |
| F12 | Strain:AB8n2 | AcetateGroup:0 | TimePoint:TP5 | Time:39 |
| F13 | Strain:AB8n2 | AcetateGroup:10L | TimePoint:TP3 | Time:23 |
| F14 | Strain:AB8n2 | AcetateGroup:10L | TimePoint:TP5 | Time:39 |
| F15 | Strain:AB8n2 | AcetateGroup:10 | TimePoint:TP3 | Time:23 |
| F16 | Strain:AB8n2 | AcetateGroup:10 | TimePoint:TP5 | Time:39 |
| F17 | Strain:AB8n2 | AcetateGroup:1L | TimePoint:TP3 | Time:23 |
| F18 | Strain:AB8n2 | AcetateGroup:1L | TimePoint:TP5 | Time:39 |
| F19 | Strain:AB8n2 | AcetateGroup:1 | TimePoint:TP3 | Time:23 |
| F20 | Strain:AB8n2 | AcetateGroup:1 | TimePoint:TP5 | Time:39 |
| F21 | Strain:- | AcetateGroup:- | TimePoint:- | Time:- |
| F22 | Strain:c | AcetateGroup:0 | TimePoint:TP3 | Time:23 |
| F23 | Strain:c | AcetateGroup:0 | TimePoint:TP5 | Time:39 |
| F24 | Strain:c | AcetateGroup:10L | TimePoint:TP3 | Time:23 |
| F25 | Strain:c | AcetateGroup:10L | TimePoint:TP5 | Time:39 |
| F26 | Strain:c | AcetateGroup:10 | TimePoint:TP3 | Time:23 |
| F27 | Strain:c | AcetateGroup:10 | TimePoint:TP5 | Time:39 |
| F28 | Strain:c | AcetateGroup:1L | TimePoint:TP3 | Time:23 |
| F29 | Strain:c | AcetateGroup:1L | TimePoint:TP5 | Time:39 |
| F30 | Strain:c | AcetateGroup:1 | TimePoint:TP3 | Time:23 |
| F31 | Strain:c | AcetateGroup:1 | TimePoint:TP5 | Time:39 |
| F32 | Strain:Valencia | AcetateGroup:0 | TimePoint:TP3 | Time:23 |
| F33 | Strain:Valencia | AcetateGroup:0 | TimePoint:TP5 | Time:39 |
| F34 | Strain:Valencia | AcetateGroup:10L | TimePoint:TP3 | Time:23 |
| F35 | Strain:Valencia | AcetateGroup:10L | TimePoint:TP5 | Time:39 |
| F36 | Strain:Valencia | AcetateGroup:10 | TimePoint:TP3 | Time:23 |
| F37 | Strain:Valencia | AcetateGroup:10 | TimePoint:TP5 | Time:39 |
| F38 | Strain:Valencia | AcetateGroup:1L | TimePoint:TP3 | Time:23 |
| F39 | Strain:Valencia | AcetateGroup:1L | TimePoint:TP5 | Time:39 |
| F40 | Strain:Valencia | AcetateGroup:1 | TimePoint:TP3 | Time:23 |
| F41 | Strain:Valencia | AcetateGroup:1 | TimePoint:TP5 | Time:39 |
