Data for Study1 Investigation of metabolomic blood biomarkers for detection of adenocarcinoma lung cancer (training set) (Study ST000385)

GC POSITIVE ION MODE (Analysis AN000620): Average values per metabolite and experimental factor (Units:peak area)

Metabolite structureAll dataF1F2F3F4F5F6F7F8F9F10F11F12F13F14F15F16F17
1,5-anhydroglucitol ME133506 7761.56 6453.50 6414.67 5416.62 7157.78 9202.29 6607.62 8457.86 14244.67 14858.50 14008.67 11272.62 16234.89 20225.00 12819.38 18508.14 6832.25
1-monoolein ME133505 497.56 449.33 308.13 455.15 222.89 225.29 297.77 416.36 1253.00 468.00 762.80 1203.00 590.44 455.86 680.00 923.50 519.85
1-monopalmitin ME133504 71.44 55.67 65.20 60.00 89.33 69.29 83.62 59.07 154.44 157.33 146.13 154.31 173.33 144.14 163.31 147.36 72.00
1-monostearin ME133503 84.11 78.67 89.00 83.08 68.78 96.43 138.77 90.64 133.11 132.00 129.67 136.08 158.11 146.71 161.31 150.00 72.55
2,3,5-trihydroxypyrazine NIST ME133502 43.00 47.67 42.27 37.92 31.89 38.43 35.08 42.07 59.89 65.67 55.33 56.92 58.78 69.00 53.15 63.14 38.60
2,3-dihydroxybutanoic acid NIST ME133501 82.78 68.33 72.47 94.31 87.44 69.00 84.00 58.50 112.11 123.33 111.60 192.38 152.56 105.57 152.15 112.50 63.15
2-deoxyerythritol ME133500 344.89 294.83 392.67 313.31 349.67 638.29 479.38 348.36 470.33 497.00 498.60 497.31 475.56 955.43 677.46 519.36 314.20
2-deoxytetronic acid NIST ME133499 514.11 724.50 715.60 908.38 495.22 717.43 819.62 650.79 882.56 1536.67 1221.40 1848.23 825.78 1352.14 1366.15 1474.79 713.70
2-hydroxybutanoic acid ME133498 6345.67 10855.83 8536.00 8479.77 6442.67 4984.86 9604.31 5560.79 13456.56 24575.67 17206.47 18680.85 9734.33 11861.86 18503.46 12738.36 7708.00
2-hydroxyglutaric acid ME133497 338.44 316.17 341.47 316.08 295.89 434.43 357.46 296.00 1155.67 1450.33 1145.00 1139.77 1247.44 1724.86 1387.77 1565.93 223.35
2-hydroxyhippuric acid ME133496 55.44 47.67 53.60 39.23 116.44 48.43 84.69 43.93 89.00 93.33 78.53 88.23 308.11 101.14 90.38 92.14 100.55
2-hydroxyvaleric acid ME133495 7742.56 563.33 706.13 714.23 630.44 528.71 603.85 502.36 14080.56 1138.17 1371.47 1322.31 927.22 1089.14 1210.77 1235.21 1231.35
2-ketoisocaproic acid ME133494 1773.67 2529.00 1893.80 1922.77 1568.89 1780.86 2031.85 1943.07 1978.89 3326.17 1861.53 2366.38 1557.89 2223.86 1890.85 2007.93 2105.85
3-aminoisobutyric acid ME133493 400.44 396.33 333.80 1977.69 448.00 329.43 333.92 376.57 794.33 1041.67 821.53 3661.77 722.78 961.43 690.54 636.21 646.80
3-hydroxybutanoic acid ME133492 1786.11 7660.67 5224.60 6794.23 2064.11 3660.14 5711.46 3592.21 3370.56 15495.83 9284.93 14606.62 3832.11 7777.29 10959.23 7086.21 4867.70
3-phosphoglycerate ME133491 79.89 128.83 94.67 97.31 58.00 145.71 107.69 203.93 81.56 190.67 79.73 140.31 83.67 279.86 162.46 306.43 95.25
4-hydroxyproline ME133490 2162.67 1602.67 1959.40 1542.00 1877.33 1800.00 1979.46 1788.36 4509.44 3780.33 3821.87 3643.77 4135.33 3779.14 3417.31 4013.57 1218.85
5-hydroxynorvaline NIST ME133489 79.89 99.33 124.13 87.15 189.00 217.29 127.23 102.71 205.67 194.83 242.47 229.00 546.00 504.71 261.77 237.21 193.15
5-methoxytryptamine ME133488 168.33 125.83 159.80 217.62 92.67 72.86 94.77 212.36 271.56 336.50 204.13 308.08 191.00 255.29 320.23 313.21 276.75
acetophenone NIST ME133487 611.11 670.67 753.27 654.62 639.33 740.29 696.77 682.86 1147.11 991.17 1067.53 1060.54 1267.78 1392.86 1220.77 1054.71 433.55
aconitic acid ME133486 109.89 87.50 100.00 124.23 87.67 125.57 130.77 107.07 171.67 119.83 139.20 180.38 158.11 176.00 188.23 184.07 112.50
adenosine-5-phosphate ME133485 208.00 178.67 278.27 278.23 224.33 89.00 93.62 239.79 101.78 102.50 100.73 100.15 206.33 158.57 94.38 79.07 144.60
adipic acid ME133484 270.22 244.17 235.40 258.62 319.78 399.86 242.15 228.57 667.44 760.17 736.20 626.31 701.89 830.43 793.54 1085.71 295.65
alanine ME133483 64882.89 65783.17 71413.47 55504.92 69009.56 58080.86 70379.15 76780.57 183321.67 176308.33 172320.00 154131.69 174118.22 141623.29 160135.08 174551.36 73514.25
alpha ketoglutaric acid ME133482 189.56 156.83 172.47 164.46 137.00 92.29 146.54 139.50 94.89 52.83 79.00 116.38 76.44 80.14 74.92 77.29 241.10
aminomalonic acid ME133481 1371.78 608.00 893.13 788.31 1155.89 943.00 1042.08 945.71 1950.56 1157.83 1538.47 1234.15 2096.11 1542.29 1591.77 1493.21 1068.35
arabinose ME133480 228.00 176.50 214.07 199.69 173.78 218.57 201.38 182.36 281.22 393.17 404.47 352.23 328.22 449.43 345.23 346.64 153.70
arabitol ME133479 81.78 58.00 77.47 103.31 75.11 123.43 92.54 64.71 151.44 158.33 132.53 208.46 133.00 185.29 125.69 149.00 82.45
arachidic acid ME133478 1805.44 1727.50 1637.67 1960.69 1789.78 1776.43 2148.77 1594.71 1076.56 1132.83 1092.40 1110.08 1068.67 1036.86 987.69 875.71 2006.50
arachidonic acid ME133477 2177.33 1988.50 2415.20 1862.54 2372.56 2399.14 3557.62 2769.00 7651.44 7322.83 6936.47 7137.85 9189.11 7400.71 10294.77 8420.21 552.20
asparagine ME133476 1289.67 1409.33 1634.07 1376.23 2021.56 2122.43 1750.38 1608.57 5347.33 4804.00 5714.80 4965.00 5639.00 5389.57 4869.38 4217.14 1610.00
aspartic acid ME133475 465.44 498.83 484.73 488.92 355.89 334.43 423.31 601.43 4930.11 4070.33 6825.20 3639.62 1597.11 1631.71 1504.08 1837.57 467.60
azelaic acid ME133474 53.56 51.33 48.07 53.31 50.00 42.14 47.54 46.57 577.00 430.83 687.20 438.92 468.00 412.86 519.62 1008.07 50.40
behenic acid ME133473 83.89 130.67 100.80 79.31 140.22 128.43 103.23 99.50 189.44 175.17 178.07 211.00 226.00 223.14 172.77 180.86 115.95
benzoic acid ME133472 1256.33 1191.00 1341.60 1320.08 1349.44 1523.86 1355.85 1330.64 2282.11 2161.50 2845.27 2595.38 2404.33 2778.14 2571.69 2526.86 1625.80
benzylalcohol ME133471 27712.44 29980.33 27738.07 27899.85 27640.67 29633.00 27243.62 28597.14 51516.89 53802.50 45924.67 53525.00 54819.89 55183.86 49726.31 52185.64 28843.05
beta alanine ME133470 80.44 112.00 83.00 120.31 77.33 98.00 123.00 113.71 263.00 330.83 238.47 355.31 160.67 240.14 262.62 248.64 98.60
beta-glycerolphosphate ME133469 84.78 71.33 80.13 92.92 74.00 98.00 90.54 75.57 170.00 155.83 154.60 192.23 175.11 218.29 175.00 178.29 74.30
beta-mannosylglycerate ME133468 2249.56 1774.50 2067.60 1414.23 1718.89 2461.14 1581.38 2405.71 3765.78 3160.83 2773.73 2579.38 3319.44 3859.57 2614.62 4042.64 2245.20
capric acid ME133467 708.44 743.17 785.27 733.08 757.11 785.57 717.46 670.43 1423.78 1801.33 1628.93 1525.77 1650.11 1421.71 1562.08 1469.00 904.65
caprylic acid ME133466 770.56 837.50 840.67 746.46 941.22 997.86 897.85 907.14 1343.56 1320.67 1405.47 1374.54 1618.44 1640.14 1646.00 1542.43 480.55
cholesterol ME133465 50420.78 58676.50 49326.53 50471.85 56120.89 55175.29 51490.92 49663.93 77385.44 85707.67 76547.20 85179.92 110421.78 90059.00 86946.31 85998.64 57784.60
citric acid ME133464 10779.44 8270.83 9914.13 10785.46 8604.22 10520.71 13414.23 10623.14 11955.44 9234.00 9804.13 12672.69 8609.44 12222.86 12707.85 11534.71 10889.75
citrulline ME133463 341.78 353.17 327.93 367.38 512.44 476.71 439.38 385.86 910.67 787.17 658.80 881.92 1122.11 975.29 926.38 835.86 449.75
conduritol beta epoxide ME133462 376.33 290.00 364.87 354.08 314.44 386.71 647.46 272.21 685.78 604.17 1640.00 742.00 445.33 799.00 1149.77 490.86 376.50
creatinine ME133461 2047.22 2203.17 2467.47 3905.54 2397.33 2119.14 3123.69 2802.64 7255.22 5838.00 5577.13 12219.15 8043.89 7026.29 8703.38 7304.29 3027.60
cysteine ME133460 510.00 756.50 789.00 644.54 715.22 548.00 800.46 826.21 1254.33 1928.33 1422.33 1483.69 1819.33 1387.43 1470.38 1414.14 745.40
cysteine-glycine ME133459 171.11 150.50 206.07 188.77 165.89 129.57 165.92 141.86 317.11 293.83 271.47 289.62 341.67 294.29 268.00 264.43 188.70
cystine ME133458 2670.22 4102.17 3825.60 4223.46 3927.67 4078.00 5404.15 4904.43 8527.44 9340.83 8969.13 10733.15 9597.11 11529.71 12894.31 10809.00 4620.80
dihydro-3-coumaric acid ME133457 198.78 272.00 228.93 227.69 239.78 201.43 261.69 291.57 520.33 710.67 607.40 625.38 646.00 524.86 633.69 598.00 276.65
erythritol ME133456 414.33 641.83 810.33 472.46 317.89 406.86 415.15 402.21 695.44 1209.17 1369.60 850.08 595.44 810.00 720.77 764.50 550.00
erythrose ME133455 68.11 58.67 60.07 69.46 68.78 86.29 89.54 64.64 156.11 137.83 189.27 199.85 190.89 202.43 213.62 212.79 49.80
ethanolamine ME133454 1030.89 873.67 771.00 1177.15 561.00 538.71 590.85 765.93 1919.00 1995.17 1467.87 2101.85 829.89 888.71 1337.85 1318.93 2021.25
fructose ME133453 12610.78 22636.00 17239.33 16189.62 21048.67 24788.71 27469.15 25386.79 31531.00 57892.50 44850.67 51609.15 65439.33 64666.57 65753.62 71052.93 3969.65
fucose ME133452 298.33 313.17 300.93 310.38 314.56 355.00 305.08 337.86 594.67 613.00 643.40 696.77 585.78 682.71 643.00 678.50 323.90
fumaric acid ME133450 147.56 189.67 190.60 167.31 135.00 118.86 168.31 154.64 344.22 361.50 363.00 363.54 245.00 331.57 322.31 333.00 154.60
gamma-tocopherol ME133449 337.67 530.83 286.87 407.00 228.22 369.00 244.31 360.43 560.78 838.67 454.27 694.85 426.56 678.86 400.00 569.43 314.75
gluconic acid ME133448 105.78 87.00 132.60 182.23 128.56 119.71 190.00 144.64 214.56 200.50 216.87 401.69 202.56 228.86 243.92 261.07 131.80
glucose ME133447 47707.11 55063.67 54149.20 53258.92 54491.89 52678.86 59147.38 63021.14 76715.67 100235.67 83973.33 96504.62 86463.33 98555.29 102394.46 106194.93 65434.85
glucuronic acid ME133446 376.22 219.17 246.67 380.15 477.22 458.86 352.31 465.29 752.44 606.00 497.13 1006.23 1181.00 1218.71 711.46 1050.14 375.20
glutamic acid ME133445 4014.33 4394.67 3800.53 3773.69 2108.22 3409.86 2975.69 3612.57 11603.67 12398.83 13814.60 9693.00 4420.56 7681.14 6232.77 6637.36 3419.05
glutamine ME133444 22863.11 25879.33 23095.87 25857.77 40800.56 39746.43 38452.85 32776.43 58495.22 41718.33 41572.87 53517.08 76947.22 69887.57 69682.15 64845.14 28825.60
glutaric acid ME133443 69.11 54.17 67.33 49.85 79.56 66.00 66.15 58.93 205.78 149.67 204.07 208.15 210.22 240.57 188.00 255.79 71.15
glyceric acid ME133442 1704.67 988.67 1443.67 1246.38 1398.56 1259.29 1899.69 1461.14 3029.56 2527.00 3014.47 2694.00 3294.33 2578.57 4166.77 3042.07 864.30
glycerol ME133441 10553.11 8101.83 10701.60 8267.54 10424.00 9617.29 14437.69 7321.71 16998.89 14430.50 18349.67 16579.31 17619.67 19473.43 21978.38 13359.14 9184.75
glycerol-3-galactoside ME133440 482.89 459.17 487.80 477.23 508.11 369.00 480.15 484.29 286.56 272.83 312.33 589.77 312.78 407.14 441.08 588.71 444.80
glycerol-alpha-phosphate ME133439 1396.89 1018.50 1600.93 1043.62 1400.78 1544.43 2123.85 1442.79 8353.56 6515.67 7950.40 6886.23 9704.78 8729.71 10492.54 8165.93 312.20
glycine ME133438 57825.78 32546.83 48537.67 38388.38 55527.33 48427.29 51146.85 49002.21 144519.11 87864.17 126094.93 97835.46 138612.22 116322.14 109241.77 107703.00 56638.10
glycolic acid ME133437 659.89 562.00 632.73 590.00 571.11 549.29 677.85 712.21 941.56 952.33 940.47 1005.77 1014.22 1073.57 1131.23 1076.57 443.05
heptadecanoic acid NIST ME133436 278.67 315.00 346.40 301.69 345.33 323.29 473.23 346.43 429.22 397.17 448.87 535.00 498.00 511.43 531.38 611.93 323.65
hippuric acid ME133435 3941.89 2392.50 3191.27 2552.77 1777.11 1605.00 1757.46 1984.14 5548.78 4832.00 5518.87 3753.54 3535.78 3360.29 3503.08 3534.71 3780.90
histidine ME133434 2947.11 2528.17 2738.60 3068.69 3218.56 2960.57 3743.31 3327.57 8807.11 5713.67 5581.53 7045.62 5712.89 5885.86 6344.15 6771.21 4602.70
hydroxylamine ME133433 533.00 548.50 424.27 551.54 481.44 510.43 496.77 527.29 1327.89 1023.67 1089.27 1414.77 1203.33 1133.86 1155.62 1394.64 536.50
indole-3-acetate ME133432 337.67 1374.00 383.00 560.77 504.67 989.57 539.31 544.36 685.44 2622.83 761.07 1123.92 966.44 2061.29 1195.23 1150.57 578.35
indole-3-lactate ME133431 255.00 306.83 290.73 363.62 466.67 375.71 293.92 281.07 483.00 570.83 482.47 755.85 949.22 780.86 550.31 533.93 345.30
inosine ME133430 38.56 40.67 35.13 36.62 42.78 42.14 39.38 43.36 103.67 362.00 123.80 206.85 380.89 233.57 339.08 225.71 40.85
inulobiose ME133429 141.33 119.17 230.00 192.46 160.22 187.43 494.54 138.07 203.78 250.67 468.93 354.69 277.89 382.57 235.54 279.86 184.25
isocitric acid ME133428 313.44 265.33 337.13 411.46 220.22 332.29 419.23 328.57 306.00 253.00 247.20 357.00 224.11 332.43 319.00 308.79 339.85
isoleucine ME133427 14145.22 17628.33 17310.13 16748.92 12605.89 14913.00 17570.31 15391.00 27674.67 38285.00 31984.60 33794.00 23478.00 30456.14 31676.92 29783.21 16356.10
isothreonic acid ME133426 534.11 417.33 581.47 618.77 631.56 579.43 861.69 621.79 983.22 995.33 1189.47 1406.54 1517.22 1316.57 1720.08 1343.00 388.50
kynurenine ME133425 92.22 98.17 101.40 108.15 77.22 93.29 98.08 96.14 183.78 202.50 157.60 205.85 172.00 214.43 158.38 242.93 107.80
lactamide ME133424 144.89 116.00 137.53 149.08 103.22 55.43 79.62 83.64 231.89 264.33 281.27 292.31 252.22 186.57 169.00 196.50 129.75
lactic acid ME133423 79041.44 64889.50 92373.27 78165.23 56574.78 28003.14 37229.69 51032.36 164557.11 156337.17 175400.40 190792.00 151633.33 92961.86 98513.77 106303.00 68347.35
lauric acid ME133422 1548.44 1309.50 1474.87 1218.00 1151.00 1127.00 1080.77 1003.43 2411.22 2544.00 2382.27 2372.62 1985.78 2143.29 1964.92 1878.50 1501.50
leucine ME133421 17781.00 24541.00 25661.13 20478.31 19662.00 19413.14 24651.15 23097.21 40281.22 63746.50 54673.80 46338.46 40308.89 38377.29 50460.23 46575.00 22105.50
levoglucosan ME133420 185.44 368.00 227.07 326.15 245.89 216.43 157.23 397.00 312.11 749.67 392.27 648.00 423.00 440.00 305.23 808.00 276.50
lignoceric acid ME133419 333.44 174.00 255.93 290.85 265.33 574.86 200.62 196.64 420.00 296.17 351.40 390.46 643.67 383.71 394.85 358.07 392.80
linoleic acid ME133418 886.00 787.00 1051.67 754.85 822.00 838.43 1264.92 701.29 1889.11 1804.67 2106.00 1887.85 2123.00 1938.29 2876.08 1719.43 687.85
linolenic acid ME133417 811.78 576.67 809.00 1008.77 913.44 1066.86 1545.46 744.86 2097.56 2325.83 1674.73 2424.54 2624.78 2749.43 2324.38 2423.43 738.10
lysine ME133416 13832.78 12778.33 14652.40 14226.15 14297.22 12706.29 17718.77 15206.64 35437.33 32286.83 33491.20 33451.62 32334.56 30293.57 36828.31 33062.57 16340.85
malate ME133415 153.78 142.83 167.07 153.77 273.89 127.00 193.23 152.64 260.00 279.50 822.40 265.38 162.78 214.86 206.00 244.43 150.85
maleimide ME133414 428.22 183.17 207.80 188.62 233.33 285.86 248.15 189.36 2055.22 2488.83 2119.67 1899.85 1725.22 2266.00 1811.85 2125.86 187.00
maltose ME133413 223.11 60.17 124.27 257.38 102.33 81.00 135.08 155.00 269.33 211.00 365.73 410.15 106.22 143.14 157.77 184.93 155.25
maltotriose ME133412 153.11 80.83 86.33 181.54 71.56 64.00 83.15 129.00 139.78 131.50 149.00 164.92 104.67 145.57 101.31 133.79 128.20
mannitol ME133411 3591.22 2708.17 6849.27 5244.31 2928.89 5946.86 9442.31 3685.43 7809.11 6902.83 12142.60 10906.69 5568.44 11236.00 10538.31 7756.00 6050.65
methanolphosphate ME133410 193.00 237.00 284.13 239.23 279.56 313.43 258.85 254.64 470.22 571.33 464.60 571.38 622.67 637.86 578.38 449.50 266.40
methionine ME133409 765.00 1022.33 1085.47 836.85 1020.89 899.57 980.08 1177.64 1923.89 2762.33 2327.40 2084.23 2136.22 1944.00 1896.77 2163.00 1125.20
methionine sulfoxide ME133408 158.44 127.17 150.40 154.00 160.33 156.43 194.54 162.21 336.56 348.67 415.73 388.23 420.89 514.43 462.54 382.07 119.75
methylhexadecanoic acid ME133407 1077.56 949.67 1122.53 930.69 982.89 924.29 1213.23 888.43 1996.89 1809.00 1942.80 1986.15 2011.78 1740.29 2040.31 1795.43 993.95
myo-inositol ME133406 4124.00 2635.50 4347.40 5266.46 3106.44 4305.43 4823.31 3662.71 8142.67 6195.83 9087.87 11051.08 5906.44 9153.57 8712.92 6713.79 4491.15
myristic acid ME133405 720.67 552.50 741.53 555.31 685.00 617.43 712.15 453.93 1170.56 1036.17 1210.07 1114.15 1161.67 1194.29 1197.00 913.29 695.55
N-acetylglucosamine ME133507 845059.56 947519.33 843391.40 905657.85 905022.33 949547.71 850677.08 902411.00 2905.11 2876.50 2747.93 3577.00 2637.89 2810.00 2821.62 2479.14 863568.25
N-acetylglutamate ME133404 278.33 205.17 247.53 217.15 203.67 180.00 201.00 180.29 456.56 406.33 325.60 396.00 451.33 365.43 384.00 343.79 276.15
N-acetylglycine NIST ME133403 97.89 60.50 93.60 83.54 93.00 96.43 117.77 77.07 163.89 111.33 168.07 134.08 187.44 186.71 178.38 136.50 89.45
naproxen ME133402 58.11 55.50 1211.47 102.00 144.00 1950.00 614.85 2636.00 136.56 100.67 2035.33 180.00 114.44 4162.43 1174.46 5615.14 788.10
nicotinic acid ME133401 481.89 220.67 286.07 349.92 319.44 210.14 236.31 250.43 75.67 78.83 66.60 75.62 81.00 76.86 73.69 77.43 318.60
N-methylalanine ME133400 2994.00 3949.17 4329.93 3475.08 2955.89 3057.57 4499.46 3616.86 7333.67 9385.83 8426.40 8182.31 5917.33 6423.86 9082.15 7773.43 3735.25
oleic acid ME133399 2389.22 2108.67 2840.73 2202.38 2476.22 1873.57 3255.46 1327.43 4102.67 4116.17 4729.87 4495.62 5042.67 4138.14 6536.08 2707.29 2302.75
ornithine ME133398 14289.89 8927.67 13747.07 10906.77 8964.89 9865.14 11208.46 9527.07 39970.89 26014.33 36988.07 29353.85 22897.56 26015.14 26394.38 23446.29 12918.40
oxalic acid ME133397 170426.56 95421.33 112484.87 139202.38 128319.56 95128.43 95154.38 104840.36 14276.00 9101.83 12021.40 11021.54 15479.89 11261.00 17716.85 13997.71 131532.95
oxoproline ME133396 46708.44 41405.33 48398.93 35063.62 49726.89 41867.71 46596.92 40513.86 93200.89 90103.17 88094.47 79559.00 106904.56 89350.00 90041.31 81150.21 31065.30
palmitic acid ME133395 12596.44 11244.50 13302.33 10633.31 11357.11 11608.71 14128.08 9738.07 22899.11 22093.00 23536.87 22270.00 23608.78 22973.29 25740.69 19110.14 11422.25
palmitoleic acid ME133394 2077.56 1373.83 1881.00 1139.92 1831.33 1619.71 1583.08 568.93 3181.44 2750.17 2772.40 2240.62 3328.11 3428.29 3432.62 1087.00 1454.80
parabanic acid NIST ME133393 449.67 238.50 271.60 387.00 336.22 263.71 287.23 274.14 347.67 325.33 365.20 395.15 369.33 338.43 388.92 346.29 407.00
paracetamol ME133392 203.00 215.00 300.87 91.31 109.78 488.57 74.92 126.50 338.44 462.83 502.80 194.77 184.89 1077.29 154.15 253.29 166.80
pelargonic acid ME133391 2066.56 2036.67 2162.93 2159.54 2203.11 2427.00 2075.31 2148.21 4425.00 4416.83 4075.67 4711.38 4345.56 4268.71 4689.54 4494.21 2155.80
phenylacetic acid ME133390 59.56 52.00 65.73 69.46 94.00 78.43 71.92 72.71 154.56 133.50 136.00 151.77 192.33 144.43 154.54 158.21 82.95
phenylalanine ME133389 6762.78 6577.33 7245.27 6969.00 5665.00 7095.86 7917.00 6796.64 16804.33 15973.17 17992.80 17198.54 11785.89 15488.71 15785.15 14267.79 7219.75
phenylethylamine ME133388 188.11 280.33 213.87 271.54 179.89 565.57 197.85 315.14 547.11 694.50 554.60 730.85 451.00 1308.14 507.92 820.57 180.50
pimelic acid ME133387 145.11 94.17 67.27 85.77 63.22 57.14 59.62 75.57 404.11 350.17 319.27 304.62 205.89 252.86 239.85 417.21 99.70
pipecolic acid ME133386 54.44 277.17 108.07 98.77 125.44 700.86 124.00 218.43 213.33 1065.33 301.60 353.46 278.33 1567.00 287.38 646.21 173.10
proline ME133385 20131.22 31121.33 32577.40 24625.31 23178.78 36660.57 29487.85 35837.21 64836.22 93696.17 85223.40 70261.00 57526.44 89396.86 70878.00 89635.43 30726.35
pseudo uridine ME133384 822.89 746.17 766.13 1094.92 836.89 1012.57 917.38 863.14 1438.22 1393.50 1263.60 2079.54 1565.11 2041.43 1461.08 1553.64 854.75
pyrophosphate ME133383 3159.56 2037.17 2928.07 3441.92 926.56 845.00 1160.31 2489.07 756.44 726.33 840.73 954.54 871.11 904.14 854.08 1072.36 2166.25
pyruvic acid ME133382 3078.44 1691.00 2604.53 2303.31 748.56 564.00 1001.92 1154.29 421.33 298.33 323.40 726.92 246.00 233.86 218.85 295.93 2936.80
quinic acid ME133381 189.11 361.83 336.80 319.69 1268.33 976.57 362.38 278.86 353.67 864.67 5286.07 703.46 1385.22 1792.29 702.85 543.93 457.55
rhamnose ME133451 677.33 728.17 667.60 820.00 479.33 883.00 625.00 819.00 1262.89 1426.67 1251.27 1763.85 889.89 1878.29 1295.00 1596.36 693.10
ribose ME133380 46.67 43.17 43.40 39.62 54.11 42.71 54.85 52.36 84.56 62.17 85.47 101.08 84.44 126.00 95.31 94.57 42.60
saccharic acid ME133379 97.44 54.17 85.33 91.77 123.67 81.86 82.15 67.43 162.89 99.83 569.40 158.54 169.56 137.57 114.77 109.36 93.05
salicylic acid ME133378 293.89 140.00 465.07 268.00 25292.67 282.00 2897.31 447.93 518.00 300.67 900.67 544.15 62038.00 545.00 2805.77 851.57 9092.30
serine ME133377 4324.56 4954.33 6148.20 4653.46 4904.44 4525.00 5914.31 5050.29 14163.44 17881.33 18901.53 12810.92 12277.89 10805.71 12122.77 11988.00 5577.30
shikimic acid ME133376 114.78 121.67 97.73 224.31 130.67 214.71 149.62 173.50 1801.00 1360.33 1413.47 1326.38 1408.22 1382.86 1241.15 2195.43 241.05
stearic acid ME133375 67458.44 61819.00 67821.67 57840.15 60200.00 60496.00 73644.31 56613.57 110522.89 113669.17 110361.00 111962.92 110239.89 106321.71 114308.31 99767.50 63765.80
succinic acid ME133374 314.78 252.67 234.47 218.69 264.78 232.14 240.31 210.50 692.78 575.67 626.93 547.85 752.56 665.29 616.46 632.36 257.20
sucrose ME133373 80.22 73.17 89.60 84.85 663.67 75.57 102.00 102.79 150.11 163.67 2233.00 127.23 612.78 162.14 102.46 186.57 171.50
tagatose ME133372 564.33 686.17 501.47 525.00 553.44 758.86 734.46 801.50 1373.67 1906.17 1557.00 2253.92 2621.00 2362.14 2443.85 2627.50 361.85
taurine ME133371 1516.44 1208.50 1843.93 1459.38 637.78 697.00 953.15 1490.93 7196.11 6288.50 7561.40 6146.00 4426.22 5015.86 4597.62 4370.86 1226.50
threitol ME133370 204.22 131.17 184.53 208.92 182.78 205.57 211.15 187.57 337.78 268.00 316.00 413.08 322.00 419.29 320.77 345.64 200.45
threonic acid ME133369 1476.22 686.67 1391.13 938.54 2066.56 927.57 2764.92 1550.00 4367.00 1718.67 4230.27 2711.00 5207.44 2299.00 6360.92 3712.21 1114.45
threonine ME133368 11134.78 8881.83 10839.27 10425.23 12792.22 8803.29 11132.23 8531.21 22548.00 20766.50 21315.33 22654.62 27585.11 18796.86 22327.15 17106.79 11190.15
threose ME133367 73.67 85.33 86.47 71.15 84.78 80.71 100.08 87.43 187.67 198.83 169.33 205.46 192.22 229.29 220.77 204.29 89.25
tocopherol alpha ME133366 2047.67 1383.50 2167.40 1690.69 1998.67 1361.29 2785.00 1667.57 3359.44 2252.17 3092.67 3071.00 3887.22 2627.86 4755.92 2770.00 2000.65
trans-4-hydroxyproline ME133365 867.67 516.17 493.80 522.00 398.00 748.00 497.69 620.86 1548.89 752.33 762.27 1074.15 735.44 1418.29 885.23 1115.14 599.95
tryptophan ME133364 13181.22 15213.50 13450.27 13909.31 14308.33 13223.00 17131.00 14332.64 35867.00 37419.67 29239.27 33715.62 32844.89 32836.14 36991.54 31546.14 14771.90
tyrosine ME133363 15517.56 16759.00 17084.67 15785.00 12208.11 16150.43 19908.00 15627.43 32053.33 33117.67 31408.13 34517.85 28099.22 35417.86 37009.92 30165.21 16208.15
urea ME133362 183059.00 161834.33 176635.27 183204.54 145863.33 184004.00 179319.23 177258.43 265990.89 223477.00 241835.47 258144.23 194280.33 332311.71 264585.46 314945.14 165589.20
uric acid ME133361 10856.67 10948.17 12178.07 12664.77 10320.33 13977.14 15181.23 13962.00 22925.89 23383.83 21919.13 26796.85 20907.56 31017.86 27710.38 28422.00 10905.60
uridine ME133360 101.33 113.33 102.73 112.85 113.11 106.43 115.38 103.50 116.11 152.17 99.33 132.85 108.89 150.86 117.54 107.50 98.45
valine ME133359 33395.22 43357.83 43968.80 36895.46 36997.78 34845.29 43821.08 42701.50 79752.00 109368.33 91598.47 88599.38 78516.22 74117.71 89648.85 90664.79 40925.50
xanthine ME133358 54.11 49.67 53.33 58.31 45.67 50.71 47.31 44.14 159.78 130.50 175.20 144.92 141.33 136.86 125.38 127.36 50.10
xylitol ME133357 165.33 139.00 126.73 121.38 171.00 208.00 96.23 298.86 307.22 260.67 252.07 204.08 368.33 444.86 177.46 255.36 141.80
xylose ME133356 518.33 463.17 474.93 619.85 404.00 582.71 562.15 801.14 1018.67 980.67 993.60 1360.08 1050.11 1291.00 1056.23 1535.07 494.00

Factors:

F1Organ:Plasma | Health State:Adenocarcinoma | Smoking Status:Current | Gender:F
F2Organ:Plasma | Health State:Adenocarcinoma | Smoking Status:Current | Gender:M
F3Organ:Plasma | Health State:Adenocarcinoma | Smoking Status:Former | Gender:F
F4Organ:Plasma | Health State:Adenocarcinoma | Smoking Status:Former | Gender:M
F5Organ:Plasma | Health State:Healthy | Smoking Status:Current | Gender:F
F6Organ:Plasma | Health State:Healthy | Smoking Status:Current | Gender:M
F7Organ:Plasma | Health State:Healthy | Smoking Status:Former | Gender:F
F8Organ:Plasma | Health State:Healthy | Smoking Status:Former | Gender:M
F9Organ:Serum | Health State:Adenocarcinoma | Smoking Status:Current | Gender:F
F10Organ:Serum | Health State:Adenocarcinoma | Smoking Status:Current | Gender:M
F11Organ:Serum | Health State:Adenocarcinoma | Smoking Status:Former | Gender:F
F12Organ:Serum | Health State:Adenocarcinoma | Smoking Status:Former | Gender:M
F13Organ:Serum | Health State:Healthy | Smoking Status:Current | Gender:F
F14Organ:Serum | Health State:Healthy | Smoking Status:Current | Gender:M
F15Organ:Serum | Health State:Healthy | Smoking Status:Former | Gender:F
F16Organ:Serum | Health State:Healthy | Smoking Status:Former | Gender:M
F17Organ:Serum or Plasma | Health State:NA | Smoking Status:NA | Gender:NA
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