metabolite_name S00026010 S00026011 S00026012 S00026013 1-METHYLADENOSINE (M+CL)- 2215.2122 2973.5007 2238.6082 2965.3179 16:0 LYSO PC (M+CL)- 12399.976 33248.56 28443.46 25921.172 16:0-18:0 PC (M+CL)- 12125.471 20490.023 15518.594 14839.021 18:0 LYSO-PE (M-H)- 18525.955 50007.645 34315.45 23735.3 2-DEOXY-D-GLUCOSE (M+CL)- 123558.84 142520.62 134175.44 119824.5 2-HYDROXY-3-METHYLBUTYRIC ACID (M-H)- 178030.58 176966.22 176469.84 196870.16 2-METHYLMALEIC ACID #2 (M-H)- 46802.715 59766.945 63363.68 58841.594 24:0 SM (D18:1/24:0) (M+CL)- 27184.557 26328.906 27512.3 30333.83 3-(4-HYDROXYPHENYL)LACTIC ACID (M-H)- 44495.977 72456.61 54197.246 67149.69 3-HYDROXY-3-METHYLGLUTARIC ACID (M-H)- 311364.22 485938 418890.38 432543.97 3-METHYL-2-OXOPENTANOIC ACID (M-H)- 750523.8 683631.6 904172.4 1169471.4 3-UREIDOPROPIONIC ACID (M-H)- 28027.895 30850.555 41592.805 32626.176 4-ACETAMIDOBUTANOIC ACID (M-H)- 31929.328 51885.863 41035.207 36904.79 4-HYDROXYBENZOIC ACID (M-H)- 11332.892 12222.311 8846.201 10800.789 4-METHYL-2-OXOPENTANOIC ACID (M-H)- 1463403.9 1272891.4 1808964.5 2395294.5 5'-METHYLTHIOADENOSINE (M+CL)- 40511.965 66819.13 55648.234 36743.41 5-OXOPROLINE (M-H)- 953568.44 683300.9 739639.44 881482.25 ADENOSINE (M+CL)- 42509.055 54474.01 33979.56 56905.66 ADIPIC ACID (M-H)- 7962.631 11777.991 4207.497 15532.754 ALPHA-HYDROXYISOBUTYRIC ACID (M-H)- 39499.367 43694.707 58065.87 65523.098 ARABITOL (M+CL)- 4594.655 3146.8853 3391.9485 4548.468 ARACHIDONIC ACID (M-H)- 199574.75 304864.56 287192.16 251921.33 AZELAIC ACID (M-H)- 4832.8555 5905.05 5072.5093 11163.008 BENZOIC ACID (M-H)- 15686.103 23239.586 25757.66 32574.139 BIOTIN (M-H)- 10321.559 16150.748 7705.5376 6097.2153 CIS-ACONITIC ACID (M-H)- 25449.504 58537.418 72697.625 28972.422 CITRAMALIC ACID (M-H)- 57387.027 41974.02 58632.445 77593.37 CITRIC ACID (M-H)- 775639.1 837614.3 1175762.2 1086124.4 DEOXYCYTIDINE (M+CL)- 16795.453 28384.555 29220.98 16566.979 DEOXYURIDINE (M+CL)- 2091947.5 4087669.5 3171398.5 1942965.2 DEOXYURIDINE (M-H)- 77096.234 143406.6 114986.47 76220.984 DOCOSAHEXAENOIC ACID (M-H)- 608942.94 729297.8 634502.56 594839.4 EPIBRASSINOLIDE [ISTD] (M+CL)- 228235.75 244510.52 255453.78 283096.44 GLUCONIC ACID (M-H)- 50702.434 49427.887 51599.445 57927.82 GLUCOSE (M+CL)- 1503104.1 1473520.1 1551322.2 1132063.4 GLUTARIC ACID (M-H)- 14781.138 19263.287 22873.559 21066.236 GLYCERIC ACID (M-H)- 32279.79 30247.168 25841.953 39474.85 HEPTADECANOIC ACID (M-H)- 6726.357 6531.4805 6759.313 6564.2886 HIPPURIC ACID (M-H)- 6364.9336 13537.85 7183.9346 8497.642 HYODEOXYCHOLIC ACID (M-H)- 602414.25 629815.75 615240.6 597530.7 ISOCITRIC ACID (M-H)- 717880.56 868586.3 1129827.9 1295796.1 ISOLEUCINE (M-H)- 1082897.9 1195131.8 1435912.8 1168615.4 L-TRYPTOPHAN-15N2 [ISTD] (M-H)- 58882.066 65900.734 69185.484 74315.56 L-[15N]ANTHRANILIC ACID [ISTD] (M-H)- 54555.113 62914.992 72644.414 74535.555 LINOLEIC ACID (M-H)- 19319.107 24918.547 23323.441 21802.902 LYSINE (M-H)- 4477.662 5751.9097 7470.6743 3573.12 MALEIC ACID (M-H)- 69796.55 88661.69 79505.03 79563.125 MALIC ACID (M-H)- 130369.22 181772.16 154503.9 158707.92 METHYL BETA-D-GALACTOSIDE (M+CL)- 27459.2 31063.2 31845.252 27964.857 MEVALONIC ACID (M-H)- 378743.9 420192.94 268591.3 289072.88 MYRISTIC ACID (M-H)- 12731.647 13732.985 14612.687 13798.173 N-ACETYL-D-GLUCOSAMINE (M+CL)- 306008.06 210881.75 274406.94 248774.03 N-ACETYL-L-ALANINE (M-H)- 211761.52 192026.22 197780.97 190769.52 N-ACETYL-L-LEUCINE (M-H)- 6414.755 7728.1953 8521.7295 7182.7075 N-ACETYL-L-PHENYLALANINE (M-H)- 8621.181 12154.573 7837.0845 7334.88 N-ACETYLGLYCINE (M-H)- 18988.379 21006.924 20923.127 17667.54 N-ACETYLNEURAMINIC ACID (M-H)- 214499.9 172867.81 169256.3 187994.88 O-SUCCINYL-L-HOMOSERINE (M-H)- 15880.667 17676.488 16704.61 13606.58 OLEIC ACID (M-H)- 49393.207 56419.656 64546.992 53598.77 OROTIC ACID (M-H)- 102015.414 160133.88 207554.48 140513.11 OXALOACETIC ACID (M-H)-[-H2O] 52838.387 53737.98 60214.676 44712.113 PALMITIC ACID (M-H)- 100946.28 97583.12 109507.51 104069.336 PALMITOLEIC ACID (M-H)- 8411.177 9117.399 11917.25 8511.666 PANTOTHENIC ACID (M+CL)- 1608769.6 2092371.2 1668594.9 1574895.2 PANTOTHENIC ACID (M-H)- 4533262 6072063 4560863.5 4264633.5 PHENYLALANINE (M-H)- 3677087.8 5061324.5 5075900 3953790.8 PTERIN (M-H)- 25016.123 46853.758 36378.742 33080.45 PYRUVIC ACID (M-H)- 38672.65 34270.777 28398.69 48256.17 RIBITOL (M+CL)- 427277.12 583331.8 595126.2 469384 S-ADENOSYL-L-HOMOCYSTEINE (M-H)- 6517.2173 6573.7773 7470.86 6884.84 SALICYLATE #2 (M-H)- 71017.11 77443.12 93471.875 111633.23 STEARIC ACID (M-H)- 108256.97 105623.17 119055.89 105318.88 SUCCINIC ACID (M-H)- 501773.88 757069.1 548299.8 635311.8 SUCROSE (M+CL)- 4058.3506 3355.3206 2597.871 3404.2844 THYMIDINE (M+CL)- 309847.06 734265.8 522595.6 291170.75 THYMIDINE (M-H)- 9865.981 20861.752 15436.502 8216.372 TRANS-ACONITIC ACID (M-H)- 123482.2 238979.38 291429.62 153368.42 TRYPTOPHAN (2M-H)- 99778.28 153551.31 142780.92 118312.56 TRYPTOPHAN (M-H)- 470466.3 645233.56 613618.5 562610.44 TYROSINE (M-H)- 197251.12 199224.58 225166.31 178218.45 UNK_116.0475@2.337 570796.3 559963.44 734047.44 852929.56 UNK_120.0418@0.825 76035.99 77238.46 114570.47 97908.086 UNK_135.9019@24.643 110702.98 253775.22 267238.06 224527.11 UNK_146.0496@7.663 39982.418 44592.047 40830.668 52143.254 UNK_146.0576@2.071 76927.32 80014.99 74907.1 167603.62 UNK_148.0515@2.449 44757.797 61096.234 44091.617 49018.414 UNK_154.0262@4.608 65860.34 105737.38 77262.52 100476.46 UNK_169.9965@5.826 275278.4 214821.78 186392.44 313500.72 UNK_173.9987@3.173 417980.84 579927.4 220880.16 209483.27 UNK_180.0581@2.461 33790.344 40379.81 40634.35 32796.008 UNK_188.882@0.480 20864.543 21545.34 18345.738 19369.246 UNK_189.1@2.413 109534.17 132132.3 133590.23 110372.17 UNK_189.9936@2.553 943662.9 1330882.5 899024.6 805202.75 UNK_190.0474@1.365 608775 702003.5 790997.5 679680.4 UNK_192.0271@1.447 190049.28 251783.6 359122.6 260225.88 UNK_197.0326@7.961 39206.574 35855.82 75040.086 50803.51 UNK_201.056@2.454 78860.484 87752.71 93501 76879.56 UNK_202.0305@8.430 415808.16 734339.9 414162.9 387442.53 UNK_202.0454@0.897 100118.07 121000 108743.43 99678.13 UNK_204.0096@3.991 42578.54 51882.137 42461.133 45198.01 UNK_213.0099@3.512 256570.25 359810.72 160322.38 150614.56 UNK_213.9866@5.821 317177.34 249246.02 213374.67 364753.25 UNK_214.023@9.429 26604.521 33491.055 98406.77 25869.572 UNK_214.8969@0.794 142482.56 117204.07 113033.09 159729.58 UNK_216.0404@1.458 928678.7 815404.6 905719.4 952909.4 UNK_219.1108@3.480 591298.4 813502.7 606638.5 501554.94 UNK_219.1116@3.279 10200000 14700000 10100000 9224542 UNK_223.0385@2.463 72639.76 74627.69 70800.05 76411.78 UNK_228.9124@1.723 184945.3 164447.67 227113.3 216943.08 UNK_233.0669@2.452 88098.375 100459.82 94769.04 89355.72 UNK_235.1053@1.568 52348.242 73293.7 63202.586 58301.797 UNK_236.0821@2.483 18784.883 36743.562 21491.578 28269.445 UNK_239.0396@1.269 58949.11 42104.35 48694.81 58295.43 UNK_239.0542@0.938 128651.46 137264.12 124824.8 114514.08 UNK_239.0566@1.414 75280.8 76190.664 75861.09 85124.77 UNK_240.0748@19.167 46020.203 60343.73 65779.96 54454.062 UNK_242.0652@3.535 50713.684 63293.965 68158.055 61265.184 UNK_243.1837@15.878 17489.008 16388.908 16665.428 23471.979 UNK_244.07@0.917 70860.84 147809.31 109556.05 55889.105 UNK_249.122@2.450 16025.1875 17658.965 17557.332 15569.761 UNK_253.8885@0.804 37378.395 36158.79 41186.57 36879.203 UNK_254.099@1.471 28435.592 33802.426 38627.555 34359.293 UNK_255.088@3.476 286924.7 377851.47 293972.25 236118.45 UNK_256.9672@1.503 575981.4 525239.3 583294.5 535789.44 UNK_261.0673@2.446 44368.945 47821.973 48254.145 43114.3 UNK_262.0492@3.545 139733.69 152346.27 156788 153838.64 UNK_265.1177@3.825 15524.871 15338.775 15046.397 19948.977 UNK_266.1566@21.599 20725.3 37918.824 21627.986 34171.54 UNK_266.9961@1.526 94532.88 87353.79 93743.766 88708.54 UNK_268.0796@1.541 42462.84 65043.703 45933.574 55125.11 UNK_269.9905@14.336 70874.25 82611.93 80589.38 69480.25 UNK_271.0837@1.574 27691.252 42151.25 33597.926 32405.46 UNK_272.0772@3.542 61655.53 67546.1 67605.06 68244.58 UNK_272.2358@22.430 53896.004 65539.23 53977.473 71366.93 UNK_272.939@5.299 16618.73 18466.72 19535.316 22814.617 UNK_274.0803@1.536 165681.25 311012.25 253193.1 160914.95 UNK_276.0627@2.394 66011.125 82200.25 73945.62 88984.445 UNK_277.07@3.276 178870.47 213822.95 179538.34 190632.31 UNK_277.084@1.291 37839.805 46633.387 59472.883 36658.418 UNK_277.9202@0.850 32484.2 27010.062 29643.535 25726.393 UNK_282.1087@4.814 25461.7 20802.219 36617.586 48027.715 UNK_288.0962@2.742 29498.39 64259.21 44571.555 24444.38 UNK_288.9208@1.825 21648.01 33919.25 20938.47 33793.703 UNK_289.8852@1.163 169703.33 88799.63 110551.98 140767.05 UNK_290.906@4.820 121025.69 112907.86 174582.7 256460.31 UNK_291.9367@1.454 533100.4 533371.25 565768.6 482379.38 UNK_294.0621@1.450 47207.36 70724.29 70870.56 45331.08 UNK_294.0625@2.451 124024.42 224294.67 147795.03 104308.35 UNK_294.0627@2.146 43201.707 117815.21 70132.67 38397.293 UNK_294.1874@24.330 55699.62 101020.734 50588.66 70236.38 UNK_297.1083@2.494 15154.255 20116.645 18639.203 21854.225 UNK_298.0722@5.314 30466.35 32906.008 38237.188 39397.863 UNK_298.2509@22.108 18439.963 19631.27 21440.867 19083.373 UNK_298.8875@5.320 99734.21 105508.32 93209.914 112326.41 UNK_300.2662@22.146 36556.74 36348.086 35791.84 38553.668 UNK_300.9346@4.822 46477.996 39985.363 66186.46 96011.18 UNK_300.9806@2.445 40951.297 41515.125 42393.6 37284.098 UNK_301.0531@2.453 24997.87 26809.102 25758.84 24406.09 UNK_302.225@22.508 8836.817 13835.644 9949.268 9252.624 UNK_302.2467@22.842 11039.422 10183.847 11243.431 11571.132 UNK_304.0904@2.459 13358.982 29011.377 19875.344 11621.848 UNK_305.1053@1.548 57513.953 53051.83 56262.332 70780.31 UNK_305.9186@1.819 21501.39 28055.15 20418.625 13271.34 UNK_306.2568@22.888 16188.909 24277.646 26617.709 22146.871 UNK_306.9472@1.284 130974.07 86708.53 110135.54 109430.29 UNK_307.9999@3.276 294180.4 314452.7 295726.47 276277.38 UNK_309.8915@0.858 70827.85 56130.9 57493.086 46466.26 UNK_311.1574@1.499 59575.473 56902.684 62119.1 63823.64 UNK_317.1093@3.597 10855.275 15511.903 13494.301 11514.256 UNK_318.0736@2.523 22139.19 25424.912 26161.418 28004.37 UNK_321.8943@1.838 64142.14 112851.85 50357.312 89873.34 UNK_322.922@5.318 24127.113 26654.775 27336.287 29693.277 UNK_324.2286@22.840 44092.844 41563.6 47744.44 44263.47 UNK_325.1025@0.799 13550.35 16760.613 16740.021 13593.653 UNK_325.9216@2.406 255735.3 239383.45 276131.88 228787.1 UNK_326.1144@2.371 15911.799 19989.71 16061.822 13302.415 UNK_328.1351@22.455 39553.266 39807.64 40009.188 40636.367 UNK_328.2618@22.517 25437.107 26577.508 26750.486 25860.057 UNK_330.2569@22.849 53666.914 63694.207 58578.19 52562.883 UNK_330.2775@23.182 6526.7637 7053.8813 8433.582 7349.7446 UNK_332.2725@22.955 33237.176 45297.45 41002.29 37756.832 UNK_333.0846@2.507 49472.426 59051.48 57352.31 66759.35 UNK_334.0989@1.361 20598.898 31245.9 20642.861 23516.957 UNK_339.1889@1.473 17214.734 21426.47 25133.04 19635.709 UNK_340.2178@22.712 14276.515 18414.826 19529.285 17392.518 UNK_340.2238@22.432 10527.14 11434.169 10400.28 13241.988 UNK_345.1432@2.451 100027.03 120167.39 111710.42 105835.39 UNK_346.1423@6.651 16633.62 16043.814 19199.54 20845.055 UNK_346.1428@8.559 1052443.5 1156303.1 1262023.2 1474369.5 UNK_346.1429@7.451 11873.713 12945.152 15015.768 15886.077 UNK_347.1093@22.453 39793.332 39872.94 41589.016 40562.65 UNK_348.1592@8.967 25224.326 27208.709 28357.469 31976.588 UNK_350.2442@22.927 8948.607 11178.915 12118.682 9847.998 UNK_350.9176@4.823 39941.547 35452.316 60598.387 87599.914 UNK_352.0136@2.440 65977.555 73601.48 74884.47 63196.977 UNK_352.0859@1.518 121984.445 107035.51 125262.86 114610.3 UNK_352.1408@2.456 71715.58 85956.72 79352.164 74887.26 UNK_352.261@23.181 29487.955 32284.41 34947.824 32940.1 UNK_354.1519@22.619 7862.872 8652.972 10676.067 8169.806 UNK_354.1726@22.842 8368.612 8760.23 9630.125 8287.685 UNK_356.1667@22.837 219067.73 225581.92 236798.92 224353.58 UNK_356.2705@22.908 8578.509 11297.715 8935.413 6661.5576 UNK_358.0633@1.358 15023.625 20648.115 14577.658 13196.201 UNK_358.2885@23.080 12362.703 13186.086 14920.224 13252.223 UNK_358.8988@5.307 67920.32 75102.32 74907.22 81908.18 UNK_359.1698@1.540 117941.39 224094.28 182625.03 110009 UNK_360.3026@23.259 5952.3228 6484.0938 7636.1294 7598.4023 UNK_361.0208@21.781 28131.672 26839.082 24697.398 30496.742 UNK_362.0986@1.336 41431.92 98470.65 48940.55 46102.234 UNK_364.2183@22.690 58827.863 65225.355 60470.27 57660.99 UNK_366.9552@2.752 16863.178 37167.348 26693.494 12746.204 UNK_368.2349@22.144 32370.717 126357.56 31097.773 44744.098 UNK_368.2541@22.831 139274.3 143160.64 145970.2 143690.56 UNK_371.154@22.650 6670.166 9508.509 10847.999 9407.715 UNK_372.2288@22.717 26840.09 39762.242 37543.7 35389.168 UNK_373.1135@1.191 306643.28 393392.25 273435.88 269326.97 UNK_373.1275@22.619 8343.731 8462.254 10471.072 7435.7173 UNK_373.1491@22.840 10605.849 9079.132 11196.881 9328.532 UNK_375.0564@2.455 27601.488 28995.355 28714.627 26757.943 UNK_375.1257@0.933 26512.86 36347.953 25529.543 22207.979 UNK_375.1412@22.840 256369.92 240154.12 275699 257574.12 UNK_376.1423@22.453 23967.992 25913.379 25041.525 26841.979 UNK_377.0383@21.139 34695.402 32347.324 33226.684 30888.639 UNK_377.958@3.274 39106.984 37147.54 40993.8 37249.766 UNK_378.2813@22.799 392554.88 404973.94 412448.25 415763.56 UNK_379.9538@3.194 1271794.6 1247755.6 1354823.2 1215643.8 UNK_380.1081@1.301 28628.814 34787.617 34339.234 24653.795 UNK_380.166@22.736 10763.879 15496.211 15990.712 15134.018 UNK_382.1195@8.558 188617.16 205443.95 211507.98 229660.56 UNK_382.1819@22.913 41719.55 46698.004 52828.19 43788.293 UNK_382.268@22.849 286081.12 283517.88 292919.06 287100.88 UNK_384.131@1.273 69383.695 69454.05 68155.57 65811.91 UNK_384.1983@23.181 164777.36 189558.8 194420.75 196079.67 UNK_386.1953@22.841 64050.79 61182.91 61538.164 61433.105 UNK_386.1995@22.691 15656.394 15398.064 14254.541 15161.429 UNK_389.0526@22.455 35391.594 27945.57 29927.191 32113.36 UNK_390.1951@1.548 95855.766 79443.74 88070.4 120083.87 UNK_391.0244@3.542 16539.068 19469.195 18169.334 17007.715 UNK_392.2159@22.837 39292.73 37253.055 42441 40374.61 UNK_396.2286@22.696 82356.27 94342.04 80000.73 76616.34 UNK_399.1421@22.754 12703.122 14959.637 13608.286 13636.667 UNK_400.0884@0.865 8985.108 22705.352 20887.447 9635.052 UNK_401.1198@1.293 20679.312 16786.857 35058.875 20593.006 UNK_401.1205@1.432 66790.36 62798.094 94373.05 76709.01 UNK_403.1729@23.182 202016.12 229413.4 257203.69 229212.78 UNK_404.1015@8.575 79309.984 76565.52 78996.336 78971.414 UNK_404.1718@22.868 126219.125 124031.586 130613.586 121577.3 UNK_405.1657@2.408 16190.077 25744.83 25019.469 22775.275 UNK_406.1739@23.183 16099.325 18769.27 21843.176 18423.191 UNK_409.3048@16.457 875.4066 3393.9797 2342.6355 23976.41 UNK_412.1667@14.541 39342.766 25105.277 126420.39 55072.16 UNK_412.2062@22.928 15185.112 18252.865 22031.564 15630.676 UNK_413.1339@22.850 39684.246 35218.79 40559.953 40368.176 UNK_414.1305@8.571 96524.5 94944.05 101872.99 100305.734 UNK_414.2225@23.180 56515.98 59044.64 61464.58 59248.176 UNK_415.0945@3.180 36408.625 49731.832 22107.113 23257.545 UNK_417.0854@22.843 54892.375 42907.08 55153.125 52549.895 UNK_419.1484@1.576 47462.266 44148.17 43975.02 50609.535 UNK_420.0551@2.439 187366.14 182724.42 189682.83 170658.27 UNK_420.1218@2.456 55945.508 61175.918 59292.93 51050.484 UNK_420.162@22.950 24889.139 25696.74 27843.766 25987.389 UNK_420.1747@23.196 71979.41 61377.72 66373.836 65986.21 UNK_420.2472@23.183 31891.895 32001.828 36098.06 34278.008 UNK_422.1511@16.515 74935.49 71118.055 95724.914 134567.03 UNK_422.2353@24.098 181503.92 307074.9 204788.64 224491.33 UNK_422.2356@24.644 29058.584 177287.58 126372.14 136179.42 UNK_423.1409@22.710 24219.229 33756.52 31204.77 28948.66 UNK_423.1653@2.451 37222.293 79927.055 49006.95 32295.541 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82250.445 73386.07 UNK_739.2817@22.271 8812.955 22529.256 20125.979 16884.03 UNK_745.5624@25.599 17840.93 33197.234 22821.256 21804.945 UNK_745.5698@23.874 19585.041 37551.31 44063.03 41141.88 UNK_746.451@22.694 10358.635 10608.429 9709.859 9677.193 UNK_746.56@23.725 40096.348 91518.664 91199.266 79576.7 UNK_747.5217@24.535 61873.79 126348.48 129497.43 121111.87 UNK_748.5745@24.042 420079.12 821415.06 804703.4 753343.56 UNK_749.5383@24.749 53302.47 121246.016 97582.07 93604.195 UNK_750.375@22.848 15371.9 15058.896 15348.376 15987.657 UNK_750.5866@24.258 64354.23 91416.3 128587.1 130966.375 UNK_751.5413@24.132 56117.812 123787.98 98718.305 87027.29 UNK_751.5519@25.172 16328.581 32947.645 32007.941 35753.67 UNK_751.5521@25.362 53046.145 132962.61 80753.31 85749.31 UNK_753.4057@22.931 22491.355 22872.09 25817.248 23226.62 UNK_753.5572@27.380 6482.1436 4442.1655 3378.2148 5041.312 UNK_754.2158@3.266 21795.145 25840.508 20888.547 19239.484 UNK_759.255@3.289 65594.55 70826.23 62223.688 63111.773 UNK_763.2574@22.268 5204.5522 12617.718 12690.493 9840.039 UNK_764.5685@23.822 12985.153 20683.88 17990.633 15591.979 UNK_765.5894@25.204 24140.564 40343.977 39435.34 41532.29 UNK_766.5748@24.624 20896.121 45133.37 40452.445 39597.55 UNK_769.5424@24.691 39211.117 95603.484 79159.62 66761.95 UNK_775.211@8.564 36809.38 38746.895 42412.285 47049.67 UNK_776.6055@24.621 138627.52 234776.88 225924.53 247479.22 UNK_777.5543@24.277 110563.234 281729.03 236996.22 219297.17 UNK_779.5703@24.702 280118.03 605696.44 518556.72 472468.84 UNK_779.5751@27.586 21565.246 32141.605 28685.188 30320.043 UNK_779.5839@26.106 23196.105 37299.76 46055.008 41356.566 UNK_781.5909@29.314 23862.969 16068.116 13338.659 17429.54 UNK_782.217@8.561 72660.24 76022.46 83387.88 87581.94 UNK_784.1848@8.558 32265.365 32856.016 35080.03 36264.074 UNK_785.404@22.697 19445.318 19304.406 18495.613 19489.92 UNK_788.4695@23.181 14324.678 15811.595 16602.85 16458.637 UNK_791.5678@24.539 14884.215 37187.617 31878.164 27473.293 UNK_791.6055@25.347 51269.215 139272 116394.28 115224.3 UNK_795.5563@24.838 46139.29 104020.49 96714.836 82782.125 UNK_799.4062@22.713 19671.49 20358.086 18767.111 18877.17 UNK_800.3984@22.858 16165.264 18102.602 17520.182 17560.244 UNK_803.5686@24.423 131049.46 362304.1 298515.97 275973.97 UNK_804.6363@25.372 49852.22 66462.73 61476.715 69529.266 UNK_805.5853@24.847 358154.16 918174 826781.44 711638.1 UNK_806.421@22.752 43508.887 43176.36 44678.277 42370.24 UNK_806.4323@23.185 13840.456 15412.225 16742.455 14390.399 UNK_806.5322@24.041 38309.637 60043.02 63148.94 59060.027 UNK_807.6001@25.498 53076.67 94831.03 79549.04 83069.29 UNK_808.5465@24.268 7353.0254 11227.561 11396.747 11989.611 UNK_813.1973@8.569 14719.368 14037.802 16155.732 16896.014 UNK_813.5596@23.869 7956.1504 12634.204 15235.072 14117.856 UNK_813.589@24.779 21647.781 59828.59 43786.707 43166.41 UNK_814.5529@23.722 17620.195 38051.594 37096.13 32284.283 UNK_815.1632@8.557 176882.05 207930.81 202116.19 212035.83 UNK_815.5103@24.532 22351.43 40086.36 41856.316 40630.215 UNK_816.5613@24.039 154046.52 274949.7 267009.25 254238.95 UNK_817.4457@22.960 97342.86 91895.42 95673.28 97952.3 UNK_817.5335@24.756 22297.55 42686.62 31281.488 35353.16 UNK_819.1471@8.559 178224.14 213659.05 208656.19 216327.89 UNK_819.6367@25.944 12878.316 11331.767 10144.154 10819.445 UNK_821.5695@25.107 27314.92 60827.047 48780.645 50374.918 UNK_822.6402@26.405 22399.469 22772.705 21805.979 25628.512 UNK_824.6404@22.837 19232.04 17925.69 20920.033 19961.434 UNK_827.4732@22.933 54265.543 53605.426 53344.137 53252.06 UNK_827.5692@24.367 220165.17 681923.44 514249.9 458132.16 UNK_830.2102@8.570 34123.06 35073.703 36802.805 38150.914 UNK_830.6525@25.629 31952.209 56190.29 53869.164 53420.73 UNK_831.5987@25.098 199393.53 469529.78 428251.94 373518.94 UNK_832.6676@26.401 107661.07 119086.14 95118.66 119600.734 UNK_833.6161@25.686 81915.664 208910.1 195293.33 162233.66 UNK_834.52@24.043 29779.895 46452.402 46911.367 44128.215 UNK_835.5336@24.979 23729.166 46785.74 29103.41 23099.662 UNK_837.5423@24.704 35057.484 62510.44 52211.176 46904.94 UNK_839.6046@24.921 25092.135 71022.66 48787.645 40168.53 UNK_840.18@8.560 23701.955 25372.959 25957.07 24937.777 UNK_840.3193@3.539 87021.33 109802.63 107053.02 96514.09 UNK_844.2228@8.563 25672.592 24968.775 27664.303 28323.363 UNK_844.5918@24.603 53694.55 84174.25 82241.555 82340.016 UNK_845.5397@24.271 45134.4 99346.07 89547.91 84625.18 UNK_845.5723@25.027 37264.414 84050.164 64617.98 60149.227 UNK_845.6587@26.074 21967.8 35203.223 45259.09 46142.918 UNK_846.6397@25.733 15305.098 30182.865 31042.553 25594.514 UNK_847.5587@24.704 103265.38 181161.9 159745.19 149666.97 UNK_847.6768@27.210 20582.723 20826.555 22494.154 27624.205 UNK_848.6552@26.525 45117.93 95671 102600.82 76130.87 UNK_850.2277@8.568 20386.223 19914.799 22053.824 23581.938 UNK_851.5708@24.298 7763.0464 24644.824 14790.415 13242.655 UNK_851.6036@22.683 5358.569 16738.506 12669.686 10109.874 UNK_853.586@24.495 61107.668 186238.11 133138.86 112185.664 UNK_853.6631@25.368 8602.583 13759.865 16293.955 14320.226 UNK_855.6006@25.032 338817.88 971324.7 728610.9 615340.5 UNK_855.6805@26.068 25157.049 45126.86 43625.812 39929.797 UNK_856.4555@23.186 11853.011 12794.953 12640.351 11617.929 UNK_858.6834@26.523 281924.97 521507.66 564216.2 533132.8 UNK_860.6982@27.883 95691.25 107477.734 89963.03 108058.82 UNK_871.5553@24.422 51748.98 117709.53 108424.305 100482.38 UNK_872.6241@25.353 25356.252 32206.135 31777.307 28010.838 UNK_873.5715@24.845 131080.42 282032.97 268925.1 237795.3 UNK_874.6527@22.839 10712.117 9888.183 11452.277 10628.25 UNK_875.5871@25.493 23805.541 41669.625 35023.984 34269.145 UNK_878.531@24.039 42079.074 67867.65 70974.664 68499.29 UNK_880.5419@24.264 7875.029 10707.7295 14734.205 14079.358 UNK_882.3043@3.538 17199.984 21650.06 19620.033 17904.092 UNK_884.5476@24.041 61811.13 100661.3 98254.02 97293.35 UNK_894.5096@24.044 33971.695 57840.633 56794.426 52817.312 UNK_895.5553@24.365 84434.19 223016.9 178951.89 160885.9 UNK_897.5707@24.642 38031.426 118568.875 107001.67 93484.66 UNK_899.5859@25.104 78181.43 157744.77 154354.6 138251.27 UNK_900.6558@26.402 37717.14 41553.426 40303.684 47490.066 UNK_901.604@25.679 34556.1 79599.67 78399.69 61608.348 UNK_902.508@24.043 22049.564 36889.156 35299.023 32835.27 UNK_902.5476@24.633 9417.729 12985.524 13658.922 11411.667 UNK_907.5099@24.275 11769.095 22845.268 19094.898 19327.12 UNK_907.6266@23.705 6521.0415 8887.962 9688.778 7570.879 UNK_908.7353@23.183 7640.47 8859.953 11329.635 8185.5615 UNK_909.5319@24.700 27113.129 40801.85 36391.68 35942.47 UNK_915.5443@24.703 42153.812 73949.98 66658.26 63065.613 UNK_915.615@25.947 30714.21 38823.2 40194.645 40981.47 UNK_916.641@26.535 43980.12 71712.49 82320.45 66600.28 UNK_919.557@24.291 16171.079 50797.664 32933.562 26595.924 UNK_923.5863@25.033 123294.16 301001.06 241068.27 218212.33 UNK_924.6566@25.744 47135.797 91426.71 97793.43 94034.88 UNK_926.6705@26.524 98869.37 194222.88 197617.86 188000.23 UNK_928.6859@27.888 37286.598 36600.04 39454.637 42432.484 UNK_935.5418@24.841 28930.777 57479.78 56852.27 52104.086 UNK_936.3708@3.279 43468.027 57749.324 39709.773 34627.223 UNK_940.6093@25.365 13282.402 16701.402 21427.295 22360.105 UNK_941.6267@26.064 17956.006 32488.28 47418.684 37179.58 UNK_942.3884@3.277 38298.64 49339.816 35714.504 32664.627 UNK_942.4982@24.066 18352.31 27251.562 26010.617 25481.521 UNK_942.6366@22.842 9923.523 9837.833 11421.546 10637.125 UNK_944.6308@26.523 27803.31 43217.324 44809.71 49623.977 UNK_946.5177@24.045 33170.523 53113.574 53349.367 50375.285 UNK_952.5311@24.048 26594.752 36662.688 36204.734 36653.54 UNK_956.9804@0.587 88172.58 111575.71 117922.81 124290.305 UNK_957.5216@24.375 23916.715 48637.94 42336.383 37746.082 UNK_961.5503@25.108 17944.953 33527.33 36761.3 29852.123 UNK_962.6261@26.408 15893.117 18141.83 17864.484 18370.502 UNK_963.5406@24.367 32986.63 80511.68 62341.47 61885.48 UNK_968.6417@26.409 25858.438 23881.166 18816.09 21443.81 UNK_974.5379@24.607 15295.675 21104.486 19776.146 22184.592 UNK_977.5149@24.699 24134.041 39306.824 39274.516 33010.5 UNK_981.5398@25.050 54891.05 104846.555 79932.22 76949.03 UNK_991.572@25.038 50116.98 95149.21 90110.086 76213.75 UNK_992.6427@25.734 21474.445 41561.504 36252.67 38293.285 UNK_994.3283@3.281 33176.438 36916.87 31280.219 30174.021 UNK_994.6569@26.525 43528.848 64917.945 78143.83 81241.875 UNK_996.6664@19.909 62245.43 67574.15 71019.5 87144.27 URIC ACID (M-H)- 304547.75 289557.2 400042.28 172571.45 URIDINE (M+CL)- 5922846 10700000 7884783.5 5077067 URIDINE (M-H)- 274611.97 412473.97 377292.3 293920.12 URIDINE-5-MONOPHOSPHATE (M-H)- 3594.2593 5341.686 9998.429 3917.4404 XANTHINE (M-H)- 482043.22 538685 403831.7 471411.8 ZEATIN [ISTD] (M+CL)- 504246.12 544496.4 530337.7 625482.5 ZEATIN [ISTD] (M-H)- 156773.44 160183.39 150331.94 197156.98 metabolite_name moverz_quant ri ri_type pubchem_id inchi_key kegg_id other_id other_id_type 1-METHYLADENOSINE (M+CL)- 281.1132 2.992 27476 16:0 LYSO PC (M+CL)- 495.3334 22.265 460602 16:0-18:0 PC (M+CL)- 761.5963 25.507 18631368 18:0 LYSO-PE (M-H)- 481.3182 22.655 9547068 2-DEOXY-D-GLUCOSE (M+CL)- 164.0687 0.679 439268 2-HYDROXY-3-METHYLBUTYRIC ACID (M-H)- 118.0629 3.477 853180 2-METHYLMALEIC ACID #2 (M-H)- 130.0267 2.429 643798 24:0 SM (D18:1/24:0) (M+CL)- 814.6963 27.911 44260127 3-(4-HYDROXYPHENYL)LACTIC ACID (M-H)- 182.0578 3.695 440177 3-HYDROXY-3-METHYLGLUTARIC ACID (M-H)- 162.0521 1.528 1662 3-METHYL-2-OXOPENTANOIC ACID (M-H)- 130.063 4.42 440877 3-UREIDOPROPIONIC ACID (M-H)- 132.0516 0.881 111 4-ACETAMIDOBUTANOIC ACID (M-H)- 145.0733 1.78 18189 4-HYDROXYBENZOIC ACID (M-H)- 138.0316 4.065 135 4-METHYL-2-OXOPENTANOIC ACID (M-H)- 130.0632 4.819 70 5'-METHYLTHIOADENOSINE (M+CL)- 297.0902 4.435 439176 5-OXOPROLINE (M-H)- 129.0424 1.182 7405 ADENOSINE (M+CL)- 267.0962 1.749 60961 ADIPIC ACID (M-H)- 146.0607 3.557 196 ALPHA-HYDROXYISOBUTYRIC ACID (M-H)- 104.0473 1.631 440873 ARABITOL (M+CL)- 152.0661 0.673 94154 ARACHIDONIC ACID (M-H)- 304.2415 22.705 444899 AZELAIC ACID (M-H)- 188.105 10.809 2266 BENZOIC ACID (M-H)- 122.0366 4.944 243 BIOTIN (M-H)- 244.0883 6.301 11966127 CIS-ACONITIC ACID (M-H)- 174.0168 1.455 643757 CITRAMALIC ACID (M-H)- 148.0365 1.409 441696 CITRIC ACID (M-H)- 192.0276 1.03 311 DEOXYCYTIDINE (M+CL)- 227.0924 0.92 13711 DEOXYURIDINE (M+CL)- 228.0753 1.579 13712 DEOXYURIDINE (M-H)- 228.0745 1.537 13712 DOCOSAHEXAENOIC ACID (M-H)- 328.2417 22.684 445580 EPIBRASSINOLIDE [ISTD] (M+CL)- 480.3462 19.909 115196 GLUCONIC ACID (M-H)- 196.0579 0.69 10690 GLUCOSE (M+CL)- 180.064 0.666 5793 GLUTARIC ACID (M-H)- 132.0423 2.027 743 GLYCERIC ACID (M-H)- 106.0266 0.801 439194 HEPTADECANOIC ACID (M-H)- 270.2561 22.993 10465 HIPPURIC ACID (M-H)- 179.058 4.812 464 HYODEOXYCHOLIC ACID (M-H)- 392.2964 22.881 5283820 ISOCITRIC ACID (M-H)- 192.0273 0.797 5318532 ISOLEUCINE (M-H)- 131.0941 1.515 6306 L-TRYPTOPHAN-15N2 [ISTD] (M-H)- 206.0846 3.538 16217285 L-[15N]ANTHRANILIC ACID [ISTD] (M-H)- 138.0447 5.313 227 LINOLEIC ACID (M-H)- 280.2409 22.749 5280450 LYSINE (M-H)- 146.1054 0.51 5962 MALEIC ACID (M-H)- 116.0113 0.978 444266 MALIC ACID (M-H)- 134.0214 0.81 222656 METHYL BETA-D-GALACTOSIDE (M+CL)- 194.0802 0.735 94214 MEVALONIC ACID (M-H)- 148.0731 1.576 439230 MYRISTIC ACID (M-H)- 228.2089 22.447 11005 N-ACETYL-D-GLUCOSAMINE (M+CL)- 221.0907 0.676 446101 N-ACETYL-L-ALANINE (M-H)- 131.0572 1.44 88064 N-ACETYL-L-LEUCINE (M-H)- 173.1048 7.186 75619 N-ACETYL-L-PHENYLALANINE (M-H)- 207.0883 7.738 74839 N-ACETYLGLYCINE (M-H)- 117.0421 0.877 1097 N-ACETYLNEURAMINIC ACID (M-H)- 309.1053 0.676 444885 O-SUCCINYL-L-HOMOSERINE (M-H)- 219.0713 0.96 439406 OLEIC ACID (M-H)- 282.2566 22.926 445639 OROTIC ACID (M-H)- 156.0171 0.857 967 OXALOACETIC ACID (M-H)-[-H2O] 132.0033 0.513 970 PALMITIC ACID (M-H)- 256.2408 22.838 985 PALMITOLEIC ACID (M-H)- 254.225 22.618 445638 PANTOTHENIC ACID (M+CL)- 219.1114 3.271 6613 PANTOTHENIC ACID (M-H)- 219.1114 3.279 6613 PHENYLALANINE (M-H)- 165.0791 2.451 6140 PTERIN (M-H)- 163.0522 1.474 73000 PYRUVIC ACID (M-H)- 88.0164 0.729 1060 RIBITOL (M+CL)- 152.0661 0.673 94154 S-ADENOSYL-L-HOMOCYSTEINE (M-H)- 384.1185 1.463 439155 SALICYLATE #2 (M-H)- 138.0317 8.262 338 STEARIC ACID (M-H)- 284.2724 23.185 5281 SUCCINIC ACID (M-H)- 118.0265 1.33 1110 SUCROSE (M+CL)- 342.1222 0.672 5988 THYMIDINE (M+CL)- 242.0911 2.751 5789 THYMIDINE (M-H)- 242.0906 2.74 5789 TRANS-ACONITIC ACID (M-H)- 174.0165 1.231 444212 TRYPTOPHAN (2M-H)- 204.088 3.537 6305 TRYPTOPHAN (M-H)- 204.0923 3.538 6305 TYROSINE (M-H)- 181.0736 1.272 6057 UNK_116.0475@2.337 116.0475 2.337 UNK_120.0418@0.825 120.0418 0.825 UNK_135.9019@24.643 135.9019 24.643 UNK_146.0496@7.663 146.0496 7.663 UNK_146.0576@2.071 146.0576 2.071 UNK_148.0515@2.449 148.0515 2.449 UNK_154.0262@4.608 154.0262 4.608 UNK_169.9965@5.826 169.9965 5.826 UNK_173.9987@3.173 173.9987 3.173 UNK_180.0581@2.461 180.0581 2.461 UNK_188.882@0.480 188.882 0.48 UNK_189.1@2.413 189.1 2.413 UNK_189.9936@2.553 189.9936 2.553 UNK_190.0474@1.365 190.0474 1.365 UNK_192.0271@1.447 192.0271 1.447 UNK_197.0326@7.961 197.0326 7.961 UNK_201.056@2.454 201.056 2.454 UNK_202.0305@8.430 202.0305 8.43 UNK_202.0454@0.897 202.0454 0.897 UNK_204.0096@3.991 204.0096 3.991 UNK_213.0099@3.512 213.0099 3.512 UNK_213.9866@5.821 213.9866 5.821 UNK_214.023@9.429 214.023 9.429 UNK_214.8969@0.794 214.8969 0.794 UNK_216.0404@1.458 216.0404 1.458 UNK_219.1108@3.480 219.1108 3.48 UNK_219.1116@3.279 219.1116 3.279 UNK_223.0385@2.463 223.0385 2.463 UNK_228.9124@1.723 228.9124 1.723 UNK_233.0669@2.452 233.0669 2.452 UNK_235.1053@1.568 235.1053 1.568 UNK_236.0821@2.483 236.0821 2.483 UNK_239.0396@1.269 239.0396 1.269 UNK_239.0542@0.938 239.0542 0.938 UNK_239.0566@1.414 239.0566 1.414 UNK_240.0748@19.167 240.0748 19.167 UNK_242.0652@3.535 242.0652 3.535 UNK_243.1837@15.878 243.1837 15.878 UNK_244.07@0.917 244.07 0.917 UNK_249.122@2.450 249.122 2.45 UNK_253.8885@0.804 253.8885 0.804 UNK_254.099@1.471 254.099 1.471 UNK_255.088@3.476 255.088 3.476 UNK_256.9672@1.503 256.9672 1.503 UNK_261.0673@2.446 261.0673 2.446 UNK_262.0492@3.545 262.0492 3.545 UNK_265.1177@3.825 265.1177 3.825 UNK_266.1566@21.599 266.1566 21.599 UNK_266.9961@1.526 266.9961 1.526 UNK_268.0796@1.541 268.0796 1.541 UNK_269.9905@14.336 269.9905 14.336 UNK_271.0837@1.574 271.0837 1.574 UNK_272.0772@3.542 272.0772 3.542 UNK_272.2358@22.430 272.2358 22.43 UNK_272.939@5.299 272.939 5.299 UNK_274.0803@1.536 274.0803 1.536 UNK_276.0627@2.394 276.0627 2.394 UNK_277.07@3.276 277.07 3.276 UNK_277.084@1.291 277.084 1.291 UNK_277.9202@0.850 277.9202 0.85 UNK_282.1087@4.814 282.1087 4.814 UNK_288.0962@2.742 288.0962 2.742 UNK_288.9208@1.825 288.9208 1.825 UNK_289.8852@1.163 289.8852 1.163 UNK_290.906@4.820 290.906 4.82 UNK_291.9367@1.454 291.9367 1.454 UNK_294.0621@1.450 294.0621 1.45 UNK_294.0625@2.451 294.0625 2.451 UNK_294.0627@2.146 294.0627 2.146 UNK_294.1874@24.330 294.1874 24.33 UNK_297.1083@2.494 297.1083 2.494 UNK_298.0722@5.314 298.0722 5.314 UNK_298.2509@22.108 298.2509 22.108 UNK_298.8875@5.320 298.8875 5.32 UNK_300.2662@22.146 300.2662 22.146 UNK_300.9346@4.822 300.9346 4.822 UNK_300.9806@2.445 300.9806 2.445 UNK_301.0531@2.453 301.0531 2.453 UNK_302.225@22.508 302.225 22.508 UNK_302.2467@22.842 302.2467 22.842 UNK_304.0904@2.459 304.0904 2.459 UNK_305.1053@1.548 305.1053 1.548 UNK_305.9186@1.819 305.9186 1.819 UNK_306.2568@22.888 306.2568 22.888 UNK_306.9472@1.284 306.9472 1.284 UNK_307.9999@3.276 307.9999 3.276 UNK_309.8915@0.858 309.8915 0.858 UNK_311.1574@1.499 311.1574 1.499 UNK_317.1093@3.597 317.1093 3.597 UNK_318.0736@2.523 318.0736 2.523 UNK_321.8943@1.838 321.8943 1.838 UNK_322.922@5.318 322.922 5.318 UNK_324.2286@22.840 324.2286 22.84 UNK_325.1025@0.799 325.1025 0.799 UNK_325.9216@2.406 325.9216 2.406 UNK_326.1144@2.371 326.1144 2.371 UNK_328.1351@22.455 328.1351 22.455 UNK_328.2618@22.517 328.2618 22.517 UNK_330.2569@22.849 330.2569 22.849 UNK_330.2775@23.182 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UNK_453.2196@1.516 453.2196 1.516 UNK_455.0265@2.451 455.0265 2.451 UNK_455.1984@22.931 455.1984 22.931 UNK_457.2277@23.179 457.2277 23.179 UNK_458.0382@2.452 458.0382 2.452 UNK_458.1864@22.690 458.1864 22.69 UNK_460.2018@22.842 460.2018 22.842 UNK_460.2051@3.280 460.2051 3.28 UNK_460.2116@18.492 460.2116 18.492 UNK_461.2062@23.181 461.2062 23.181 UNK_462.1859@3.283 462.1859 3.283 UNK_463.2487@1.519 463.2487 1.519 UNK_463.3079@22.561 463.3079 22.561 UNK_464.1306@1.266 464.1306 1.266 UNK_464.215@22.703 464.215 22.703 UNK_465.3236@22.792 465.3236 22.792 UNK_471.0878@2.444 471.0878 2.444 UNK_472.0165@8.568 472.0165 8.568 UNK_472.1562@22.847 472.1562 22.847 UNK_474.2014@3.827 474.2014 3.827 UNK_474.2912@27.764 474.2912 27.764 UNK_476.0975@8.589 476.0975 8.589 UNK_476.174@22.683 476.174 22.683 UNK_479.3007@22.405 479.3007 22.405 UNK_480.2003@22.953 480.2003 22.953 UNK_482.1729@1.521 482.1729 1.521 UNK_482.1868@3.267 482.1868 3.267 UNK_482.2192@23.185 482.2192 23.185 UNK_485.1367@22.708 485.1367 22.708 UNK_486.2105@22.934 486.2105 22.934 UNK_486.2821@24.643 486.2821 24.643 UNK_488.1146@2.449 488.1146 2.449 UNK_488.1214@3.538 488.1214 3.538 UNK_488.2337@23.180 488.2337 23.18 UNK_491.134@3.280 491.134 3.28 UNK_492.2021@1.527 492.2021 1.527 UNK_498.0786@3.550 498.0786 3.55 UNK_498.1457@3.541 498.1457 3.541 UNK_500.1816@23.183 500.1816 23.183 UNK_501.0554@14.540 501.0554 14.54 UNK_501.2869@22.122 501.2869 22.122 UNK_505.2553@24.647 505.2553 24.647 UNK_506.9851@8.555 506.9851 8.555 UNK_511.0393@17.556 511.0393 17.556 UNK_511.0398@16.514 511.0398 16.514 UNK_515.2843@24.649 515.2843 24.649 UNK_516.172@2.361 516.172 2.361 UNK_516.323@19.566 516.323 19.566 UNK_517.0135@8.583 517.0135 8.583 UNK_517.1628@22.792 517.1628 22.792 UNK_518.1635@3.283 518.1635 3.283 UNK_524.1514@3.539 524.1514 3.539 UNK_526.1858@22.679 526.1858 22.679 UNK_526.3522@19.570 526.3522 19.57 UNK_526.3522@19.909 526.3522 19.909 UNK_527.3592@22.531 527.3592 22.531 UNK_528.121@3.277 528.121 3.277 UNK_531.0975@16.512 531.0975 16.512 UNK_531.1782@23.392 531.1782 23.392 UNK_531.1805@23.123 531.1805 23.123 UNK_532.2022@22.690 532.2022 22.69 UNK_532.3182@18.965 532.3182 18.965 UNK_537.032@14.542 537.032 14.542 UNK_539.0706@18.476 539.0706 18.476 UNK_539.2029@2.445 539.2029 2.445 UNK_540.1436@22.837 540.1436 22.837 UNK_541.3385@22.263 541.3385 22.263 UNK_543.249@24.642 543.249 24.642 UNK_544.089@8.606 544.089 8.606 UNK_544.1535@22.708 544.1535 22.708 UNK_544.1854@23.187 544.1854 23.187 UNK_547.0154@17.563 547.0154 17.563 UNK_547.1984@24.632 547.1984 24.632 UNK_548.1496@2.454 548.1496 2.454 UNK_548.3379@1.522 548.3379 1.522 UNK_549.3054@22.656 549.3054 22.656 UNK_550.1008@8.624 550.1008 8.624 UNK_550.1607@22.710 550.1607 22.71 UNK_550.1984@3.505 550.1984 3.505 UNK_550.2056@23.188 550.2056 23.188 UNK_552.196@24.641 552.196 24.641 UNK_553.2742@24.649 553.2742 24.649 UNK_555.1733@2.456 555.1733 2.456 UNK_555.2095@24.233 555.2095 24.233 UNK_557.2273@24.647 557.2273 24.647 UNK_558.148@23.185 558.148 23.185 UNK_559.1278@18.489 559.1278 18.489 UNK_559.3409@22.681 559.3409 22.681 UNK_565.2028@2.458 565.2028 2.458 UNK_565.3388@22.093 565.3388 22.093 UNK_566.9963@8.568 566.9963 8.568 UNK_567.3552@22.401 567.3552 22.401 UNK_569.3706@22.663 569.3706 22.663 UNK_570.154@8.548 570.154 8.548 UNK_572.5068@25.039 572.5068 25.039 UNK_573.4907@24.384 573.4907 24.384 UNK_575.0468@18.476 575.0468 18.476 UNK_575.2962@1.507 575.2962 1.507 UNK_575.5055@24.628 575.5055 24.628 UNK_578.2937@1.524 578.2937 1.524 UNK_582.131@2.446 582.131 2.446 UNK_582.5343@25.038 582.5343 25.038 UNK_583.5187@24.381 583.5187 24.381 UNK_585.2595@25.364 585.2595 25.364 UNK_585.5349@24.629 585.5349 24.629 UNK_586.1252@2.446 586.1252 2.446 UNK_587.1878@1.279 587.1878 1.279 UNK_589.3392@22.108 589.3392 22.108 UNK_590.1625@2.440 590.1625 2.44 UNK_594.1549@2.464 594.1549 2.464 UNK_594.1731@22.692 594.1731 22.692 UNK_596.4168@22.840 596.4168 22.84 UNK_598.1934@2.537 598.1934 2.537 UNK_599.0842@16.511 599.0842 16.511 UNK_599.2974@22.266 599.2974 22.266 UNK_600.5367@26.009 600.5367 26.009 UNK_601.1739@2.470 601.1739 2.47 UNK_601.5195@25.074 601.5195 25.074 UNK_602.5257@22.846 602.5257 22.846 UNK_604.378@22.845 604.378 22.845 UNK_605.2107@19.914 605.2107 19.914 UNK_607.1871@2.439 607.1871 2.439 UNK_609.3263@22.266 609.3263 22.266 UNK_611.5488@25.075 611.5488 25.075 UNK_612.4056@22.844 612.4056 22.844 UNK_614.4071@22.838 614.4071 22.838 UNK_616.1662@22.953 616.1662 22.953 UNK_616.1817@23.194 616.1817 23.194 UNK_616.4046@22.838 616.4046 22.838 UNK_627.2851@22.268 627.2851 22.268 UNK_627.3278@22.663 627.3278 22.663 UNK_633.3256@22.098 633.3256 22.098 UNK_635.3409@22.401 635.3409 22.401 UNK_637.3579@22.661 637.3579 22.661 UNK_639.4304@22.849 639.4304 22.849 UNK_641.1878@19.912 641.1878 19.912 UNK_650.2171@3.548 650.2171 3.548 UNK_653.3004@22.403 653.3004 22.403 UNK_653.4053@22.846 653.4053 22.846 UNK_654.4631@22.703 654.4631 22.703 UNK_655.315@22.678 655.315 22.678 UNK_656.2347@3.538 656.2347 3.538 UNK_657.3247@22.099 657.3247 22.099 UNK_657.5855@27.372 657.5855 27.372 UNK_658.5111@23.183 658.5111 23.183 UNK_660.4416@23.188 660.4416 23.188 UNK_660.5175@22.689 660.5175 22.689 UNK_664.422@22.837 664.422 22.837 UNK_666.1902@3.539 666.1902 3.539 UNK_667.2836@22.293 667.2836 22.293 UNK_667.6134@27.382 667.6134 27.382 UNK_668.4666@23.182 668.4666 23.182 UNK_669.4679@24.385 669.4679 24.385 UNK_670.469@23.184 670.469 23.184 UNK_671.2963@22.273 671.2963 22.273 UNK_671.4801@24.627 671.4801 24.627 UNK_675.2826@22.113 675.2826 22.113 UNK_677.3127@22.263 677.3127 22.263 UNK_678.4631@22.685 678.4631 22.685 UNK_679.3009@3.269 679.3009 3.269 UNK_680.3954@22.842 680.3954 22.842 UNK_682.2329@3.541 682.2329 3.541 UNK_684.2764@2.449 684.2764 2.449 UNK_685.4514@22.840 685.4514 22.84 UNK_685.6181@29.320 685.6181 29.32 UNK_689.2712@22.272 689.2712 22.272 UNK_693.6301@27.574 693.6301 27.574 UNK_695.275@22.269 695.275 22.269 UNK_695.2803@3.278 695.2803 3.278 UNK_695.4916@23.181 695.4916 23.181 UNK_695.6455@29.326 695.6455 29.326 UNK_696.5109@26.011 696.5109 26.011 UNK_701.1579@3.540 701.1579 3.54 UNK_701.2971@3.281 701.2971 3.281 UNK_701.5376@25.161 701.5376 25.161 UNK_705.3453@22.662 705.3453 22.662 UNK_711.2522@3.281 711.2522 3.281 UNK_711.2545@22.264 711.2545 22.264 UNK_713.3888@22.835 713.3888 22.835 UNK_714.2672@8.557 714.2672 8.557 UNK_716.4187@22.698 716.4187 22.698 UNK_720.4825@23.182 720.4825 23.182 UNK_720.5434@23.619 720.5434 23.619 UNK_723.3073@22.663 723.3073 22.663 UNK_723.4396@22.843 723.4396 22.843 UNK_723.523@24.624 723.523 24.624 UNK_724.2129@3.553 724.2129 3.553 UNK_726.4995@23.181 726.4995 23.181 UNK_727.3982@22.853 727.3982 22.853 UNK_727.552@25.344 727.552 25.344 UNK_732.2264@3.283 732.2264 3.283 UNK_734.4106@22.708 734.4106 22.708 UNK_735.5442@23.873 735.5442 23.873 UNK_736.4557@23.180 736.4557 23.18 UNK_737.4101@22.689 737.4101 22.689 UNK_738.4255@22.845 738.4255 22.845 UNK_738.5458@24.041 738.5458 24.041 UNK_739.2817@22.271 739.2817 22.271 UNK_745.5624@25.599 745.5624 25.599 UNK_745.5698@23.874 745.5698 23.874 UNK_746.451@22.694 746.451 22.694 UNK_746.56@23.725 746.56 23.725 UNK_747.5217@24.535 747.5217 24.535 UNK_748.5745@24.042 748.5745 24.042 UNK_749.5383@24.749 749.5383 24.749 UNK_750.375@22.848 750.375 22.848 UNK_750.5866@24.258 750.5866 24.258 UNK_751.5413@24.132 751.5413 24.132 UNK_751.5519@25.172 751.5519 25.172 UNK_751.5521@25.362 751.5521 25.362 UNK_753.4057@22.931 753.4057 22.931 UNK_753.5572@27.380 753.5572 27.38 UNK_754.2158@3.266 754.2158 3.266 UNK_759.255@3.289 759.255 3.289 UNK_763.2574@22.268 763.2574 22.268 UNK_764.5685@23.822 764.5685 23.822 UNK_765.5894@25.204 765.5894 25.204 UNK_766.5748@24.624 766.5748 24.624 UNK_769.5424@24.691 769.5424 24.691 UNK_775.211@8.564 775.211 8.564 UNK_776.6055@24.621 776.6055 24.621 UNK_777.5543@24.277 777.5543 24.277 UNK_779.5703@24.702 779.5703 24.702 UNK_779.5751@27.586 779.5751 27.586 UNK_779.5839@26.106 779.5839 26.106 UNK_781.5909@29.314 781.5909 29.314 UNK_782.217@8.561 782.217 8.561 UNK_784.1848@8.558 784.1848 8.558 UNK_785.404@22.697 785.404 22.697 UNK_788.4695@23.181 788.4695 23.181 UNK_791.5678@24.539 791.5678 24.539 UNK_791.6055@25.347 791.6055 25.347 UNK_795.5563@24.838 795.5563 24.838 UNK_799.4062@22.713 799.4062 22.713 UNK_800.3984@22.858 800.3984 22.858 UNK_803.5686@24.423 803.5686 24.423 UNK_804.6363@25.372 804.6363 25.372 UNK_805.5853@24.847 805.5853 24.847 UNK_806.421@22.752 806.421 22.752 UNK_806.4323@23.185 806.4323 23.185 UNK_806.5322@24.041 806.5322 24.041 UNK_807.6001@25.498 807.6001 25.498 UNK_808.5465@24.268 808.5465 24.268 UNK_813.1973@8.569 813.1973 8.569 UNK_813.5596@23.869 813.5596 23.869 UNK_813.589@24.779 813.589 24.779 UNK_814.5529@23.722 814.5529 23.722 UNK_815.1632@8.557 815.1632 8.557 UNK_815.5103@24.532 815.5103 24.532 UNK_816.5613@24.039 816.5613 24.039 UNK_817.4457@22.960 817.4457 22.96 UNK_817.5335@24.756 817.5335 24.756 UNK_819.1471@8.559 819.1471 8.559 UNK_819.6367@25.944 819.6367 25.944 UNK_821.5695@25.107 821.5695 25.107 UNK_822.6402@26.405 822.6402 26.405 UNK_824.6404@22.837 824.6404 22.837 UNK_827.4732@22.933 827.4732 22.933 UNK_827.5692@24.367 827.5692 24.367 UNK_830.2102@8.570 830.2102 8.57 UNK_830.6525@25.629 830.6525 25.629 UNK_831.5987@25.098 831.5987 25.098 UNK_832.6676@26.401 832.6676 26.401 UNK_833.6161@25.686 833.6161 25.686 UNK_834.52@24.043 834.52 24.043 UNK_835.5336@24.979 835.5336 24.979 UNK_837.5423@24.704 837.5423 24.704 UNK_839.6046@24.921 839.6046 24.921 UNK_840.18@8.560 840.18 8.56 UNK_840.3193@3.539 840.3193 3.539 UNK_844.2228@8.563 844.2228 8.563 UNK_844.5918@24.603 844.5918 24.603 UNK_845.5397@24.271 845.5397 24.271 UNK_845.5723@25.027 845.5723 25.027 UNK_845.6587@26.074 845.6587 26.074 UNK_846.6397@25.733 846.6397 25.733 UNK_847.5587@24.704 847.5587 24.704 UNK_847.6768@27.210 847.6768 27.21 UNK_848.6552@26.525 848.6552 26.525 UNK_850.2277@8.568 850.2277 8.568 UNK_851.5708@24.298 851.5708 24.298 UNK_851.6036@22.683 851.6036 22.683 UNK_853.586@24.495 853.586 24.495 UNK_853.6631@25.368 853.6631 25.368 UNK_855.6006@25.032 855.6006 25.032 UNK_855.6805@26.068 855.6805 26.068 UNK_856.4555@23.186 856.4555 23.186 UNK_858.6834@26.523 858.6834 26.523 UNK_860.6982@27.883 860.6982 27.883 UNK_871.5553@24.422 871.5553 24.422 UNK_872.6241@25.353 872.6241 25.353 UNK_873.5715@24.845 873.5715 24.845 UNK_874.6527@22.839 874.6527 22.839 UNK_875.5871@25.493 875.5871 25.493 UNK_878.531@24.039 878.531 24.039 UNK_880.5419@24.264 880.5419 24.264 UNK_882.3043@3.538 882.3043 3.538 UNK_884.5476@24.041 884.5476 24.041 UNK_894.5096@24.044 894.5096 24.044 UNK_895.5553@24.365 895.5553 24.365 UNK_897.5707@24.642 897.5707 24.642 UNK_899.5859@25.104 899.5859 25.104 UNK_900.6558@26.402 900.6558 26.402 UNK_901.604@25.679 901.604 25.679 UNK_902.508@24.043 902.508 24.043 UNK_902.5476@24.633 902.5476 24.633 UNK_907.5099@24.275 907.5099 24.275 UNK_907.6266@23.705 907.6266 23.705 UNK_908.7353@23.183 908.7353 23.183 UNK_909.5319@24.700 909.5319 24.7 UNK_915.5443@24.703 915.5443 24.703 UNK_915.615@25.947 915.615 25.947 UNK_916.641@26.535 916.641 26.535 UNK_919.557@24.291 919.557 24.291 UNK_923.5863@25.033 923.5863 25.033 UNK_924.6566@25.744 924.6566 25.744 UNK_926.6705@26.524 926.6705 26.524 UNK_928.6859@27.888 928.6859 27.888 UNK_935.5418@24.841 935.5418 24.841 UNK_936.3708@3.279 936.3708 3.279 UNK_940.6093@25.365 940.6093 25.365 UNK_941.6267@26.064 941.6267 26.064 UNK_942.3884@3.277 942.3884 3.277 UNK_942.4982@24.066 942.4982 24.066 UNK_942.6366@22.842 942.6366 22.842 UNK_944.6308@26.523 944.6308 26.523 UNK_946.5177@24.045 946.5177 24.045 UNK_952.5311@24.048 952.5311 24.048 UNK_956.9804@0.587 956.9804 0.587 UNK_957.5216@24.375 957.5216 24.375 UNK_961.5503@25.108 961.5503 25.108 UNK_962.6261@26.408 962.6261 26.408 UNK_963.5406@24.367 963.5406 24.367 UNK_968.6417@26.409 968.6417 26.409 UNK_974.5379@24.607 974.5379 24.607 UNK_977.5149@24.699 977.5149 24.699 UNK_981.5398@25.050 981.5398 25.05 UNK_991.572@25.038 991.572 25.038 UNK_992.6427@25.734 992.6427 25.734 UNK_994.3283@3.281 994.3283 3.281 UNK_994.6569@26.525 994.6569 26.525 UNK_996.6664@19.909 996.6664 19.909 URIC ACID (M-H)- 168.0283 0.99 1175 URIDINE (M+CL)- 244.0707 1.325 6029 URIDINE (M-H)- 244.0702 1.365 6029 URIDINE-5-MONOPHOSPHATE (M-H)- 324.0362 0.859 6030 XANTHINE (M-H)- 152.0333 1.249 1188 ZEATIN [ISTD] (M+CL)- 219.1127 3.826 449093 ZEATIN [ISTD] (M-H)- 219.1123 3.829 449093