Data for ST003408   

(Analysis AN005593): Average values per metabolite and experimental factor (Units:AU)

Metabolite structureAll dataF1F2F3F4F5F6F7F8F9F10F11F12F13F14F15F16F17F18F19F20F21F22F23F24F25F26
10,11-epoxychlorovulone
9650.25 8005.99 8273.54 7604.05 8644.64 12098.39 11766.83 10809.61 9743.29 7190.57 7319.30 7646.00 6770.75 612998.82 513772.67 747900.46 690612.21 728164.36 641162.16 1344349.93 1006798.35 1052174.25 1035384.81 780982.16 640737.86 578969.40
10-Deacetyl-2-debenzoylbaccatinIII
77129.85 142279.29 221450.96 95051.23 206758.24 300512.41 200743.28 112851.03 279833.18 98991.18 214241.63 191315.51 107242.56 468996.97 443834.74 443553.82 419583.73 619585.84 504567.74 491298.58 452398.18 517546.18 557517.38 498949.26 504276.51 500960.29
1,11-Undecanedicarboxylate
133181.95 95487.30 32821.52 29200.71 98465.27 185451.84 72775.97 83590.78 94579.84 117791.25 220412.50 132725.26 63447.38 512087.80 485562.11 533743.11 457805.14 596656.09 632390.74 526454.49 505760.13 557891.89 626353.42 727535.94 646699.32 513399.83
1^14-dihydroxyisochainin
11800.57 9639.24 12130.23 8599.75 10968.88 20356.39 20432.65 12628.41 14177.78 11729.49 9289.93 9106.81 7237.09 147409.81 139724.77 152040.02 130122.95 165023.05 212391.12 140582.55 138537.87 130062.26 158356.43 142111.40 157572.88 156754.99
11-beta-Hydroxyandrosterone-3-glucuronide
34563.54 35645.86 145107.69 28695.75 27322.59 19940.80 17810.73 15430.19 15196.87 9904.92 10897.86 11010.85 8948.88 7543725.09 7325538.79 7807313.68 6709265.94 8127325.90 9515801.78 7735825.63 6969778.83 7066882.09 7689434.67 7556098.48 8113036.66 7597462.15
11-Dehydro-thromboxane B2
11467.25 8925.39 10302.12 9051.41 9954.48 15210.80 15288.41 12403.41 12011.64 8634.33 8094.98 8451.19 7889.45 986928.21 1088558.34 1065316.98 896483.50 1346603.12 1108696.13 1266672.26 1315670.88 1512629.50 1396418.14 1187507.45 1174188.36 846419.63
1-(1-Hydroxybutyl)-1,3,4,5,6,7-hexahydro-2-benzofuran-4,5,6,...
12801.61 11525.15 23190.71 10245.37 11091.52 13389.05 13185.84 14254.74 13907.69 9757.06 10840.22 11073.19 9725.27 992891.46 636437.41 793786.04 1036496.95 1042848.67 1324560.73 740116.47 820088.73 667571.01 825046.82 558472.77 706867.85 795659.14
11-Hydroxyprogesterone 11-glucuronide
10711.34 8436.68 9762.09 8727.45 9496.60 14051.01 13978.80 11823.25 11566.13 8180.72 7878.28 13743.29 7350.37 1572099.52 1077584.05 1407609.46 1381017.12 1515212.05 1530492.88 1424610.31 1873818.96 1108679.67 1142814.71 1679484.90 1363977.61 1184322.26
11-Oxo-androsteroneglucuronide
12479.32 12811.14 30195.69 10100.63 11128.80 16261.81 16979.62 13737.98 13534.36 9467.88 9029.20 9811.18 8646.69 3644515.53 3683039.23 3952759.62 3627671.16 4316475.18 3781116.36 3341487.32 3647691.82 3597315.34 4070953.35 3755931.61 4033229.18 3719728.33
1,2,3-Trihydroxybenzene
47336.80 153090.60 65573.98 147435.30 89835.97 19865.10 56809.66 41270.52 66949.12 58916.88 59562.66 52194.23 76765.28 1344060.97 1088159.90 1285401.56 1448645.38 1352359.70 1299974.26 1717038.45 1073495.33 1284973.21 1000622.82 1474806.03 1049960.59 959179.51
12beta-acetoxy-3beta,28-dihydroxy-7,11,15,23-tetraoxo-5alpha...
11811.24 9803.17 12880.53 9732.65 16201.29 19651.07 21772.62 13627.10 15537.93 10629.91 10369.78 9632.36 8267.46 217253.00 216900.30 208820.21 215928.11 245353.99 264746.20 211781.34 248581.39 294618.92 251506.72 277495.56 254123.69 235918.29
12-Hydroxy-19-[(2Z)-4-hydroxy-3-methyl-2-buten-1-yl]-8,8,21,...
13557.63 12785.83 19184.62 11166.68 18531.70 28594.25 25934.31 16566.61 25821.79 11307.83 19336.16 14687.79 10266.81 142387.22 140751.18 222627.52 217207.80 291400.37 201703.91 68422.26 206895.87 87552.86 260911.69 255292.34 261071.30 276426.51
1,3,7-Trimethyluric acid
12916.55 50032.31 80451.54 12071.95 10796.23 13985.46 11719.63 12392.34 11838.21 8135.10 8863.62 9903.12 9260.98 3907714.98 4888676.40 5372561.68 4365201.52 5750158.64 5011291.35 6001540.07 4919896.30 4552613.52 4148836.73 4904590.00 4305938.24 3668783.96
1,3-Diacetylpropane
78829.05 41971.36 47152.41 35008.25 45240.71 25196.49 98341.35 42665.46 64291.10 39423.06 40584.79 43202.09 31687.33 2389053.51 1724472.40 2016747.96 1821915.30 1981177.81 2643236.97 2427056.04 1829629.47 2137383.19 2034765.81 1906613.28 1820912.85 1864654.19
1,3-Diisopropylbenzene
9394.56 7580.37 9749.30 7597.25 8012.41 12681.74 14929.71 11564.65 10980.28 11375.28 6225.51 6772.08 6304.61 728618.35 798400.95 835969.85 994110.16 1078226.92 1347942.81 1292264.78 1257455.49 1000787.63 944894.78 2318655.68 774387.26 1173245.90
1,3-Dimethyluric acid
110097.16 33132.36 103182.98 78364.51 58362.20 89128.68 19026.63 17780.66 16773.12 12279.03 11621.02 19735.38 13436.30 7375346.03 6365965.74 8123634.85 7744078.78 8303280.89 8983577.94 8293636.81 8373257.20 6765654.57 6900685.27 6850513.41 7067113.55 6332070.28
13-hydroxypalitantin
11543.00 11351.57 11862.35 9276.19 11855.30 21719.09 18608.91 13075.52 14078.84 8995.07 11766.13 11452.34 8525.16 1342373.55 1164959.03 1419959.03 1307346.47 1568047.73 1703483.21 1416796.61 1296221.27 1326593.20 1434351.85 1332690.06 1395063.44 1205266.73
13-hydroxystreptazolin
11607.38 7411.37 15830.77 9463.37 10294.05 10959.30 11836.32 12016.34 11432.72 7894.76 7941.80 9072.35 9065.95 359878.55 511650.19 535795.76 405202.13 519671.34 595451.15 550055.15 473879.52 415630.32 442562.63 424290.13 467914.92 371176.23
14-hydroxyisochainin
19467.50 17152.60 25261.12 14975.05 41805.04 46314.02 38144.38 21886.71 39187.29 16783.19 22825.17 18318.34 12222.62 294676.39 300351.73 322539.83 258743.00 390150.90 352750.98 363620.39 307079.92 287442.54 315883.21 348940.77 356213.28 292087.65
1,5-Anhydrosorbitol
71539.46 57505.13 151039.24 46548.46 60460.73 75715.73 90836.45 72492.54 71868.87 59045.21 75139.44 57528.55 34757.51 1771554.24 1955415.41 2423006.14 2279080.92 2667940.84 3171087.21 2297709.51 2308106.43 1702371.52 1921944.10 1960204.89 1997790.10 1939319.70
1,5-dihydroriboflavin
17794.43 15339.49 14218.75 13775.19 15580.11 19411.45 19991.02 20482.25 19342.51 13967.77 14534.15 14746.63 13305.10 913505.04 624227.12 802666.57 742089.33 791870.50 1203449.60 642178.74 632316.26 602332.84 740967.60 604833.97 710103.22 715425.50
15-Hydroxynorandrostene-3,17-dione glucuronide
10365.23 8378.12 8717.20 8549.56 9597.73 12298.66 12328.62 11636.39 11595.83 7884.59 11502.32 14409.46 8213.21 3304191.55 3502791.88 4305423.67 3447146.55 2913948.55 3818352.93 3548100.70 3600159.50 4084524.03 3809119.85 3335691.27 3447633.47 3515671.95
15-Keto-prostaglandin E2
10910.77 8484.04 10368.27 8657.20 9496.92 14716.92 15386.51 12218.99 11607.74 8130.04 7823.51 8170.07 7530.96 267245.54 282329.79 324165.94 269008.75 328443.52 310174.83 368537.58 326354.12 390714.68 435773.91 344680.21 306835.27 230412.92
16alpha-hydroxydehydroepiandrosterone 3-sulfate
35199.95 73749.01 146678.86 26998.12 23159.99 11511.71 11501.23 10566.17 9955.73 7376.11 7467.49 37401.21 7038.21 8735333.71 9626103.13 11702989.94 8619562.39 11317695.42 10798144.33 10742633.29 10796875.67 11283228.37 13336029.38 11706071.11 11608398.85 9216447.75
16-Hydroxy hexadecanoic acid
242283.40 189067.94 165606.65 142994.21 168712.48 155349.65 337549.01 79235.30 131223.62 202115.74 492043.75 218791.14 159546.19 331508.67 564459.28 893727.22 348713.16 607377.72 447956.84 618435.18 762473.80 513671.65 548698.63 1054113.47 356450.00 568998.21
16α-hydroxyprednisolone
11568.82 10200.50 10129.74 9186.77 10763.50 16891.69 15294.43 12858.75 12218.59 8875.32 9277.10 9264.25 8520.62 762529.50 700669.24 788096.23 810207.79 925801.55 872493.10 810119.31 885454.01 850688.92 894183.28 949247.48 853883.98 813106.61
1,7-Dimethyluric acid
104292.13 285568.92 639193.54 72800.80 57343.68 87465.52 15182.99 15421.56 15101.57 10170.72 10391.29 19132.00 11852.64 29637905.14 36824471.89 43380064.81 31170243.59 43758814.34 48191722.27 44377364.58 37156570.07 33602378.95 33722775.80 32776462.09 33113148.28 27668328.71
17-Hydroxyandrostane-3-glucuronide
11657.15 9917.79 14029.41 9315.39 13649.14 20963.07 21210.66 13633.93 17343.13 9326.43 11542.62 10715.02 8049.36 621672.68 624803.95 627332.78 551394.87 682963.83 749198.24 686204.68 553908.96 623799.96 700173.68 677466.14 720241.36 703414.53
17-Hydroxypregnenolone sulfate
11539.46 9250.96 9644.32 8983.20 10128.09 14233.59 14098.89 12867.53 12055.92 8726.50 8425.80 9081.51 7972.89 820815.88 754027.98 893202.72 738093.22 846259.13 989308.39 949276.90 937580.14 902246.10 1150791.92 1195095.33 1064204.49 751609.67
1,8-Diazacyclotetradecane-2,9-dione
9899.15 10136.15 11582.11 8499.75 10919.73 18259.76 15192.63 11758.28 14000.97 8367.38 10489.91 9943.22 8030.74 133380.29 107862.27 151229.81 114595.41 160221.57 167937.59 156867.66 138045.10 139603.70 139447.01 123400.56 140278.83 109679.87
18-Hydroxycortisol
11973.90 9067.55 10121.79 8986.93 9681.01 14729.09 14586.10 12998.09 12204.66 8756.87 8649.01 8705.56 7769.27 740523.47 671380.37 749985.99 738408.49 875225.76 830550.51 693564.01 787287.42 739103.29 797121.73 892345.25 828666.31 783206.65
19-methoxy-19,20-dihydrophomacin C
14151.56 16905.02 33763.49 8879.57 16289.57 22388.05 21865.68 13964.28 20480.16 10901.66 12128.90 10201.77 7680.79 3890155.44 4234285.28 4330434.15 4094600.84 4846071.05 4824900.84 4904560.55 5220472.79 4394800.59 4568617.25 5410333.84 5658890.16 4046617.66
1-alaninechlamydocin
10638.65 14806.37 9902.14 8504.60 9339.79 14216.00 13713.94 11808.67 10882.22 7927.64 7824.82 7937.27 7321.68 1635503.36 1462457.89 1525402.00 1374851.05 1568397.62 1977625.32 1463192.45 1435507.15 1389693.28 1487221.44 1501188.27 1666394.72 1546373.41
1b,3a,12a-Trihydroxy-5b-cholanoic acid
11613.54 12569.12 13205.51 9575.29 12607.61 18052.09 19355.12 14353.09 15011.53 11296.69 9348.41 8541.05 7884.16 171142.46 179796.50 161419.97 155480.45 243893.03 186729.86 199984.80 171470.38 212731.73 175690.07 233999.74 194396.19 163781.20
1b,3a,12a-Trihydroxy-5b-cholanoic acid_
10404.72 7643.91 9560.71 8032.68 8664.71 13604.29 14513.64 11063.84 10797.75 7634.66 7919.00 7578.44 6864.02 136569.11 151993.48 136816.02 129205.17 137202.49 152120.31 157614.87 148278.47 174451.99 139698.81 158418.27 162791.37 124738.29
1-(beta-D-Glucopyranosyloxy)-7-methyl-1,4a,5,6,7,7a-hexahydr...
26743.00 21365.85 91439.64 19390.57 21296.55 29365.32 25903.30 27176.91 26414.79 18116.56 20299.13 21040.46 19025.15 2078427.51 2248086.55 2431411.77 2117890.89 2331737.96 3020177.57 2407628.62 2085497.61 2285213.99 2245089.88 2122814.07 2808469.56 2006817.64
(1E)-1-(Allyldisulfanyl)-3-(methylsulfinyl)-1-propene
25080.85 54173.26 124502.13 25775.48 17917.89 26991.99 30219.94 30151.08 26300.25 20853.09 18446.96 19332.26 18550.32 2790994.32 6043524.57 5946228.58 3944605.27 6664396.20 5209732.00 5487515.13 4701325.97 4782798.07 3789668.14 6029157.49 5710261.14 3161544.15
1-hydroxy-2-hydroxymethyl-3-pent-1,3-dienylbenzene
11447.95 15672.27 32218.87 10043.84 10211.69 14440.25 14081.55 12823.29 11742.71 8661.02 8682.79 9070.34 7990.42 2664244.82 2064194.90 2488944.01 2744549.90 3530890.42 4481629.08 2719983.41 2387992.12 2030684.18 2178431.29 2652686.20 1933563.02 2925501.63
1-hydroxyhexanoylglycine
11248.22 10855.25 34712.83 8911.89 9782.55 13127.92 11550.92 11999.89 11281.19 7950.18 8696.33 9506.92 8782.29 993508.26 1267421.82 1481603.68 1086531.81 1430580.92 1967437.65 1644041.20 1162239.56 1092150.76 1094214.79 986969.11 1234605.84 1001550.26
1-Hydroxyibuprofen
9916.39 14548.55 19929.32 12930.61 9169.52 12490.87 12197.66 11107.73 10445.27 7547.84 7457.16 7856.87 10141.65 2981215.41 3356179.86 4931454.39 4125142.48 5800732.82 7492116.99 3365846.43 4198731.26 2856056.91 3540668.17 4586169.74 3459807.80 4236060.70
1^-hydroxyisochainin
19467.50 17152.60 25261.12 14975.05 41805.04 46314.02 38144.38 21886.71 39187.29 16783.19 22825.17 18318.34 12222.62 294676.39 300351.73 322539.83 258743.00 390150.90 352750.98 363620.39 307079.92 287442.54 315883.21 348940.77 356213.28 292087.65
1-Linoleoyl-3-glycerophosphate
9727.77 7776.41 9448.69 7535.20 8051.61 13351.31 15186.28 13957.03 11410.98 11518.64 6434.32 6638.20 6358.86 153677.31 207696.50 125850.53 172901.91 139058.08 150370.58 307640.10 506657.46 391016.52 149871.22 257893.86 112301.48 154745.88
1-Methylcyclohexanol
8979.62 7937.58 7822.88 7465.14 8465.08 10511.27 11045.44 10579.99 9859.05 7297.17 7297.23 7617.93 6775.33 247195.29 233571.24 459544.81 459283.33 522339.80 507446.01 410608.04 358464.96 333384.96 369376.36 329822.56 309539.36 241138.60
1-Methylguanine
15981.45 11228.37 27907.99 10309.55 10991.98 18454.21 19986.07 18894.11 17158.67 13010.55 12111.18 11400.55 11184.25 1105717.79 1490871.22 1546186.05 1230012.72 1588622.05 1616293.80 1946884.47 1313398.21 1571038.56 1219788.27 1368204.34 1501817.07 1136682.23
1-Methylguanosine
11341.92 7056.85 8627.45 9061.64 10152.66 12220.91 12738.68 12536.11 11597.08 8843.08 7225.44 8383.08 8793.18 276384.42 360021.28 332176.68 216413.73 343743.00 385511.26 339266.15 270547.85 299809.18 273803.03 231141.59 304856.73 248739.69
1-METHYL-L-HISTIDINE
119548.52 109165.34 427594.46 113180.15 57107.83 57415.24 40167.82 66094.58 49273.26 19300.27 36195.04 29548.88 45425.84 2351899.50 1992023.17 1638478.33 2081743.20 1717847.65 2105789.37 2830293.18 1874371.62 2370879.71 2075573.22 2179072.58 1753753.11 1866264.31
1-Methyluric acid
24768.46 97090.73 235112.83 34580.38 19280.46 28483.90 24412.60 24999.36 21736.44 16975.15 15095.63 16088.84 15380.75 6104798.68 7382051.13 10033829.54 7459341.82 10354969.63 10504993.18 8262497.47 6604835.28 6439400.81 6341428.66 5763493.05 7095726.35 6037994.44
1-Methylxanthine
39675.31 96348.01 135545.43 86953.79 276783.77 45375.53 30566.53 31670.50 61675.73 58371.99 47287.63 43683.29 41718.98 2942768.38 3929220.18 4667077.58 3599142.54 4769537.89 4550270.23 4647407.92 3282444.86 4121758.92 3275679.75 3744177.69 3733697.35 3153334.12
1-oleoylglycerone 3-phosphate
9727.77 7776.41 9448.69 7535.20 8051.61 13351.31 15186.28 13957.03 11410.98 11518.64 6434.32 6638.20 6358.86 153677.31 207696.50 125850.53 172901.91 139058.08 150370.58 307640.10 506657.46 391016.52 149871.22 257893.86 112301.48 154745.88
{(1S,2R,3R,6E,8S,9S,12S,14E,16R)-9-[(4,6-Dideoxy-3-O-methyl-...
49786.86 95965.22 190345.63 65154.27 155114.92 183991.92 151046.87 96999.81 221490.60 85086.73 155132.90 147786.65 82469.32 1566997.20 1958820.21 1617527.67 1794017.49 1784866.44 1740524.69 1698446.23 1991663.46 3035976.80 2739708.32 2052303.17 1782932.99 2115731.55
1-Thio-beta-D-glucopyranose
28443.07 19074.88 20762.81 17846.47 12213.53 27467.52 27594.82 27378.26 27257.32 18143.05 19559.76 22855.58 18588.01 519818.36 417059.07 627178.84 604918.97 595905.41 816195.80 638596.66 689816.74 452077.13 525132.09 497097.74 518928.70 436544.24
20-beta-Dihydrocortisol
8115.45 6934.51 7084.61 6525.99 7449.32 10439.39 9914.23 9034.97 8327.51 6445.33 6339.02 6545.78 5884.88 59508.14 50639.52 45100.49 43163.78 40898.39 49256.19 72439.44 53156.15 76625.81 56771.44 70323.65 52339.09 49016.57
(20S,22S,25S)-22,25-Epoxyfurost-5-ene-3beta,26-diol 3-O-beta...
12283.76 9263.41 11517.68 9236.43 9608.12 14891.60 18685.01 19193.30 14573.94 15440.17 8779.92 8340.18 7485.86 128646.42 129908.76 128700.76 98411.82 175261.32 171612.33 137803.77 127101.10 118030.95 152243.73 158303.07 149324.66 112335.01
2-(1-Propen-1-yl)-4-hydroxymethyl-3-furanylcarbonyla-L-Rhamn...
17942.75 19199.74 18714.27 13960.44 18111.80 37058.79 30481.98 20167.06 24981.58 13811.04 17999.75 19236.78 12636.54 988411.58 933533.01 1274533.57 1082546.40 1169943.03 1480069.90 1089603.12 1005438.78 1169917.03 1124305.13 977430.87 1063776.23 1413805.57
2-(2-Phenylacetoxy)propionylglycine
9376.04 9935.67 7807.71 7427.27 8373.10 10184.36 10799.19 10734.74 9988.12 7377.61 7930.80 8014.16 7438.00 725357.19 758949.62 864277.93 780373.92 847430.53 950817.90 824628.06 753455.86 740808.54 807346.45 748279.03 811962.69 778252.65
2-[(2R,4aS,6S,8aS)-6-(beta-D-Glucopyranosyloxy)-4a-methyl-8-...
8334.14 8533.67 8767.78 7087.65 9105.13 12747.70 12790.74 9899.35 10232.58 6546.94 8630.81 8371.24 6107.30 284561.18 284740.44 461200.28 386083.86 428056.93 326779.69 420068.50 393536.14 452855.47 414739.84 282660.40 330615.81 312431.27
2-(3,5-Dihydroxyphenyl)ethanol sulfate
27187.83 17750.48 23330.40 20815.18 23971.84 30334.87 33460.32 32992.46 29132.85 23197.18 19054.57 21752.74 21370.46 1586456.09 3393188.65 2554852.67 1489215.01 3008368.12 2926349.12 3476407.21 2767524.82 3134267.13 1950238.93 3214037.08 2825759.49 1656018.68
2-(3,5-Dihydroxyphenyl)ethanol sulfate_
13586.77 10632.50 18571.50 11043.47 12028.80 12801.02 13812.64 14198.37 13341.65 9297.53 9286.94 10555.63 10579.70 2227385.32 2692973.37 2424715.87 1739804.43 2322514.41 2802353.70 4503337.76 2183499.95 2686703.20 2374901.81 2648689.18 2179768.49 1620977.54
2-{[(3alpha,5beta,7alpha)-3-Hydroxy-24-oxo-7-(sulfooxy)chola...
19778.70 14921.91 18403.36 15432.73 16847.80 25884.44 27924.54 21491.03 20735.46 14698.33 15243.24 14587.69 13306.54 1122987.77 1086478.89 999983.50 876034.64 1663309.30 1226893.45 1203463.73 1068099.60 870974.45 1264819.93 1529293.89 1420151.86 894758.56
2,3-Bis(octanoyloxy)propanimidic acid
10763.01 8515.16 10084.23 8774.46 9939.69 14608.39 14349.46 12307.73 11456.52 8077.73 7964.63 8452.49 7523.53 52213.76 88011.10 119033.78 97486.15 167465.72 108197.19 70606.55 106657.50 60267.86 99720.17 67231.05 103191.00 78972.84
2,3-didehydro-19alpha-hydroxy-14-epicochlioquinone B
10040.52 8469.54 10921.16 7823.73 10201.32 16607.39 18103.83 11280.15 13888.04 8088.75 8652.68 8620.93 6801.48 161674.89 154530.12 223075.46 163016.97 199027.75 183314.71 208166.77 167292.67 135075.19 130751.34 157060.89 175028.11 158338.00
2,3-Dihydrobenzofuran
9757.63 7892.00 8359.58 7703.91 8999.32 12408.87 10458.73 10757.37 10593.36 7284.89 8398.60 9132.03 7493.73 320505.61 280143.82 261710.26 252057.06 244964.71 344872.72 426843.36 249093.08 381071.57 332217.87 360501.91 270819.44 253899.63
2,3-dihydropyrenophorolic acid
9427.90 24059.63 22219.04 7597.11 14695.36 10790.66 11242.25 10987.83 9756.76 8244.35 7415.16 7733.48 7055.19 1378689.17 1166935.66 1411779.68 1196061.26 1603799.27 1924950.80 1477992.48 1176354.74 1234848.12 1353009.91 1459344.65 1409679.08 1158560.63
2,3-Dihydroxypropyl octanoate
11272.56 11542.44 11859.09 9693.81 12315.38 17242.24 17300.45 13389.62 13840.35 9528.27 11673.83 11322.74 8260.58 517338.18 518719.26 636841.51 564411.85 680553.73 706986.41 654117.52 596330.22 567100.89 651212.50 536860.31 597184.79 516838.47
2,3-Methylene suberic acid
68360.42 85144.26 335045.13 97357.18 124543.02 32489.24 32070.92 19061.64 79768.04 37729.86 20789.39 56423.22 39501.25 12770418.29 11085260.56 17252061.28 13199189.74 18067450.83 19325093.52 13389490.87 13736000.36 12574463.85 14799465.19 11545209.43 13772365.22 11990116.78
2,4-Dihydroxybenzophenone
236349.35 443821.72 512831.30 480343.53 471258.65 346045.08 564331.07 709914.52 616736.35 744196.12 592809.55 527132.59 512657.72 507296.46 544760.83 640429.69 748059.90 664099.93 402664.56 760682.24 861390.66 846445.38 780143.73 705168.86 597145.81 843051.17
2-[4-hydroxy-3-(sulfooxy)phenyl]acetic acid
21818.55 17946.76 43654.67 14369.29 14905.91 26134.98 28460.02 26438.63 24274.50 18542.38 17659.97 17006.63 16342.96 2924580.90 3280038.48 5113834.44 4248204.51 5731708.66 4820777.44 3240471.99 3528397.72 2948381.88 2899973.31 3249962.97 2625861.78 3000445.12
2-[4-(Hydroxymethyl)cyclohexyl]-2-propanyl hexopyranoside
13481.92 11536.62 16225.53 10773.59 15785.73 24433.98 24530.91 15768.15 20435.05 10786.36 13433.03 12392.32 9341.99 207158.74 212850.14 249971.46 221244.55 275924.75 282807.90 257196.02 189191.44 201474.03 244941.49 238290.65 244125.83 209143.24
2,5-diamino-6-(5-phosphono)ribitylamino-4(3H)-pyrimidinone
25474.42 17084.00 18237.76 15983.80 10938.78 24600.69 24714.70 23686.19 24412.43 16249.43 17518.28 20470.10 16647.95 594965.07 473211.11 507637.93 574993.46 518582.83 419089.31 537321.51 609652.73 440300.04 561150.50 386466.59 544983.97 510242.03
2^,5^-Dihydroxy-4,3^,4^,6^-tetramethoxychalcone
9333.77 7919.25 7958.06 7586.46 8576.32 11725.61 11617.60 10501.54 9712.79 7073.98 7499.38 7526.50 6833.11 290322.90 342040.61 351260.11 371650.51 370140.10 374023.32 339980.49 304756.19 322438.99 361428.16 319252.98 336505.03 331382.08
2,5-Dihydroxybenzaldehyde
29336.36 36560.70 76401.27 29173.76 43000.55 24799.18 24914.11 24718.59 24609.40 16380.54 17659.62 20635.27 16782.27 1057928.99 1057971.32 1243824.61 1221223.01 1371279.73 1529895.79 1252636.44 1349566.25 1017552.76 1223946.25 962522.05 1140718.35 1095187.18
2,5-Furandicarboxylic acid
67192.09 50068.77 108618.66 56698.54 39095.92 68510.64 82374.96 67357.27 68700.19 52577.14 59044.42 52401.38 37185.06 2903360.52 2318218.47 2676844.11 2741589.77 2761509.09 3287443.66 3969572.08 3175952.08 3121817.97 2952257.19 1744743.50 2899675.27 2471101.74
25I8391P98
9664.54 7999.06 7781.47 7637.50 8625.77 10734.32 11064.48 10704.12 10331.63 7512.38 7895.19 7926.28 7218.78 375786.93 313196.03 280549.74 455461.71 455671.95 915814.70 404269.74 272005.31 324736.37 495765.40 338527.98 260090.42 794329.40
2,8-Quinolinediol 2-sulfate
11800.68 7529.82 8260.40 9703.19 10447.52 11118.23 11958.31 12004.58 11695.62 8075.30 8066.10 9014.93 9162.31 194844.49 196931.74 132344.52 155361.63 141854.76 271884.43 340136.19 317344.09 269271.86 212213.36 175480.02 228258.16 173921.56
2,8-Quinolinediol 8-sulfate
11800.68 7529.82 8260.40 9703.19 10447.52 11118.23 11958.31 12004.58 11695.62 8075.30 8066.10 9014.93 9162.31 194844.49 196931.74 132344.52 155361.63 141854.76 271884.43 340136.19 317344.09 269271.86 212213.36 175480.02 228258.16 173921.56
2-Acetamido-4-O-[2-(carboxyamino)-2-deoxy-beta-D-glucopyrano...
10176.05 7489.27 7833.84 7973.46 9049.17 10614.77 10401.98 10849.09 10500.54 7451.50 7734.46 8300.96 7672.68 222865.15 335236.28 347299.03 235064.33 337492.04 404540.82 346436.38 266898.78 308409.15 268279.48 236642.67 302343.74 228415.78
2-Acetolactate
123932.28 244345.32 390133.88 102567.32 385440.20 170498.88 135386.58 202280.96 118574.48 214257.88 93516.19 250380.28 157756.44 2259896.47 2133120.87 2533136.17 2235422.34 2466200.12 2761702.28 2935061.53 2268771.25 2523297.47 2319954.42 2206591.58 2300860.62 2165720.01
2^-amino-2^-deoxyadenosine
11767.43 11572.28 11607.58 9456.55 11918.72 22141.38 18970.72 13329.74 14352.58 9077.46 11994.90 11675.01 8690.92 269055.05 253152.54 340851.04 316555.30 414512.00 264999.63 344716.12 337398.29 373781.17 315169.97 232800.32 234813.77 258707.84
2-amino-8-oxo-9-hydroxydecanoic acid
21714.24 16815.99 18352.97 15094.81 17200.06 31534.27 27281.03 23368.12 22933.75 15314.44 16393.32 17351.22 13550.35 1203975.92 1064305.12 1241633.47 1202110.03 1318180.90 1284359.72 1188641.32 1232136.67 1094001.12 1130515.80 1275251.06 1111375.95 1070158.80
2-aminophenol sulphate
52164.98 35273.13 71738.47 31560.01 10872.59 22614.37 17213.51 16041.91 15767.60 11322.46 10792.93 9615.77 9076.35 3309728.53 3858682.63 5834234.47 5313020.48 6678172.50 6566384.59 6476404.40 4999305.84 4818398.69 4445720.83 4919541.38 5708149.51 3890256.97
2-Butylfuran
8546.39 8194.52 8103.82 7119.80 8073.27 10301.32 10420.45 10329.03 9234.03 6962.66 7241.39 7087.74 6815.42 439346.73 379149.53 492493.87 414545.11 488300.70 568033.50 449377.41 405225.90 438351.59 473491.88 398555.01 442278.17 407403.82
2-Dehydro-3-deoxylaetiporic acid A
13894.38 10201.32 12964.91 10580.78 11698.13 18517.13 20852.93 14949.69 14398.29 10142.31 10554.18 10280.16 9014.57 350326.44 367367.16 364983.15 368348.30 443664.76 397503.11 613699.75 692458.02 672294.20 632339.00 751556.19 437199.04 449361.01
(2E)-2-Methyl-3-phenyl-2-propen-1-yl hydrogen sulfate
9466.29 9309.30 11389.80 7487.94 9722.40 17811.59 15260.96 10491.35 11545.90 7376.76 9649.28 9391.94 6991.39 1270040.16 1016240.67 1426896.78 1096636.98 1438975.82 1695458.17 1841425.89 1484493.23 1679112.74 1670400.21 1600530.77 1449585.18 1047345.20
(2E)-4-(2,4-Dihydroxyphenyl)-2-methyl-2-buten-1-yl hydrogen ...
10330.49 8531.45 8383.84 8203.71 8910.31 10861.33 10553.79 11687.67 11163.11 7812.71 8680.02 8866.57 7993.23 616842.41 612597.83 658531.94 548246.78 710841.43 902852.19 881641.62 714969.21 747502.04 681085.12 726076.32 645404.20 518077.25
(2E)-4-(2,6-Dihydroxyphenyl)-2-methyl-2-buten-1-yl hydrogen ...
9718.05 8108.14 7962.68 7673.20 8663.24 10583.42 10885.42 10996.47 10318.84 7585.23 8065.82 8279.53 7781.37 377915.77 196282.83 234394.85 232637.54 275279.93 350230.72 295368.15 257958.09 229114.83 267345.03 250515.01 276046.88 213524.48
(2E,4E)-2,4-Heptadien-1-ol
17184.37 8568.18 15873.56 7584.48 19529.18 85932.36 15243.99 10117.84 11949.73 9107.22 25177.89 13568.05 6778.39 1047220.21 937892.38 1134881.27 1204612.37 1414711.34 1394890.82 1043323.58 995018.03 971225.09 1175932.13 931194.93 1073752.98 1009051.56
(2E)-5,7-Dihydroxy-3,6-dimethoxy-4-oxo-2-phenyl-4H-1-benzopy...
10122.07 7822.04 8816.05 8038.06 10087.76 14606.26 12124.41 11038.90 10904.00 7498.09 9273.34 9137.18 7793.90 241732.52 402406.53 495322.15 313417.79 478163.21 386303.36 740544.75 380783.69 527386.89 491577.16 329434.85 427431.36 329687.74
(2E,5Z)-2,5-Heptadien-1-ol
17184.37 8568.18 15873.56 7584.48 19529.18 85932.36 15243.99 10117.84 11949.73 9107.22 25177.89 13568.05 6778.39 1047220.21 937892.38 1134881.27 1204612.37 1414711.34 1394890.82 1043323.58 995018.03 971225.09 1175932.13 931194.93 1073752.98 1009051.56
(±)-(2E)-Abscisic acid
11727.67 12125.16 12021.06 9161.09 11458.67 24443.16 19269.45 13288.97 15997.17 9191.62 12023.60 12014.41 8251.24 182831.92 209144.95 211948.22 216250.80 331462.53 215061.77 229253.99 201629.11 162136.26 218698.53 233644.17 191480.20 242340.56
2-ene-Valproic acid
21926.18 37335.21 75761.59 12727.39 14718.06 13802.24 14826.96 20672.05 14853.15 12502.95 12099.40 10413.04 9482.33 2504601.55 2463860.13 2896253.41 2429235.87 2965303.25 3074650.33 2974270.36 2546551.36 2847664.62 2776489.76 2483032.15 2709172.01 2342690.74
2-Formylglutarate
40248.95 206514.04 222841.91 155191.48 168972.89 120993.79 175281.57 69600.90 110913.76 84566.50 74483.82 96385.35 74520.83 842300.99 920248.40 1059722.44 984563.53 1157739.91 1552360.47 1120840.42 1024358.38 917826.94 902858.08 952015.62 917849.46 778828.40
2-Furoic acid
786878.32 291976.88 1324922.10 622377.29 214132.24 199444.78 387505.22 193280.48 116763.71 261638.00 141166.44 464798.93 190497.35 116382935.07 74265170.17 98345037.35 90826686.89 95910205.15 126054883.13 134471881.14 106132392.72 103894294.55 98550938.82 73747852.48 90446262.94 91649970.76
2-Furoylglycine
53171.28 269209.26 297172.93 135703.01 161986.26 84167.74 22789.35 34307.52 43317.32 59993.85 44055.02 57246.82 111474.85 5786798.24 6129837.71 7482576.44 6490402.92 8074552.78 9048744.52 6913513.65 6412883.79 5693922.06 5184636.29 5181458.84 6005423.38 5867884.37
2-Hepten-4-one
17184.37 8568.18 15873.56 7584.48 19529.18 85932.36 15243.99 10117.84 11949.73 9107.22 25177.89 13568.05 6778.39 1047220.21 937892.38 1134881.27 1204612.37 1414711.34 1394890.82 1043323.58 995018.03 971225.09 1175932.13 931194.93 1073752.98 1009051.56
2-Hexyltetrahydrofuran-4-yl acetate
149502.87 109582.80 168577.15 83333.78 116174.11 113127.59 164464.93 100377.13 155783.09 130621.21 105068.39 102548.25 96351.13 1368302.76 1497019.11 1487593.20 1387527.32 1807747.08 1536634.56 1884791.07 1512887.89 1592547.88 1603311.06 1624042.65 1579685.44 1379543.17
2-Hydroxy-1,4-benzoxazin-3-one sulfate
21060.03 15073.06 12834.05 13976.67 14261.15 25087.34 27470.60 25374.71 23536.50 17897.75 17046.02 16415.39 15685.14 698284.04 1469507.64 1039687.63 958173.30 1220067.47 1342677.04 1419838.29 1202672.51 1384923.72 903202.38 1552792.80 1178488.25 739232.90
2-Hydroxy-2,4-pentadienoate
175649.70 275136.17 409463.75 224112.56 1060482.74 187853.37 291023.06 172486.70 236542.45 195358.38 205047.06 224595.35 250755.36 2548416.31 1811184.02 2603335.94 2576797.10 2848086.29 3718068.73 2344059.54 2034004.15 2700579.56 2045996.80 2235153.23 1541510.12 1999162.11
2-hydroxy-3-methoxy-8-methyl-1-O-beta-d-glucopyranosylnaphth...
14524.94 11689.88 12327.91 11307.32 12748.42 18047.75 17746.54 16196.60 15175.01 10984.20 10734.50 11609.11 10287.54 538630.88 544370.25 624196.26 555911.66 736833.56 780299.27 573974.69 550315.65 557620.12 648985.27 592052.52 618624.95 517747.88
2-Hydroxy-5-[3-(4-methoxy-1-benzofuran-5-yl)-3-oxopropanoyl]...
18928.73 18035.43 11148.13 16533.32 11743.16 21573.07 28784.08 20886.39 22783.22 17974.32 26054.47 16773.39 13787.86 8845816.57 7394090.54 9395012.02 6832387.79 7135560.93 8828769.32 8689815.08 5792913.53 5132330.11 5171602.37 6506089.59 6268342.45 7489423.22
2-Hydroxy-5-vinylphenyl hydrogen sulfate
9837.82 23885.25 19271.64 7825.14 9070.88 10409.16 10457.80 10989.82 10202.23 7201.66 7898.32 8323.20 7853.62 4001132.72 4949159.96 5818071.35 4744014.49 6545808.45 6430224.17 7405040.23 5131381.61 5504675.06 6017191.86 5430272.08 5486110.16 3922698.96
2-Hydroxy-5-vinylphenyl hydrogen sulfate_
11045.10 6858.79 26698.91 8719.75 9388.97 10055.42 10475.88 11298.48 10776.47 7430.22 7569.50 8832.97 8403.49 1743243.82 1856805.33 2095334.30 1860891.17 2132203.08 2552241.72 2689835.35 2054886.28 2061642.94 2128438.35 2441127.89 1839874.00 1581587.19
2-Hydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one
28653.26 40258.55 37909.53 40137.24 97151.37 12489.00 20497.34 11531.45 22140.54 33917.65 20149.72 22234.84 35006.24 519100.85 480359.93 778027.28 644487.81 843848.72 1037410.78 536531.89 582609.76 554946.22 680170.31 448998.09 595941.13 543194.05
2^-Hydroxyacetanilide
167876.57 340298.01 278100.01 403037.80 371569.77 168513.59 170226.60 249902.56 468050.82 270945.17 352067.09 236469.57 367674.49 2209912.86 4087933.06 3334149.00 2924616.80 3309083.83 3281414.23 4902391.56 3485556.28 5032145.58 3336223.15 3334085.03 2615483.00 4726142.32
2-Hydroxyadipic acid
289761.83 487034.22 702916.97 485762.78 553343.75 461428.89 477651.87 348050.47 414306.64 338991.62 265106.19 341053.11 635199.87 8306383.64 6908460.70 9796032.45 9448316.10 10033511.13 12361592.82 9462098.85 9657983.63 7694097.57 8303737.76 7506393.66 6954497.74 6902977.63
2-HYDROXYBUTYRATE
284702.34 251403.45 452895.77 247576.11 236063.94 206869.29 218975.47 227878.00 224922.62 182453.43 194007.39 192383.00 146281.46 13589187.92 7853530.55 12320038.33 11147003.24 12754123.15 15563551.74 12631983.34 11259094.19 10427295.59 10812991.81 8502414.62 8849940.10 8925723.43
2-HYDROXYBUTYRATE_
517313.02 701387.96 811631.70 642933.85 721528.59 573171.68 683060.87 651308.75 514724.04 549551.58 546731.68 534168.64 528183.11 17546847.44 14498580.96 20796199.13 16418661.79 20947131.56 25177666.83 21823673.16 16464514.95 16657760.13 14563531.82 13505047.39 14774242.91 13346328.90
2-Hydroxycaproic acid
92334.46 90477.04 82735.75 69607.56 114660.34 50416.41 121263.97 85743.04 494410.74 81607.08 76889.56 67350.56 73047.88 1115540.84 904136.52 1164430.29 1112096.26 1145266.31 1400625.82 1237921.84 1159092.11 1047767.91 1123867.36 985567.77 972064.64 927978.95
2-Hydroxydecanedioic acid
35436.77 12777.33 40471.54 18426.10 39125.98 12853.82 21109.84 14432.54 16321.12 9629.62 9749.83 9992.49 9739.52 2572786.55 1863108.85 3137113.43 2608368.00 3230561.56 4399621.53 2384384.47 2171782.75 1976319.57 2562198.54 1987580.99 2566774.86 2423938.15
2-Hydroxyestrone sulfate
9730.13 8163.24 8020.57 7907.09 8881.23 11144.20 11184.23 10836.48 10263.74 7794.02 7932.89 13506.31 7697.12 1999592.64 1404215.62 2044036.27 1975794.58 1315219.94 2267958.23 1749622.29 2458858.09 2059728.69 1821485.26 2561340.22 1585618.25 1378960.15
2-Hydroxyethanesulfonate
448004.91 374641.23 970062.60 314328.04 236866.58 177253.69 132965.11 129597.91 213185.18 83405.04 91192.94 108548.73 84785.89 4418621.71 4217875.98 4330729.64 4036182.09 4287075.98 4652745.34 5962964.20 4702991.68 5181839.19 4246276.67 4343418.88 4136963.03 4426193.36
2-Hydroxyglutarate
539379.53 1293309.49 1125839.35 809575.19 827833.82 675449.87 920368.52 309415.27 428852.76 606874.26 633935.23 745780.98 238289.02 16340247.97 10547144.66 17146326.02 17231364.59 17433585.25 22070458.76 16011225.73 15961360.05 12228657.09 14595530.58 11902133.43 13724778.63 13487746.53
2-Hydroxyibuprofen
9916.39 14548.55 19929.32 12930.61 9169.52 12490.87 12197.66 11107.73 10445.27 7547.84 7457.16 7856.87 10141.65 2981215.41 3356179.86 4931454.39 4125142.48 5800732.82 7492116.99 3365846.43 4198731.26 2856056.91 3540668.17 4586169.74 3459807.80 4236060.70
2-Hydroxyphenylacetic acid sulfate
12308.14 42551.84 12895.33 8237.42 10760.38 9408.00 9808.51 10228.78 10179.52 6738.67 7200.66 8173.19 7835.82 6151881.84 8512196.50 9446616.13 7605423.26 9343971.91 11891174.33 12830320.82 8140191.24 9875700.99 10317856.21 7199267.00 8663275.67 7078391.99
2-HYDROXYPYRIDINE
42638.49 101635.31 110769.40 145913.40 113541.38 64613.36 78792.56 75567.28 55319.08 76834.28 71215.51 49833.87 115572.26 1151170.99 1058172.16 1554371.33 1309327.23 1651804.19 1955676.90 2122786.77 1483621.87 1582603.72 1280629.60 1336399.50 1517260.12 1182610.16
2-Isopropylmaleate
106217.02 148869.09 228247.11 120154.00 152550.97 440613.19 115063.98 103591.29 111153.74 98101.28 87881.42 87029.69 113838.87 5626792.46 5646208.89 6675459.61 5316736.27 6514553.37 9050243.81 6311878.86 5728776.30 5265767.07 5832590.19 4619030.24 5200864.34 4376801.27
2-Isopropylmalic acid
18800.50 16042.86 50330.61 15691.58 17057.93 18816.42 18819.65 19264.18 18944.96 12687.10 13710.70 15244.65 14802.18 5439160.80 8038903.40 8591199.40 5751481.27 9062354.48 11564493.09 6743380.46 5473563.88 4006040.60 4915801.46 4677591.10 6044318.31 4558394.66
2-Keto-3-deoxygluconate
112590.83 114160.15 473421.40 124883.74 86119.85 140116.65 136080.90 123625.77 118540.63 89770.81 101169.44 98028.00 73229.85 3680357.82 4196410.16 3958139.58 3341025.65 4428119.14 3761134.20 4753633.88 4385313.82 4045149.68 3755786.01 3766881.67 3869264.20 3397063.77
2-Keto-glutaramic acid
65670.98 63719.07 254963.04 55414.98 38225.01 80278.08 80510.13 71099.52 71288.62 72293.69 60486.07 59611.62 39459.64 2609703.03 2840222.95 2953728.11 2911151.36 3138420.56 3180235.79 3887503.47 3430711.55 2837448.77 3081294.94 2566153.22 2905915.63 2755267.34
2-Mercaptobenzothiazole
9193.90 7629.75 7487.62 7120.38 8143.29 10884.18 10850.22 10116.45 9505.51 6922.82 7121.71 7309.25 6547.75 1977917.26 1066990.19 1406602.45 2415670.10 1538614.27 1826312.62 2169338.59 2547060.65 1714635.87 1554900.23 1832813.44 1190342.20 1258076.42
2-methoxy-17beta-estradiol 3-sulfate
9384.91 7921.83 7450.53 7230.66 8398.81 10655.90 10879.36 10594.37 9636.10 7235.70 7226.77 7365.06 6989.31 821596.03 662829.80 822640.81 751913.70 861228.24 968378.73 1041200.73 891396.14 996015.66 961907.80 943011.24 817939.79 679211.65
2-Methoxy-4-(2-oxiranylmethyl)phenyl hydrogen sulfate
8934.43 6610.90 22741.19 7378.21 8192.36 8618.29 8866.22 9440.51 9290.02 6133.88 6615.94 7549.24 7176.22 3136246.06 4155450.26 4229049.16 3788212.72 5436549.43 4517693.09 6752860.32 4570032.85 4575901.30 4587119.17 4709353.54 4299203.38 3390304.07
2-methoxyacetaminophen sulfate
18926.60 86139.24 14805.76 15410.20 17603.95 20871.95 23016.79 23188.30 20459.59 16518.20 12666.30 14746.32 15143.19 3353256.54 5088654.07 4480819.28 3541550.92 5887053.84 5388030.22 5911868.06 6172822.88 7554148.61 4967584.76 4867205.23 3769053.94 4792367.06
2-Methoxy-estradiol-17b 3-glucuronide
10564.41 9357.39 8914.24 8375.00 9836.12 13180.82 12927.50 12046.38 11502.18 8298.14 8878.58 9123.90 7789.22 629879.80 539187.53 696342.77 650920.50 718007.60 656157.81 569555.96 642475.06 553295.82 627195.27 697613.77 659359.59 611616.83
2-Methoxyestrone 3-glucuronide
10753.71 9907.44 10112.36 8273.54 10337.77 17986.10 15449.81 11456.76 12051.93 8138.20 9502.87 9538.03 7185.49 282438.73 213839.13 316516.47 302353.28 290384.13 229296.65 259416.79 284118.13 233006.37 284597.37 229009.48 292181.34 225051.37
2-Methoxyestrone 3-sulfate
9190.36 7796.36 7964.95 7337.06 8375.15 11907.42 11146.41 10470.20 9362.49 7246.38 7092.22 7359.32 6616.27 100194.48 69594.21 129029.77 119084.42 74010.75 136884.00 139032.74 147277.57 157211.15 134965.56 162177.85 95038.59 87397.03
2-methyl-2,5,6-bornantriol
148864.98 101625.38 53308.37 75074.88 90561.12 88203.13 162470.53 93209.88 139319.96 128641.96 84163.01 72365.69 85473.26 658422.50 410163.62 434057.81 419019.49 773100.47 606337.11 603619.57 443079.80 537911.56 479162.41 514753.09 466210.03 445681.70
2-Methylacetoacetic acid
1627975.75 2311199.54 1068741.16 1183734.31 1170665.74 1250486.29 1824365.23 1423343.78 1354420.66 1294683.23 1235113.81 1115720.70 1354302.01 2823966.25 3281350.44 3109996.18 2751960.21 3149693.58 3696084.88 3401342.44 2826482.07 2812405.36 2661931.03 2741706.52 2534155.35 2658251.27
2-Methylbutyroylcarnitine
10552.98 8262.14 8366.57 8406.42 9596.17 11134.58 11218.03 11573.20 10943.89 7847.96 8536.23 8928.25 8424.54 382190.77 397411.24 429952.11 373116.92 442498.27 490723.18 438819.35 404646.74 378146.92 386185.06 347356.63 422707.83 362786.76
2-Methylerythritol
30425.42 24713.24 26762.97 25888.38 27869.01 29560.73 48384.14 32808.11 31218.95 24629.50 35701.42 22983.92 18892.96 546941.07 615582.86 641930.87 677566.93 775880.07 873825.42 768339.90 812223.75 640634.91 652748.06 538596.23 694722.57 610755.82
2-Methylguanosine
11341.92 7056.85 8627.45 9061.64 10152.66 12220.91 12738.68 12536.11 11597.08 8843.08 7225.44 8383.08 8793.18 276384.42 360021.28 332176.68 216413.73 343743.00 385511.26 339266.15 270547.85 299809.18 273803.03 231141.59 304856.73 248739.69
2-Methylhippuric acid
12613.83 17709.97 29254.23 11333.44 28150.39 12539.46 12119.45 12818.49 12459.02 8545.01 11320.60 10310.05 8886.59 826266.15 2828581.39 1165655.43 825690.09 2428877.46 1398649.25 2709194.17 963384.67 885180.78 982861.39 1065433.23 914059.60 857090.55
2-(Methylthio)ethanol
8585290.09 22277555.03 44305153.72 4775331.76 38616756.22 64153285.66 34983496.92 9623808.83 25854009.63 11359187.78 26376582.90 28682421.68 8494908.79 8741080.20 58831172.87 89365728.73 3728008.61 104100821.49 101481063.99 25193649.21 9246306.07 37477926.77 4713933.17 86305439.99 66616377.69 7471270.75
2-Nonenal
8765.49 7074.95 7172.76 6766.76 7609.00 9472.66 9851.82 9545.46 9292.19 6734.38 7317.01 7274.90 6523.79 138774.81 123396.63 132700.20 129931.12 133796.96 158807.15 170505.65 118052.71 142093.65 141586.19 135184.45 135961.82 125475.10
2-Octenedioic acid
82348.14 82659.95 90475.13 615305.32 98686.64 70846.03 100878.28 84270.82 85553.44 76190.11 65572.97 152928.53 74179.91 1759486.72 1681782.25 2049704.29 1762389.00 2053093.45 2687616.81 2067974.27 1800299.27 1734492.27 1902034.73 1480838.16 1714298.80 1629525.22
2-Octenoylcarnitine
9852.02 8576.51 8208.07 8173.77 9089.83 10982.38 11167.93 11251.48 10620.90 7863.70 8104.94 8324.70 7469.25 69123.66 107977.53 184222.86 125377.22 217858.39 169745.15 82574.81 147783.64 81066.27 131520.03 74314.23 130612.28 95689.71
2-octenoylglycine
19088.83 23221.55 107845.36 19639.91 23387.54 11486.66 11436.05 10662.65 10018.73 7325.12 7506.22 7703.89 6901.27 4302176.28 4333561.03 5513484.82 4802740.14 5766484.67 6359235.71 4945232.19 4517252.05 4509158.22 5312790.78 4062706.23 5168758.08 4346726.67
2-Oxovalericacid
1627975.75 2311199.54 1068741.16 1183734.31 1170665.74 1250486.29 1824365.23 1423343.78 1354420.66 1294683.23 1235113.81 1115720.70 1354302.01 2823966.25 3281350.44 3109996.18 2751960.21 3149693.58 3696084.88 3401342.44 2826482.07 2812405.36 2661931.03 2741706.52 2534155.35 2658251.27
2-Phenylethanolglucuronide
11177.80 9138.66 12274.69 8920.87 10045.85 12488.05 12806.17 12550.91 11830.31 8816.08 9171.68 9317.42 8706.46 675213.09 773466.54 797241.95 787592.38 660895.41 902417.61 654850.83 581491.29 594248.88 1011552.47 615818.68 670619.57 656053.98
2-Propyl-2,4-pentadienoic acid
12150.97 9879.16 9922.52 9539.05 10931.90 12932.95 13564.98 13363.52 13046.89 9435.48 9936.22 10014.41 9233.14 231751.51 207828.73 256721.14 227796.77 251690.74 313066.95 284502.41 208115.56 227989.49 232940.45 229292.19 225913.76 194868.34
2-Propylpent-3-enoic acid
21926.18 37335.21 75761.59 12727.39 14718.06 13802.24 14826.96 20672.05 14853.15 12502.95 12099.40 10413.04 9482.33 2504601.55 2463860.13 2896253.41 2429235.87 2965303.25 3074650.33 2974270.36 2546551.36 2847664.62 2776489.76 2483032.15 2709172.01 2342690.74
(2R)-1-(Octanoyloxy)-3-(phosphonooxy)-2-propanyl decanoate
9887.63 7860.00 9550.27 7652.80 8138.17 13419.99 15349.54 14368.53 11533.65 11759.43 6503.49 6566.26 6240.47 153883.00 206065.27 125580.25 172887.89 132716.31 150285.70 289451.96 506657.46 391016.52 150298.26 240113.49 102888.90 152008.62
(2R)-2-(Octanoyloxy)-3-(phosphonooxy)propyl decanoate
9887.63 7860.00 9550.27 7652.80 8138.17 13419.99 15349.54 14368.53 11533.65 11759.43 6503.49 6566.26 6240.47 153883.00 206065.27 125580.25 172887.89 132716.31 150285.70 289451.96 506657.46 391016.52 150298.26 240113.49 102888.90 152008.62
(2S)-2-[(1-Carboxyethyl)amino]-4-(dimethylsulfonio)butanoate
17355.69 13045.05 12456.70 14114.37 15177.75 16107.75 17492.72 17753.84 17348.62 11684.08 11937.48 13879.67 13616.27 545372.93 927923.31 1029944.18 733899.86 945621.17 1367384.64 824182.71 792534.77 568778.74 755407.51 558413.92 741365.51 584774.86
(2S)-3-Hydroxy-1,2-propanediyl dibutanoate
15397.49 13086.11 14667.79 11469.68 13688.61 20250.70 18150.45 16525.87 15921.39 11405.27 12196.50 12665.45 10811.23 852538.63 611048.15 919332.99 796828.25 997048.61 1228586.73 874181.61 793159.35 753748.16 924314.62 754548.74 853192.87 726276.15
(2S,3S)-2-Hydroxytridecane-1,2,3-tricarboxylate
10327.95 7918.02 13536.63 8215.99 8986.15 27429.83 13667.23 11380.03 10690.26 7676.76 7255.65 7663.42 7107.85 343685.84 304671.46 363777.13 280972.72 371659.27 378350.04 352361.40 378288.58 344133.81 377639.92 345697.24 352429.48 334186.68
3097-C2
10833.57 9071.62 8867.97 8933.27 9917.96 11996.35 12698.41 12596.14 11733.39 8530.16 9214.00 9267.52 8572.68 321688.23 284287.20 383196.70 283370.67 390365.11 428706.86 384069.00 316367.85 311501.25 338625.10 275891.45 332001.17 276142.10
3,11-dihydroxy-6,8-dimethyldodecanoic acid
13274.38 11695.91 17224.90 10211.10 28505.76 31580.32 26009.65 14923.97 26716.67 11444.02 15563.88 12490.80 8334.28 141549.03 175173.64 164632.94 130415.26 221872.96 265072.99 214637.17 156255.89 162737.95 168574.60 248411.74 217964.14 151353.33
3-{[({(1R,2R,3S,4R,5R,6R)-2-[(2-Acetamido-2-deoxy-alpha-D-gl...
11148.57 9066.62 11757.85 9072.34 9572.62 15211.26 17981.63 13804.10 13151.31 13422.35 7767.94 8104.61 7408.03 567106.20 338147.15 832011.76 748669.19 857665.24 823283.93 388883.65 236159.94 381254.16 1333726.73 675372.16 907144.81 987097.54
3-(2’-acetoxy-3’- oxo-4’-methylpentyl)-indole
9370.05 7608.60 8034.93 7369.39 8307.64 11552.22 11198.85 10335.98 9760.19 7134.63 6921.31 7566.44 6705.08 543171.00 676898.39 805637.41 744451.37 827586.29 944789.36 902716.37 848891.86 1056852.96 912407.47 790652.48 800449.72 682485.32
3-{[(2E)-4-Amino-4-oxo-2-butenoyl]amino}alanine
71010.74 58478.95 53007.61 64003.72 44133.13 77337.70 92988.34 76035.74 77551.69 55808.09 66651.84 59152.90 41976.07 250659.99 292698.79 416021.27 327735.69 397273.64 338479.06 363448.18 391492.35 296187.19 361269.19 204129.57 331493.71 388030.90
3-(3,4,5-Trimethoxyphenyl)propanoic acid
10093.02 9438.03 10101.34 7882.96 9785.60 17133.92 14717.80 10913.94 11480.91 7638.40 9052.63 9086.12 6836.62 1429173.93 1260071.71 1602457.22 1442705.53 1819920.63 1910216.46 1374929.34 1370814.28 1452792.57 1692409.65 1424328.02 1605667.52 1436352.72
3-(3,4-Dihydroxyphenyl)-N-(3-oxopropyl)propanamide
9691.49 7817.66 8381.61 7663.42 8702.21 11484.21 12495.41 10654.44 11240.17 7328.97 11020.91 8259.71 7356.91 842202.51 1149258.43 1290036.09 1086302.65 1321338.17 1578002.33 1240064.29 1138708.57 1025890.36 1227987.32 892605.89 1178316.02 1017868.66
3-(3-Hydroxyphenyl)-2-methylpropionic acid
88149.24 47881.13 39397.84 37803.10 48002.65 36785.44 66517.72 32662.24 34753.09 40001.98 44296.92 33776.33 50306.32 522452.05 437462.37 457971.11 452786.67 464296.68 577578.22 554099.20 407382.61 544725.48 541571.00 491551.06 506123.29 391816.54
3-[3-Methoxy-4-(sulfooxy)phenyl]-2-oxopropanoic acid
14165.36 8855.98 10233.75 11273.36 12650.39 13643.02 13542.04 14446.13 14049.84 9408.92 9870.34 11305.64 10735.90 1549332.10 1228418.07 1430844.12 1332884.47 1438500.26 1971916.50 1670825.81 1622274.35 1257106.32 1659761.00 1455172.34 1303828.64 1016409.39
3-[3-(sulfooxy)phenyl]propanoic acid
13085.13 8349.40 73114.01 10759.34 11553.20 12328.39 13251.85 13311.22 12968.63 8966.32 8944.06 27229.70 10159.59 3219872.23 590098.16 779822.17 1393297.41 641113.37 2838216.37 795324.91 1889642.21 794025.68 2521946.63 1311646.06 777290.89 1354055.95
3-[3-(sulfooxy)phenyl]propanoic acid_
14294.11 28616.10 73114.01 10849.74 14616.39 13264.90 13497.78 13671.56 13470.94 9002.17 9812.89 27648.15 10616.38 10067925.58 8619621.98 10403328.50 9224979.16 9159015.83 12529265.98 11055744.07 10617998.76 9281083.46 9591921.92 10098221.85 9229442.84 8299281.73
3,4-Dihydroxybenzaldehyde
29336.36 36560.70 76401.27 29173.76 43000.55 24799.18 24914.11 24718.59 24609.40 16380.54 17659.62 20635.27 16782.27 1057928.99 1057971.32 1243824.61 1221223.01 1371279.73 1529895.79 1252636.44 1349566.25 1017552.76 1223946.25 962522.05 1140718.35 1095187.18
3,4-Dihydroxybenzenesulfonic acid
1253150.10 297735.49 887422.36 652349.43 1002678.76 688882.93 1678331.06 1090673.17 1861581.21 390172.17 267437.57 708249.37 1749816.72 715302.21 786369.07 808944.86 855415.07 1068630.44 700097.42 1020275.46 762418.12 746835.20 639633.23 708657.40 846102.17 588107.30
[3-(4-Methoxyphenyl)-2-oxiranyl]methyl hydrogen sulfate
8934.43 6610.90 22741.19 7378.21 8192.36 8618.29 8866.22 9440.51 9290.02 6133.88 6615.94 7549.24 7176.22 3136246.06 4155450.26 4229049.16 3788212.72 5436549.43 4517693.09 6752860.32 4570032.85 4575901.30 4587119.17 4709353.54 4299203.38 3390304.07
3-(4-Methoxyphenyl)propyl hydrogen sulfate
8768.36 9740.38 45329.75 9540.88 7965.65 9643.68 10103.42 10196.53 9388.81 6934.93 7454.93 7533.30 6864.39 3873049.22 3065578.99 3837855.05 3170587.84 4354581.40 5688933.08 4814142.75 3549772.53 4209525.92 5293935.79 3737096.28 4025392.49 3251706.08
3,4-Methyleneazelaic acid
10845.25 9244.22 16852.78 16508.63 10029.07 14343.58 48620.21 16967.03 30914.90 33483.33 17547.04 15580.85 10072.34 331622.02 360830.15 404969.45 407182.03 513012.27 508048.95 409746.70 385311.39 365564.91 415099.64 384657.27 408334.04 343617.95
3,4-Methylenesebacic acid
12401.38 13457.51 18460.70 9848.26 23636.93 18024.69 15673.35 14030.62 13400.91 9378.87 10420.05 13196.15 13062.31 764498.27 712063.49 910009.03 854655.57 1055461.03 949623.32 920695.58 847162.56 708672.52 840486.01 786587.32 764040.97 690655.69
3,4-Methylene suberic acid
45662.28 39194.75 174875.87 98832.37 48946.95 24299.18 22454.03 32899.06 66989.96 17585.07 36737.27 54039.77 24306.37 1002181.29 953419.04 1224076.11 1039060.64 1289927.31 1464387.79 1076233.31 1045650.45 1014774.09 1201253.95 1007121.18 1117973.10 967328.70
3-[4-(Sulfooxy)phenyl]acrylic acid
16921.86 11719.84 12145.32 13761.55 14798.35 15705.10 17055.46 17310.05 16914.96 11392.02 11639.08 13532.72 13275.91 1209993.05 1390079.24 1492592.08 1145053.40 1481147.42 1872038.96 1783618.95 1300018.43 1292776.14 1497337.68 1462389.74 1205107.78 1091740.67
3-[4-(sulfooxy)phenyl]propanoic acid
13085.13 8349.40 73114.01 10759.34 11553.20 12328.39 13251.85 13311.22 12968.63 8966.32 8944.06 27229.70 10159.59 3219872.23 590098.16 779822.17 1393297.41 641113.37 2838216.37 795324.91 1889642.21 794025.68 2521946.63 1311646.06 777290.89 1354055.95
3-[4-(sulfooxy)phenyl]propanoic acid_
14294.11 28616.10 73114.01 10849.74 14616.39 13264.90 13497.78 13671.56 13470.94 9002.17 9812.89 27648.15 10616.38 10067925.58 8619621.98 10403328.50 9224979.16 9159015.83 12529265.98 11055744.07 10617998.76 9281083.46 9591921.92 10098221.85 9229442.84 8299281.73
3,5-Dihydroxycinnamic acid
90272.73 89646.50 105882.79 87203.58 62324.99 52210.11 86834.44 71648.62 37679.82 60741.77 63972.66 63842.82 84624.99 385503.35 438634.98 496740.12 458371.21 512066.08 569164.58 566017.80 445274.77 483089.74 449329.64 463345.01 467721.79 374519.29
3,5-Dihydroxyphenylvaleric acid sulfate
12825.03 9288.11 21456.50 10613.29 11182.32 12121.49 12637.51 13179.00 13115.54 8688.03 9397.93 10530.53 10095.86 2613022.26 2634505.34 2971428.23 2561086.36 2758191.88 3080339.18 3377473.53 2954826.93 2370228.14 2647578.08 2523594.29 2638325.21 2264596.16
3,5-Dihydroxyphenylvaleric acid sulfate_
11322.75 9224.60 9559.95 8914.33 9858.47 12544.62 11634.90 12700.07 12313.71 8489.45 9491.62 9634.60 8686.55 805381.11 564858.55 687168.07 629996.10 774389.95 1394482.44 763827.16 802311.60 694606.79 738565.65 664356.84 754569.17 576556.90
3,5-dimethoxy-4-(sulfooxy)benzoic acid
15495.96 9800.09 11255.70 12785.90 13953.23 14566.85 16301.97 15715.19 15349.91 10383.56 10904.60 11974.71 12008.20 808010.95 875966.99 1017680.32 747204.98 1021362.35 1385562.15 1100018.38 1362354.34 779325.46 839976.47 944638.15 871609.36 657925.04
(3alpha,5beta,6alpha)-3,24-Dihydroxy-24-oxocholan-6-yl beta-...
11843.74 11978.75 13453.84 9535.78 11202.75 16586.98 20220.53 15163.43 14995.97 12267.83 9140.51 8789.37 7824.67 725590.37 642582.42 707293.03 615014.86 781145.91 897120.39 687395.50 708767.89 696939.93 661672.15 742276.07 750437.64 692342.60
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanate
17089.05 19696.92 27780.65 13456.79 24641.93 44839.95 37570.72 22814.41 39300.24 15621.39 37189.52 22864.09 12122.48 1048156.76 1021863.79 914600.41 757295.56 1026419.84 1102437.60 958907.88 850028.64 1034141.32 1062839.46 1666674.98 934950.50 851145.37
3-alpha-hydroxy-5-alpha-androstane-17-one 3-D-glucuronide
11897.69 8696.15 15820.88 9033.39 9835.95 15519.33 16675.77 12534.88 12142.94 8585.79 8905.55 8589.72 7719.14 1179211.33 1274754.39 1369816.69 1098223.68 1540017.16 1490898.89 1329466.50 1181657.76 1210371.95 1402168.34 1277580.96 1377439.33 1344422.38
3-Carboxy-4-methyl-5-propyl-2-furanpropionic acid
14111.15 8842.27 11247.43 9185.84 9590.06 16993.33 21042.50 14319.64 15451.09 9323.19 9350.67 9593.99 10243.36 662149.99 607284.66 654342.16 609872.00 792590.44 770087.79 668618.19 636119.25 717210.21 819669.47 734308.98 739950.92 672045.33
3-Deformyl-3-hydroxymethyl sordarin
12055.71 8885.41 11683.23 9138.45 10527.09 15182.41 18387.22 17435.02 15286.69 15455.90 8230.72 17982.25 7441.07 1970808.32 2083175.40 2444337.99 2113775.15 1933452.53 2790974.80 1917216.84 2542997.38 2797204.07 2457145.42 2841065.46 2768528.62 2299749.23
(3E)-3-Hepten-2-one
17184.37 8568.18 15873.56 7584.48 19529.18 85932.36 15243.99 10117.84 11949.73 9107.22 25177.89 13568.05 6778.39 1047220.21 937892.38 1134881.27 1204612.37 1414711.34 1394890.82 1043323.58 995018.03 971225.09 1175932.13 931194.93 1073752.98 1009051.56
3-ethylphenyl sulfate
10013.30 8710.04 19863.62 7937.37 8959.44 10876.55 11533.18 11584.65 10666.98 7879.04 8469.83 8558.86 7943.54 1703944.48 1447423.50 1791078.24 1491740.96 1877978.17 2725311.32 2232580.18 1670447.28 1907606.25 2064319.39 1705950.93 1740828.62 1363530.29
3-hydroxy-1H-quinolin-4-one
9787.35 17602.88 38943.46 22944.77 46813.45 9607.90 12516.56 9871.64 9416.58 10840.38 11368.36 7224.93 10830.64 571291.01 720708.05 667175.12 623993.87 933523.01 747557.74 846766.96 880401.99 757463.16 822439.30 876656.99 729626.44 622543.38
3-hydroxy-3-(3-hydroxyphenyl)propanoic acid-O-sulphate
15784.76 64414.30 40809.66 11645.71 15520.14 13429.58 14158.05 15089.75 14423.50 9930.80 10146.17 11832.81 11558.46 4855208.07 6046580.81 7073931.00 5242764.51 5720875.97 11664491.63 6633481.06 6304673.76 4116570.75 6860543.37 5572976.82 5466544.99 4231015.79
3-Hydroxy-4,5-dimethyl-2(5H)-furanone
118188.56 757467.89 278082.21 140204.34 136967.04 156991.10 136583.29 109048.56 109456.98 105981.20 276300.42 107898.00 126196.83 962030.98 1055666.26 1215938.15 1090732.74 1211744.09 1509843.27 1536560.18 1146570.18 1057174.08 987159.73 1175457.66 988115.89 889839.97
3-Hydroxy-4-methoxyphenyllactic acid
16946.74 36938.47 121258.61 24335.62 23610.90 14331.66 14611.30 14718.89 14582.25 37652.28 16852.77 11692.43 11492.19 1013481.39 2015979.56 1978042.31 1499186.98 1932412.55 2484299.47 2212165.53 1849720.77 1272982.23 1694872.83 1813716.66 1828675.47 1460798.47
3-Hydroxyadipic acid
289761.83 487034.22 702916.97 485762.78 553343.75 461428.89 477651.87 348050.47 414306.64 338991.62 265106.19 341053.11 635199.87 8306383.64 6908460.70 9796032.45 9448316.10 10033511.13 12361592.82 9462098.85 9657983.63 7694097.57 8303737.76 7506393.66 6954497.74 6902977.63
3-HYDROXYBENZOATE
248496.41 282502.10 213187.78 254137.67 307340.99 231184.63 288601.25 217567.06 231663.92 224277.33 242688.27 228560.89 282613.50 1791751.40 1278390.65 1680068.12 2147159.50 2196644.94 1697100.78 1744390.24 1384313.69 1394056.52 1789846.71 2518072.34 1541507.18 1730778.75
3-Hydroxybutyric acid
284702.34 251403.45 452895.77 247576.11 236063.94 206869.29 218975.47 227878.00 224922.62 182453.43 194007.39 192383.00 146281.46 13589187.92 7853530.55 12320038.33 11147003.24 12754123.15 15563551.74 12631983.34 11259094.19 10427295.59 10812991.81 8502414.62 8849940.10 8925723.43
3-Hydroxybutyric acid_
517313.02 701387.96 811631.70 642933.85 721528.59 573171.68 683060.87 651308.75 514724.04 549551.58 546731.68 534168.64 528183.11 17546847.44 14498580.96 20796199.13 16418661.79 20947131.56 25177666.83 21823673.16 16464514.95 16657760.13 14563531.82 13505047.39 14774242.91 13346328.90
3-Hydroxycyclohexanone
34338.84 50379.45 37090.78 43214.31 56847.73 36992.42 81073.44 36478.22 41048.09 59278.46 47429.68 31692.66 52387.52 562407.99 573994.48 737644.25 580624.33 748159.53 926584.95 858285.17 706679.55 672397.69 677862.29 537481.93 591928.76 504778.86
3^-Hydroxydaidzein
9396.02 7903.34 24630.33 7506.55 8533.81 12146.63 11681.02 10665.14 9767.06 7098.38 7225.46 7667.44 6683.94 502304.95 714883.12 697342.90 657343.17 897836.55 564196.09 768930.34 569473.41 849773.56 1982221.51 655190.28 586354.32 681219.72
3-Hydroxydodecanedioic acid
9905.92 7729.42 13714.70 7887.18 8652.21 13407.91 13798.66 18082.16 12927.20 19540.38 12934.96 13367.30 9066.25 783300.82 769111.71 943086.47 832352.52 1294797.54 1167988.55 644096.09 850433.35 844622.80 1288483.64 986028.30 1198636.28 1026233.18
3-Hydroxyhippuric acid
57355.93 233112.01 371681.18 142505.42 193765.50 87250.83 37311.01 37511.75 65909.11 63472.91 51720.09 105030.29 72175.37 8587644.04 12656659.90 12879964.24 10672125.86 13265116.19 15687391.06 12889007.62 12262124.96 10352096.61 10072938.90 9782047.03 12904615.87 10345308.74
3-Hydroxyibuprofen
9916.39 14548.55 19929.32 12930.61 9169.52 12490.87 12197.66 11107.73 10445.27 7547.84 7457.16 7856.87 10141.65 2981215.41 3356179.86 4931454.39 4125142.48 5800732.82 7492116.99 3365846.43 4198731.26 2856056.91 3540668.17 4586169.74 3459807.80 4236060.70
[3-(Hydroxymethyl)-3-methyl-2-oxobicyclo[2.2.1]hept-1-yl]met...
237434.61 83671.19 947736.18 208137.33 167143.92 98436.47 14579.19 13584.39 193122.83 9083.79 9879.13 23559.02 8773.75 63986206.36 68364089.90 64749233.96 70838960.50 68102285.62 64428287.98 57349121.39 48991408.88 66138796.11 81935679.15 68957723.70 106721264.89 80169194.77
3-HYDROXYMETHYLGLUTARATE
289761.83 487034.22 702916.97 485762.78 553343.75 461428.89 477651.87 348050.47 414306.64 338991.62 265106.19 341053.11 635199.87 8306383.64 6908460.70 9796032.45 9448316.10 10033511.13 12361592.82 9462098.85 9657983.63 7694097.57 8303737.76 7506393.66 6954497.74 6902977.63
3-Hydroxyphenylacetic acid
127661.62 198942.44 261170.99 160048.64 333652.10 172923.87 238842.40 170797.59 170894.49 153117.95 171473.97 141222.93 198683.31 926179.88 891655.61 702802.96 720614.07 771606.37 1150739.31 1281384.53 739353.94 982345.60 826970.73 794058.39 777406.88 779107.76
3-Hydroxyphenylpropionic acid glucuronide
12080.98 8880.07 19428.14 10089.07 11004.37 11576.50 11935.40 12680.94 12478.79 8239.32 8886.84 13506.50 9639.44 1546847.01 1644340.30 1835945.49 1331358.18 1519491.28 2149369.58 1956876.19 1494021.36 1561230.88 1379815.36 1419634.38 1555796.69 1359858.66
3-Hydroxyphenylpyruvic acid
90272.73 89646.50 105882.79 87203.58 62324.99 52210.11 86834.44 71648.62 37679.82 60741.77 63972.66 63842.82 84624.99 385503.35 438634.98 496740.12 458371.21 512066.08 569164.58 566017.80 445274.77 483089.74 449329.64 463345.01 467721.79 374519.29
3-Hydroxypicolinicacid
24138.56 93822.41 71614.05 44013.76 48642.53 20100.53 40958.75 23234.89 32548.36 34340.14 38866.23 18031.06 239243.94 469743.49 496650.33 618124.13 549298.49 572831.96 702643.75 627318.89 553771.43 481791.22 439947.78 675803.60 475935.82 476048.52
3-Hydroxypyridine sulfate
60526.27 233591.09 334871.29 49625.43 26654.84 59698.97 7163.50 7082.90 6403.50 4526.46 4909.69 10774.70 4405.49 9881260.00 9487395.29 14018191.85 11604535.41 15210397.06 17645771.66 19483596.39 13877674.39 14001449.16 11312296.34 11633446.24 13644149.92 10097269.49
3-Hydroxysebacic acid
35436.77 25424.00 158073.37 32980.58 38531.44 12388.26 11020.15 10805.57 22299.68 7502.58 7884.89 8011.30 7270.48 5963401.97 4442010.52 7030288.35 5450576.57 7099597.90 9888735.87 5625525.78 5532378.77 4315713.74 5616931.52 4074510.87 5408609.96 5394272.69
3-Hydroxysuberic acid
16267.95 13319.30 13680.11 12807.64 14164.13 17512.92 19909.90 18246.80 17427.86 15296.08 13637.06 13842.49 12495.64 442257.75 487272.57 743300.61 587363.68 832383.38 1010343.08 601767.60 536485.47 389713.72 518873.42 410193.94 547421.63 528904.04
3-Hydroxyvaleric acid
390682.44 475253.60 1056065.73 389623.04 655991.33 363487.31 424455.52 313055.85 354168.74 329941.70 327673.77 355704.83 290613.76 18953823.51 20398577.25 27730861.01 23097883.24 27885398.32 32014150.73 29420563.62 24723505.46 23335463.32 21208916.27 21545226.46 21805561.67 17318783.25
3-Indole carboxylic acid glucuronide
12926.12 28712.50 71405.31 12097.84 12496.26 13538.98 12148.98 12814.65 12491.22 8419.77 9174.61 10054.15 9371.69 5599111.26 8628462.62 7515734.83 7203876.37 6417779.34 6884836.99 8622352.81 7759832.63 6421418.54 7889062.14 5384775.87 8456163.51 6532427.05
3-METHOXY-4-HYDROXYMANDELATE
13533.59 17653.67 54460.90 10252.84 35961.98 15137.36 17551.92 15742.52 14510.94 10870.03 10259.39 9165.36 9360.46 979790.14 1253878.28 1932552.26 1561889.10 2075471.17 1888994.54 1426501.21 1385212.81 1185418.25 1189026.23 923819.48 1422106.02 1211392.92
3-Methoxy-4-hydroxyphenylglycolglucuronide
31074.38 31082.80 66297.48 34177.76 16026.92 25718.68 26359.07 26152.21 29097.61 17206.16 18683.84 21832.06 17755.60 915404.52 889704.69 841479.53 774528.81 893563.61 926935.36 1032406.05 904868.47 851899.80 894679.68 691642.76 854678.08 798753.59
3-Methoxy-4-Hydroxyphenylglycol sulfate
142347.31 48014.41 195089.10 65030.06 33261.74 45693.68 21737.25 23465.12 39867.18 15438.26 16764.11 27462.24 15931.25 1478880.20 1243830.49 1202528.00 1349393.87 1371455.90 1490318.48 1964492.77 1541279.43 1644712.63 1569155.63 1289495.52 1490317.05 1266102.93
3-Methoxy-4-Hydroxyphenylglycol sulfate_
16307.57 14831.75 85622.14 29435.86 7032.28 10135.21 11742.54 10852.64 10289.56 7290.10 8574.42 8748.44 7104.80 541397.16 684961.84 722768.49 685408.07 941110.34 969572.00 1219842.63 680292.08 991160.96 602153.12 796677.30 835334.37 557247.02
3-Methoxy-4-Hydroxyphenylglycol sulfate__
7484.26 5083.13 10973.52 5718.00 6445.04 6936.61 6819.98 7325.82 7253.97 4938.26 5283.22 5864.05 5501.27 1293118.40 1278247.20 1385038.94 1276007.41 1254614.12 1308477.53 2363310.74 1781752.87 1427597.16 1516525.98 1416651.01 1208628.57 1215331.16
3-Methoxybenzenepropanoic acid
88149.24 47881.13 39397.84 37803.10 48002.65 36785.44 66517.72 32662.24 34753.09 40001.98 44296.92 33776.33 50306.32 522452.05 437462.37 457971.11 452786.67 464296.68 577578.22 554099.20 407382.61 544725.48 541571.00 491551.06 506123.29 391816.54
3-METHYL-2-OXINDOLE
10077.28 6544.23 7564.73 8108.54 8868.05 9894.48 10087.54 10217.41 10067.48 6669.04 7333.65 8029.17 7934.13 497985.77 614321.00 513316.53 467278.97 615265.35 534836.57 667445.08 515899.45 604032.04 532579.93 613983.94 581294.20 546568.76
(3-Methyl-3H-imidazo[4,5-f]quinolin-2-yl)azanyl acetate
10717.18 11889.05 9334.37 8510.65 10680.86 15465.01 12858.10 11687.91 11598.00 7938.93 9818.56 9783.34 8252.13 342510.40 397299.14 404995.77 274337.46 414029.13 381129.73 665702.82 336948.69 482338.32 362312.59 375707.70 448733.75 344675.29
3-Methylazelaic acid
93668.53 132625.27 251538.72 133493.00 205619.62 93834.43 107303.87 102921.74 108715.72 103933.83 80977.62 99896.20 100212.66 9761489.21 9475441.21 12287010.62 11379275.73 13477671.53 14688716.25 11379357.47 10859036.67 9581259.53 11348893.29 9466872.95 10933880.44 9403114.98
3-Methylbut-3-enoic acid
63975.09 109606.25 145022.69 94955.02 119707.55 81823.46 111327.52 75466.86 80473.89 45541.14 54598.00 73638.85 41360.89 1323499.63 828028.25 942895.78 1123634.55 920788.00 1324650.24 1242814.22 1133759.36 973828.31 1073922.14 979731.86 838455.33 964733.92
3-Methylcatechol 1-sulfate
22378.56 81923.05 112567.80 50707.22 21261.36 53408.83 10495.29 11135.85 10701.69 7310.27 16165.97 45363.27 8321.99 15579170.49 19594278.64 21510630.83 19034257.16 24636124.52 21642790.46 28892592.14 21367607.92 21848559.78 21124778.12 26063796.10 20514989.43 15145468.33
3-Methylcatechol 2-sulfate
180668.47 224030.18 656346.85 114794.03 103027.24 53582.69 12068.24 12223.62 12044.25 7978.52 16706.90 45592.33 9492.01 84721877.56 88255851.48 91472483.14 87048158.95 98230259.26 110717610.45 120732452.32 106242110.93 91534597.61 109517310.68 102643448.76 88689037.90 72866429.19
3-Methylcatechol;3-Methyl-1_2-benzenediol
13891.41 28342.36 24081.33 14830.18 19051.47 13476.49 14606.40 13999.85 14151.06 9977.46 15284.27 10724.07 10823.85 767125.85 897838.82 760994.56 635244.92 699926.43 934213.45 1096448.89 778611.82 932742.07 776779.37 1007916.80 762573.46 685735.19
3-Methylcrotonylglycine
18530.92 15014.69 105338.72 58731.17 68744.26 31928.24 21310.37 16717.99 16683.80 34711.99 16233.77 14309.15 20499.29 2107866.35 2654715.10 2686845.12 2311239.07 2726629.41 3218420.93 2937979.56 2498502.22 2572632.95 2316838.85 2400308.48 2604886.31 2154251.13
3-Methyldioxyindole
11758.93 8069.02 10027.84 8963.44 10103.14 11287.86 10960.06 11575.08 11371.20 7741.14 8332.54 9192.39 8866.84 453307.00 435983.38 334873.34 390453.86 340395.12 414240.93 682801.85 425822.45 527309.30 403718.23 465883.20 410474.45 372028.52
3-Methylindole
8525.07 7133.42 18925.83 8448.95 7704.61 9625.74 10018.12 9904.50 9069.72 6714.20 6834.54 7086.35 6582.78 2005737.54 1805448.24 2038681.18 1722605.76 2044928.49 2005708.30 2266021.99 2117624.33 2415734.20 2188300.51 2249688.48 2135138.35 1687285.90
3-METHYL-L-HISTIDINE
119548.52 109165.34 427594.46 113180.15 57107.83 57415.24 40167.82 66094.58 49273.26 19300.27 36195.04 29548.88 45425.84 2351899.50 1992023.17 1638478.33 2081743.20 1717847.65 2105789.37 2830293.18 1874371.62 2370879.71 2075573.22 2179072.58 1753753.11 1866264.31
3-Methyluric acid
576731.85 49971.22 433472.94 207724.96 100813.16 169460.20 38152.47 36564.74 35586.95 25084.50 27043.24 44223.50 25237.46 6836586.82 6993512.00 7452784.30 7074869.46 7321116.62 8671399.34 8313939.79 7563901.46 6619659.08 7092652.13 6753929.43 7344614.80 6623383.18
3-Methylxanthine
40832.79 108106.94 159008.90 134817.42 353389.40 56508.12 37276.99 54128.08 84577.69 68198.28 59989.98 64701.26 49504.82 3618358.94 6061542.91 5964849.19 4686181.66 6773976.01 5927090.20 7228427.70 4407559.61 5525499.20 3993588.46 5373527.16 5108621.39 3798832.60
3-o-acetylbotcineric acid
24674.87 29899.70 51373.24 15541.44 42671.36 90525.61 59598.42 32653.54 41350.27 27556.63 28352.60 34027.57 16142.61 372639.00 397199.73 453644.70 413860.18 554937.02 588064.36 412375.59 347834.15 409179.66 421858.62 459540.07 512564.33 414705.76
3-O-(alpha-L-olivosyl)oleandolide
18391.76 19308.01 29302.02 15311.09 25198.85 43969.56 37405.80 23194.69 42429.11 15962.83 32343.71 22145.51 13314.65 273106.73 271604.71 278394.03 211165.75 286302.58 325958.77 235847.82 258282.86 276512.81 304714.56 298099.08 313528.75 277144.72
3^-O-Methylmaysin
7486.66 5500.19 5851.93 5997.68 6806.83 7809.86 7846.35 8083.57 7785.77 5430.23 5926.01 6244.03 5742.96 150746.60 259057.98 325281.78 215581.54 214466.98 304107.03 422905.27 281605.78 328640.90 317411.37 149455.34 135796.22 176683.63
3-Oxindole-3-acetate
8847.16 11769.78 19046.21 7359.23 8329.56 10997.49 11965.83 10106.98 10442.51 6844.89 10553.82 7909.65 7108.27 1435862.24 1910415.58 1942892.24 1948102.57 2474057.44 2443562.12 1758330.10 2162960.67 1826023.67 1923596.08 1647361.46 1921686.86 1608402.70
3-Oxododecanoicacid
130399.66 101833.14 165679.51 73038.69 95761.49 133947.80 151030.42 98963.15 151315.99 123299.90 162581.41 100434.55 86223.08 904889.27 858534.73 984793.71 854702.28 1173468.40 1047437.96 1131398.54 991796.84 1064340.56 976288.07 1033545.92 913607.11 710929.76
3-Oxooctanoic acid
218354.30 222966.37 217852.79 133346.36 163603.74 173443.96 387463.01 243670.62 337189.99 241601.06 218391.24 150847.02 164154.45 589445.94 551636.41 450043.87 468875.22 422515.87 550020.55 965991.52 605879.42 696901.07 526936.53 451730.76 456247.57 482858.17
(3R,5R)-3,5-dihydroxydecanoic acid
10362.93 9114.25 19623.32 8250.75 14929.93 13284.34 12538.66 11640.49 11264.95 8148.82 8685.12 8807.28 7638.81 626714.07 691483.93 917108.55 944809.04 836900.62 873752.59 949845.85 780476.94 697707.65 783958.04 652908.48 756227.61 655922.54
(3R,5R)-3,5-dihydroxydecanoic acid_
20105.27 16647.78 16324.75 16274.76 21498.09 22685.46 23508.69 23169.35 21669.56 15822.12 16808.15 16793.13 15625.40 1063974.42 860929.09 1064230.32 1041125.47 1174050.09 1429518.76 1005560.56 1004329.94 904494.27 1031814.93 875320.51 935445.95 880542.94
(3S,9S,14aR)-9-benzyl-6,6-dimethyl-3-(6-oxooctyl)decahydro-p...
12969.41 10035.53 11908.25 10317.31 11284.43 17416.18 17623.69 14290.57 13718.75 9752.42 9111.35 9682.60 8925.75 752808.70 548257.25 629097.90 736222.45 625851.99 604295.71 608781.85 758580.76 581846.09 609098.43 744897.80 663109.07 646363.99
(3S,9S,14aR)-9-benzyl-6,6-dimethyl-3-(6-oxooctyl)decahydro-p...
9732.57 8194.09 8760.29 7758.87 8971.67 13222.56 12607.63 11046.25 10088.87 7624.48 7715.66 8130.30 7153.92 576311.48 465252.18 570693.20 569970.17 538967.34 558577.89 562940.27 651650.18 590004.68 606905.91 604067.76 545372.93 542363.30
3^-Sialyllactose
139373.10 109230.92 201702.66 103595.37 64351.52 154939.12 152254.49 146648.68 133347.77 95504.70 104422.39 109736.55 95861.22 2149976.39 2085085.86 1998849.10 1783485.75 1901933.75 2173001.35 2605693.35 2046149.72 2100982.17 1893105.10 1649981.84 2089290.06 2126189.61
3-Sialyl-N-acetyllactosamine
88355.60 72163.41 71526.91 73423.09 48180.91 96932.28 106789.43 89749.35 86077.90 68804.48 73034.29 71978.43 54403.33 2040019.57 1817671.57 1684324.77 1534682.38 1726046.80 1992289.20 2467950.12 1921187.65 1917619.13 1726082.20 1334158.00 1877087.38 1829929.29
3-tert-Butyl-4-hydroxyanisole
11035.11 10166.69 10376.97 8490.03 10608.28 18456.74 15854.08 11756.54 12367.29 8351.16 9751.53 9787.61 7373.52 899644.12 773336.23 951145.49 875095.74 1008085.87 1160929.96 862928.23 810833.39 875145.32 990166.70 902261.33 956866.41 859214.74
3-tert-Butyladipic acid
52518.55 101917.53 121470.60 102384.56 166054.25 70663.96 94996.80 95315.51 101673.23 103360.77 80492.29 90170.99 95649.44 1518073.28 1442962.93 1746680.86 1761323.24 1978893.79 2208979.96 1579347.05 1700200.63 1455714.74 1808093.42 1469611.89 1477848.45 1399396.70
3-Ureidoisobutyrate
8157.62 7366.90 7091.25 6491.13 7651.34 10135.07 10009.66 9110.03 8726.09 6388.69 6623.97 6719.05 5965.96 103869.00 74531.64 66244.01 61277.44 77786.82 74779.95 124752.77 66121.61 108931.39 81472.61 103119.09 73361.74 77534.49
4,15-Diacetoxy-3-hydroxy-12,13-epoxytrichothec-9-en-8-yl 3-h...
13415.32 10284.99 33377.39 10672.03 11672.41 18014.97 18047.33 14781.90 13885.95 10103.68 9568.22 10015.50 9232.63 2686184.51 2478888.77 2656915.67 2315861.65 2772052.41 3229066.16 2505381.15 2438629.31 2288698.43 2722331.46 2623800.86 3030836.90 2566783.49
4,21-Dehydrogeissoschizine
13301.95 10702.27 11838.28 10984.60 12066.50 16932.22 16742.35 14956.22 13829.12 10161.18 9821.08 10332.42 9329.34 323353.06 294404.58 344101.33 297290.36 392790.31 454045.56 305425.40 294438.60 322461.55 398072.16 335211.90 364678.82 347542.89
4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoate
10648.06 17875.40 56518.21 13841.78 11550.77 12613.01 10366.50 10649.26 10609.85 7307.01 8128.02 8959.75 8003.61 1227503.94 1615822.38 1637193.87 1530894.46 1785915.04 2008075.41 1524963.64 1358632.47 1266359.68 1221626.48 1152956.62 2202468.91 1074381.37
4-(2-Aminophenyl)-2,4-dioxobutanoate
11709.18 12181.97 11452.48 8945.85 10083.31 11107.85 10854.04 11552.37 11422.37 7725.95 8471.32 9174.35 8849.44 2303439.30 2894356.94 3026176.07 2858102.05 3644466.87 3410257.76 3125166.13 4083285.16 3105585.57 2994866.61 2733243.76 2823308.54 2574192.83
4,2^-Dihydroxy-4^,6^-dimethoxychalcone 4-glucoside
9616.35 11195.93 46654.88 7671.88 9052.14 12308.72 11858.81 11000.71 10429.05 7438.59 8108.80 8003.87 7136.59 1259848.80 1227763.30 1524900.41 1292745.24 1127607.11 1240535.21 1553120.53 1478880.11 1595622.58 1378756.78 1183757.87 1094149.56 1073145.67
4,6-dihydroxy-1H-isoindole-1,3(2H)-dione
9497.55 7766.07 7848.26 7544.95 8646.63 10229.37 10668.49 10544.05 10091.46 7253.42 7859.09 7920.94 7288.56 305436.96 332405.88 479015.48 406296.31 511588.90 514881.76 423525.60 384743.13 409847.65 437944.78 358000.74 419383.72 337124.37
4a,5-dihydroriboflavin
17794.43 15339.49 14218.75 13775.19 15580.11 19411.45 19991.02 20482.25 19342.51 13967.77 14534.15 14746.63 13305.10 913505.04 624227.12 802666.57 742089.33 791870.50 1203449.60 642178.74 632316.26 602332.84 740967.60 604833.97 710103.22 715425.50
4-ACETAMIDOBUTANOATE
101116.66 226585.40 251524.34 226426.12 275599.80 167291.17 252489.99 192902.10 215671.87 186409.18 177596.27 190295.66 233618.81 3082174.20 3494176.96 4319466.28 3680100.39 4584637.08 5483038.51 4621193.61 3810022.06 3808782.06 3281153.28 3236072.04 3871005.59 3004136.09
4-Acetamidophenylglucuronide
12695.79 273856.83 71083.25 10951.29 8805.99 56176.52 16465.36 14767.98 13612.63 10197.12 9624.28 8597.97 8781.00 17035617.05 19414731.72 22178977.64 22031676.65 23481123.20 30551323.20 21305720.63 20961058.54 28434992.65 19286505.71 18688320.70 15377588.41 23127107.28
4-Allyl-2-hydroxy-6-methoxyphenyl hydrogen sulfate
8546.58 9215.86 9248.96 7654.25 9072.79 12929.44 11665.93 10690.72 11050.59 7070.31 8689.94 7830.13 6595.52 520062.95 663915.81 880368.86 736556.89 818499.49 620636.52 955682.34 760297.06 900010.61 1187113.09 857351.47 651526.46 577225.56
4-Aminohippuric acid
15502.89 17823.83 66429.88 12355.94 13496.83 15019.72 16248.02 15773.11 15216.80 10824.69 10182.62 11326.09 11632.19 2320384.69 3560810.59 3832954.66 3124692.28 3681596.27 4148506.42 3224284.25 3483680.66 2770900.81 3077641.14 2690287.00 3111055.43 2581378.31
4-(beta-D-Glucosyloxy)benzoate
15786.31 18107.85 52753.40 11446.19 12571.29 17334.25 15095.47 16042.45 15503.67 10550.12 11773.89 12420.12 11230.49 1282917.89 1544116.43 1533240.61 1220313.29 1525240.20 2149613.27 1801827.56 1784500.56 1481666.08 1760388.66 1130102.61 1413786.77 1327379.78
4-Carboxypyrazole
69380.86 61756.42 117039.15 102101.93 81437.72 68537.13 82406.82 67383.32 68726.76 52597.47 69933.88 63505.77 47418.12 998561.84 943542.23 804537.18 910249.24 801602.63 909597.24 1502687.94 952960.30 1190378.85 994835.19 978670.92 985046.69 927391.96
4-COUMARATE
10439.18 26827.33 15654.09 20750.69 26476.00 10884.35 30076.25 11709.02 11304.91 11341.39 27393.48 16571.39 27326.45 214412.33 213138.98 247081.80 266655.91 235764.04 218181.67 244121.28 205657.60 197137.23 211880.39 257656.25 211734.33 228425.53
4-ene-Valproic acid
21926.18 37335.21 75761.59 12727.39 14718.06 13802.24 14826.96 20672.05 14853.15 12502.95 12099.40 10413.04 9482.33 2504601.55 2463860.13 2896253.41 2429235.87 2965303.25 3074650.33 2974270.36 2546551.36 2847664.62 2776489.76 2483032.15 2709172.01 2342690.74
4-Ethyl-2,6-dihydroxyphenyl hydrogen sulfate
10103.21 7126.35 8611.78 8360.86 8809.13 9548.98 9955.49 10274.81 10332.07 6844.19 7403.44 8295.67 7832.91 2253172.49 2757969.88 2639539.33 2752558.21 2640678.74 2803688.66 4891968.97 2843859.18 2088804.74 2241791.08 2395323.92 2506654.29 2087158.32
4-Ethyl-2,6-dihydroxyphenyl hydrogen sulfate_
13586.77 10632.50 18571.50 11043.47 12028.80 12801.02 13812.64 14198.37 13341.65 9297.53 9286.94 10555.63 10579.70 2227385.32 2692973.37 2424715.87 1739804.43 2322514.41 2802353.70 4503337.76 2183499.95 2686703.20 2374901.81 2648689.18 2179768.49 1620977.54
4-Ethyl-2-hydroxy-6-methoxyphenyl hydrogen sulfate
13801.46 11169.56 26902.47 11209.90 12081.80 13371.31 14492.41 13878.89 13629.13 9831.44 9419.44 10454.80 10687.70 2244707.22 3257121.75 2587164.11 2304477.82 2567741.66 3777091.01 3259907.23 3601144.03 2234943.57 2946236.11 3125750.57 2762722.93 1955050.36
4-Ethyl-2-methoxyphenyl hydrogen sulfate
9890.75 8348.81 7852.11 7588.71 8851.50 11230.24 11480.14 11165.40 10155.48 7625.70 7655.81 7809.76 7366.03 1634803.81 1476428.70 1830187.30 1490395.30 1802716.37 2205976.01 2867041.75 2129411.68 2640518.18 2083020.40 1984722.16 2332101.55 1602292.93
4-ethylphenylsulfonic acid
8923.47 8273.98 31414.65 6888.72 7795.82 9643.39 10029.39 9717.50 9459.67 6855.75 7448.89 7406.02 6641.37 3472654.48 3409093.07 4172544.77 3647856.45 3677396.64 4991758.77 4168069.76 3509774.30 3948989.45 4991392.06 3922419.12 3596394.34 2847911.08
4H-1-Benzopyran-4-one, 6-beta-D-glucopyranosyl-2,3-dihydro-5...
11949.89 10599.33 16115.33 9673.87 11102.00 14289.66 14478.70 13738.72 12903.33 9623.97 9573.83 9996.67 9238.85 739231.77 920709.68 741264.13 708046.17 706699.69 870233.27 518706.22 424319.31 532341.52 574923.09 673359.97 584658.56 498102.08
4-Heptanone
8979.62 7937.58 7822.88 7465.14 8465.08 10511.27 11045.44 10579.99 9859.05 7297.17 7297.23 7617.93 6775.33 247195.29 233571.24 459544.81 459283.33 522339.80 507446.01 410608.04 358464.96 333384.96 369376.36 329822.56 309539.36 241138.60
4-Hepten-2-one
17184.37 8568.18 15873.56 7584.48 19529.18 85932.36 15243.99 10117.84 11949.73 9107.22 25177.89 13568.05 6778.39 1047220.21 937892.38 1134881.27 1204612.37 1414711.34 1394890.82 1043323.58 995018.03 971225.09 1175932.13 931194.93 1073752.98 1009051.56
4-Hydroxy-(3^,4^-dihydroxyphenyl)-valeric acid
9326.94 9663.36 12297.41 7506.41 8538.66 10282.88 10615.69 10844.39 9986.41 7343.86 7932.60 7889.16 7380.47 624280.31 655421.81 796102.52 644805.04 792662.18 842939.10 678773.49 711063.78 659658.87 637851.71 677060.43 607467.33 577036.04
4-Hydroxy-3-methoxyphenylglycol sulfate
142347.31 48014.41 195089.10 65030.06 33261.74 45693.68 21737.25 23465.12 39867.18 15438.26 16764.11 27462.24 15931.25 1478880.20 1243830.49 1202528.00 1349393.87 1371455.90 1490318.48 1964492.77 1541279.43 1644712.63 1569155.63 1289495.52 1490317.05 1266102.93
4-Hydroxy-3-methoxyphenylglycol sulfate_
16307.57 14831.75 85622.14 29435.86 7032.28 10135.21 11742.54 10852.64 10289.56 7290.10 8574.42 8748.44 7104.80 541397.16 684961.84 722768.49 685408.07 941110.34 969572.00 1219842.63 680292.08 991160.96 602153.12 796677.30 835334.37 557247.02
4-Hydroxy-3-methylbenzoic acid
376643.09 570568.15 424750.32 457256.03 871143.75 446094.78 679448.59 472916.03 528065.42 444604.07 451950.11 412075.34 555224.56 1779341.54 1869714.54 1678814.35 1485427.54 1879732.52 1887891.93 2153906.22 1496873.66 1639603.09 1552470.48 1649374.82 1588389.85 1749831.63
4-Hydroxy-5-(2-hydroxy-2-propanyl)-2-methylbicyclo[3.1.0]hex...
10495.39 9040.54 12469.68 8217.16 9457.04 12860.80 12669.18 11772.39 11061.45 8087.49 8287.45 8505.69 7629.17 1619054.47 1819589.26 1533071.36 1524368.94 1665792.55 1971225.56 1516565.65 1553382.92 1585019.08 1900138.21 1535323.17 1488750.90 1524975.12
4-Hydroxy-5-(3^-hydroxyphenyl)-valeric acid-3^-O-sulphate
12825.03 9288.11 21456.50 10613.29 11182.32 12121.49 12637.51 13179.00 13115.54 8688.03 9397.93 10530.53 10095.86 2613022.26 2634505.34 2971428.23 2561086.36 2758191.88 3080339.18 3377473.53 2954826.93 2370228.14 2647578.08 2523594.29 2638325.21 2264596.16
4-Hydroxy-5-(3^-hydroxyphenyl)-valeric acid-3^-O-sulphate_
11322.75 9224.60 9559.95 8914.33 9858.47 12544.62 11634.90 12700.07 12313.71 8489.45 9491.62 9634.60 8686.55 805381.11 564858.55 687168.07 629996.10 774389.95 1394482.44 763827.16 802311.60 694606.79 738565.65 664356.84 754569.17 576556.90
4-Hydroxy-5-(4^-hydroxyphenyl)-valeric acid-4^-O-sulphate
12825.03 9288.11 21456.50 10613.29 11182.32 12121.49 12637.51 13179.00 13115.54 8688.03 9397.93 10530.53 10095.86 2613022.26 2634505.34 2971428.23 2561086.36 2758191.88 3080339.18 3377473.53 2954826.93 2370228.14 2647578.08 2523594.29 2638325.21 2264596.16
4-Hydroxy-5-(4^-hydroxyphenyl)-valeric acid-4^-O-sulphate_
11322.75 9224.60 9559.95 8914.33 9858.47 12544.62 11634.90 12700.07 12313.71 8489.45 9491.62 9634.60 8686.55 805381.11 564858.55 687168.07 629996.10 774389.95 1394482.44 763827.16 802311.60 694606.79 738565.65 664356.84 754569.17 576556.90
4-Hydroxy-5-(dihydroxyphenyl)-valeric acid-O-sulphate
19491.72 16005.64 90524.97 17022.49 14933.75 12715.39 13732.95 14116.45 13264.67 9159.79 9214.37 10526.08 10518.66 9348151.31 10518977.18 13389996.76 6719721.34 8901306.78 20041403.52 11919115.43 9490993.90 8436078.14 9380626.97 7774118.46 10038165.25 7341145.08
4-Hydroxy-5-(phenyl)-valeric acid-O-glucuronide
11809.78 12210.04 11618.18 8951.46 11538.90 24614.29 19003.23 13382.01 16109.17 9068.66 12020.61 11420.42 8035.32 626670.39 602429.72 521202.76 476629.67 1084245.94 818048.11 973193.14 759540.48 447273.76 526184.82 808914.98 576224.51 901004.03
4-Hydroxy-5-(phenyl)-valeric acid-O-sulphate
8900.34 7492.25 7206.34 7003.54 8088.42 10084.92 10459.11 10340.49 9554.79 6989.26 7292.78 7398.29 6872.55 750520.51 640450.35 586808.37 547518.15 1287502.14 994611.09 1083892.88 722488.53 662331.38 789403.46 1060705.05 724779.66 936477.70
4-Hydroxyandrostenedione glucuronide
11033.18 10040.30 10268.10 8820.45 10501.82 14825.03 14908.77 12474.25 11948.71 8787.99 9623.51 9578.45 8068.96 916898.83 763745.14 949939.92 913885.00 963597.41 844789.99 741581.36 915269.15 781158.84 842164.68 1018634.49 926108.88 773953.67
4-Hydroxybenzaldehyde
2605305.85 3274463.01 2376554.31 2452198.31 3295494.55 2576609.13 3663621.24 2580991.60 2727465.71 2688009.11 3055514.71 2510005.80 3019714.69 9379563.62 8249052.87 8346194.17 8398013.70 8454819.62 9075510.55 10005525.01 8568701.81 9303280.34 9590825.08 8960881.67 8388395.57 8724698.49
4-HYDROXYBENZOATE
409740.28 420738.48 373082.68 369604.15 450379.45 342146.97 434237.50 324032.79 336098.63 335481.09 396243.93 344305.09 418196.62 3539725.17 2993018.32 4001886.12 4449953.83 4940516.63 3272026.18 3974252.01 3172274.86 3397774.50 4051952.10 4301470.28 3434915.03 3913120.29
4-Hydroxybenzylalcohol
12386.75 17697.42 23049.97 9966.82 11210.85 12162.06 12399.37 12559.00 12374.71 8197.43 11512.26 9869.26 9939.03 1716623.21 1545649.64 1347943.10 1318227.35 1300839.70 1539665.88 2347600.14 1516251.19 1869836.21 1790157.25 2049699.34 1453113.02 1284221.29
4-Hydroxybutyric acid
284702.34 251403.45 452895.77 247576.11 236063.94 206869.29 218975.47 227878.00 224922.62 182453.43 194007.39 192383.00 146281.46 13589187.92 7853530.55 12320038.33 11147003.24 12754123.15 15563551.74 12631983.34 11259094.19 10427295.59 10812991.81 8502414.62 8849940.10 8925723.43
4-Hydroxybutyric acid_
517313.02 701387.96 811631.70 642933.85 721528.59 573171.68 683060.87 651308.75 514724.04 549551.58 546731.68 534168.64 528183.11 17546847.44 14498580.96 20796199.13 16418661.79 20947131.56 25177666.83 21823673.16 16464514.95 16657760.13 14563531.82 13505047.39 14774242.91 13346328.90
4-Hydroxycyclohexylcarboxylic acid
436817.16 359839.79 251300.92 227792.98 231417.95 245490.21 512251.84 337578.90 427777.28 337168.99 273662.88 234462.92 300897.97 2090575.28 1728813.05 1650121.33 1342484.02 2633018.81 2346699.04 1870414.10 1431003.40 1413430.44 1410908.01 1306771.05 1479984.21 1440339.29
4-Hydroxyhippuric acid
98665.84 194671.60 379835.79 325529.32 288500.94 96044.68 70030.46 36345.40 95365.83 87093.57 26576.65 100948.28 133955.66 8665930.63 14971213.41 15752503.89 12827422.22 17166810.00 17335196.63 12847508.13 12004991.37 10490340.55 12074297.96 9795772.20 13479516.24 12816506.69
4-Hydroxynonenal
16667.94 13678.39 14247.53 13278.11 15051.18 20616.51 20056.72 18339.15 17510.40 12761.75 13337.24 13411.44 11955.95 800498.89 705723.36 833407.35 860214.25 1070727.23 859366.63 821363.69 723938.57 882284.73 950364.29 780147.03 908797.78 821350.80
4-Hydroxyphenylacetaldehyde
125977.83 156500.15 113278.82 131295.13 227052.98 126845.76 149025.17 138266.56 139662.91 110302.88 151259.22 127597.82 128967.60 321312.16 411717.56 339067.30 353165.05 361261.85 391004.39 431285.93 373093.04 440673.59 409471.59 449693.75 372281.35 394025.62
4-Hydroxyphenylpyruvic acid
90272.73 89646.50 105882.79 87203.58 62324.99 52210.11 86834.44 71648.62 37679.82 60741.77 63972.66 63842.82 84624.99 385503.35 438634.98 496740.12 458371.21 512066.08 569164.58 566017.80 445274.77 483089.74 449329.64 463345.01 467721.79 374519.29
4-Hydroxyprolylvaline
14062.09 8957.05 10180.44 11564.46 12570.38 13207.94 14744.63 14571.00 13863.31 9391.62 9626.26 11033.83 10898.54 328362.55 440838.08 434826.32 339443.51 387992.16 510165.41 447334.26 344695.29 334361.82 335632.18 328333.40 376833.57 299580.00
4-Hydroxypropofol
10877.79 9410.17 8994.34 8609.44 9574.33 11759.63 11763.19 12163.26 12052.81 8373.93 8833.83 8876.77 8188.26 425070.67 391619.77 437380.30 462662.03 574176.61 788926.37 466337.86 394199.21 377674.90 390578.80 604060.24 330123.22 539976.32
4-Hydroxyvalproic acid
25603.62 28371.47 24352.38 30106.16 26377.66 21303.40 95615.83 66705.68 82582.66 51445.31 36875.61 20107.21 19929.77 238499.53 267818.66 292604.18 333634.79 292973.16 290597.02 477604.94 304394.70 361198.19 335302.95 287652.90 270364.62 246618.80
4-Indolecarbaldehyde
129207.77 204163.75 208384.58 201400.46 415743.55 202353.19 250866.11 183260.17 224466.39 207558.76 199895.12 179503.58 191732.65 2794131.64 2443391.86 3060067.55 3362686.41 3325607.54 3549048.01 4640174.40 3530104.62 3218827.68 2946192.99 3735034.89 2914374.68 2311883.43
4-methoxy-3-(sulfooxy)benzoic acid
31878.12 52347.16 136285.85 24396.43 28096.18 35553.96 39217.15 38668.79 34148.73 27429.20 22332.90 25495.29 25047.23 5803330.39 9489268.29 11467564.67 5404209.05 10297278.73 13926298.73 8311824.56 7232996.72 6454299.25 5393709.84 6909304.62 8002047.70 5349937.62
4-Methylhippuric acid
12613.83 17709.97 29254.23 11333.44 28150.39 12539.46 12119.45 12818.49 12459.02 8545.01 11320.60 10310.05 8886.59 826266.15 2828581.39 1165655.43 825690.09 2428877.46 1398649.25 2709194.17 963384.67 885180.78 982861.39 1065433.23 914059.60 857090.55
4-Oxo-9-cis-retinoyl-beta-glucuronide
9395.24 7692.94 12762.53 7814.04 8796.36 11613.81 12636.42 10621.96 10694.54 7228.49 11061.65 8352.92 7506.63 396309.54 511305.41 383347.94 289808.88 519065.89 544571.12 517385.19 356571.59 345861.25 400873.62 334229.03 330646.02 293038.02
4-oxoglutaramic acid
65670.98 63719.07 254963.04 55414.98 38225.01 80278.08 80510.13 71099.52 71288.62 72293.69 60486.07 59611.62 39459.64 2609703.03 2840222.95 2953728.11 2911151.36 3138420.56 3180235.79 3887503.47 3430711.55 2837448.77 3081294.94 2566153.22 2905915.63 2755267.34
4-Pentenoic acid
72082.88 205116.71 312534.13 138537.44 219758.13 120456.01 170601.50 116594.09 121631.08 113678.58 173724.84 241779.96 132568.28 3602821.35 5173224.33 5532147.07 4621640.06 6485216.14 8174252.91 5369925.52 6201098.75 4886694.54 5170589.46 4438270.11 5161597.11 3397472.46
4-Pentenoic acid_
63975.09 109606.25 145022.69 94955.02 119707.55 81823.46 111327.52 75466.86 80473.89 45541.14 54598.00 73638.85 41360.89 1323499.63 828028.25 942895.78 1123634.55 920788.00 1324650.24 1242814.22 1133759.36 973828.31 1073922.14 979731.86 838455.33 964733.92
4-Phenolsulfonic acid
625990.71 706950.80 2278786.11 460783.97 309784.09 226735.45 28524.24 29110.70 131588.56 20138.48 20185.50 58734.30 18217.84 91324099.32 89319553.85 84226446.39 84428320.48 96386423.44 113327015.86 115231365.87 113885464.55 112102768.74 104334870.73 113135586.27 81926129.48 77181611.06
4-phenylbutanic acid-O-sulphate
7630.27 5020.35 6069.41 5810.80 6498.39 7103.31 7111.90 7451.77 7351.74 5023.16 5406.92 5964.87 5595.85 946042.46 991303.43 1074329.64 1015825.68 1530548.08 998299.65 1609028.01 1193377.32 1303533.47 1470254.94 1252960.75 1141310.68 1003523.63
4-PYRIDOXATE
36965.01 50428.58 258556.64 53900.65 59000.76 37098.77 21975.49 20298.85 18743.62 14317.55 20140.48 23091.69 16798.94 8949904.44 14647002.57 16279367.84 13429958.31 20062654.52 21040155.79 20466271.22 22783672.61 13926812.37 13572532.89 12957494.98 12880320.62 8810978.26
(4S)-4,8,10-trihydroxy-10-methyldodec-2-en-1,4-olide
219928.72 293730.43 491691.49 196047.57 387368.72 691590.21 517028.66 349759.73 676537.20 322365.14 430699.90 402540.91 217851.46 944819.46 608877.23 593739.70 696942.16 732995.04 803819.87 839910.13 901118.56 803028.14 1128005.51 1013668.85 745963.80 722926.90
4-vinylguaiacol sulfate
9274.88 8331.00 9068.68 7692.94 8429.93 10171.14 10053.65 10613.91 10498.01 7281.37 8074.73 8367.67 7277.27 1353086.12 1321694.38 1571206.87 1388853.18 1709884.39 2126158.71 1754803.67 1533567.94 1613608.26 2033260.25 1530029.29 1549642.91 1265424.13
4-Vinylphenol sulfate
12181.57 28788.26 61913.71 11214.14 14028.53 11856.83 9993.45 10278.81 10122.09 6960.81 8024.97 8725.77 7160.35 5696064.46 5781231.91 6488251.50 5614116.77 6732684.59 9022922.41 7410391.27 6363328.52 6522876.18 7182078.70 6276194.43 5940568.53 4961438.55
5-(1,2-Dihydroxy-2-propanyl)-2-methyl-1,3-cyclohexanediol
9382.46 10098.03 22939.02 7716.69 15643.27 14804.11 14467.39 10670.94 10962.42 7542.12 9670.16 9047.45 7548.89 1259740.11 1513873.48 1801113.91 2597407.38 1623559.21 1822251.60 2220244.41 1787762.80 1335980.94 1507104.65 1472730.65 1789432.97 1252581.34
5-(1′′,3′′-dimethyl-2′′-hydroxyl-butyl)-2-en-2-m...
12101.50 12808.18 13760.35 9977.60 13137.33 18810.57 51694.10 14956.15 15642.26 11771.33 9974.47 8899.91 8215.42 201615.49 266360.14 262668.83 246292.34 308364.72 271181.91 283692.72 321124.66 271973.86 306098.44 305844.28 321179.60 264762.19
5-(2^-Carboxyethyl)-4,6-dihydroxypicolinate
38987.43 19349.84 54727.73 26681.30 12530.03 38133.80 36990.82 55533.35 36469.84 17773.76 27575.84 22011.16 35747.54 615913.59 665973.00 562659.40 666648.55 596901.10 584229.46 786932.88 626689.70 663529.70 706725.53 651409.51 591638.74 577886.62
5-(3^,4^,5^-Trihydroxyphenyl)-gamma-valerolactone-3^-O-sulph...
14829.95 11546.04 38347.96 12150.43 13455.39 14786.31 14732.67 15195.70 14943.90 9912.88 10806.67 11959.71 11676.05 2295515.09 2322417.12 2517056.46 2069273.61 2977131.28 2632397.92 2140966.57 2130362.57 2024937.13 2266220.00 2120927.85 2125873.63 2179260.17
5-(3^,4^,5^-Trihydroxyphenyl)-gamma-valerolactone-4^-O-sulph...
14829.95 11546.04 38347.96 12150.43 13455.39 14786.31 14732.67 15195.70 14943.90 9912.88 10806.67 11959.71 11676.05 2295515.09 2322417.12 2517056.46 2069273.61 2977131.28 2632397.92 2140966.57 2130362.57 2024937.13 2266220.00 2120927.85 2125873.63 2179260.17
5-(3^,4^,5^-Trihydroxyphenyl)-gamma-valerolactone-O-methyl-O...
8519.19 6332.71 7933.88 7067.74 7847.62 8213.04 8493.13 9043.25 8607.51 5875.77 6337.54 7231.57 6874.25 1234801.90 1550408.21 1905135.40 1346554.07 1760560.14 2157211.42 2438544.63 1648176.11 1718136.33 1735962.73 1651975.04 1523124.65 1404933.45
5-(3^,4^-dihydroxyphenyl)-gamma-valerolactone-3^-O-glucuroni...
13610.51 13384.79 13425.62 10794.69 12995.88 25609.28 21432.21 15417.52 16263.81 10539.33 13733.43 13503.61 9886.56 233699.33 259556.89 280614.54 238468.95 323421.68 315394.15 266267.81 241078.28 233754.85 292727.18 254948.77 290565.96 248298.70
5^-(3^,4^-Dihydroxyphenyl)-gamma-valerolactone 4^-sulfate
262959.42 191646.70 943239.04 177470.08 134234.90 46235.50 11200.47 11431.21 11263.47 7439.08 8204.86 9072.87 8876.68 50765197.96 51981280.13 50072828.07 49733943.28 51087422.42 57222113.26 63931152.72 58476306.09 49470154.73 60114739.24 57156659.82 53130936.39 41812918.25
5^-(3^,4^-Dihydroxyphenyl)-gamma-valerolactone sulfate
262959.42 191646.70 943239.04 177470.08 134234.90 46235.50 11200.47 11431.21 11263.47 7439.08 8204.86 9072.87 8876.68 50765197.96 51981280.13 50072828.07 49733943.28 51087422.42 57222113.26 63931152.72 58476306.09 49470154.73 60114739.24 57156659.82 53130936.39 41812918.25
5-(3^,5^-Dihydroxyphenyl)-gamma-valerolactone 3-O-glucuronid...
10193.36 11061.34 69663.16 9302.21 11772.10 9801.17 10077.12 10739.03 10576.68 7020.29 7533.42 8587.62 8163.29 1214595.18 1786911.50 1694726.66 1046708.68 1346688.79 1831524.41 2052997.80 1198278.59 1119286.15 1278962.66 1107841.98 1526743.39 1434573.41
5-(3^-Hydroxyphenyl)-gamma-valerolactone 3^-glucuronide
15456.35 29962.38 30178.26 12278.88 14052.83 16123.60 16198.94 17189.95 16205.66 11336.22 13624.38 12892.48 12190.14 1597997.27 1469951.52 1775243.86 1431943.42 1772507.15 2007150.79 1808937.05 1605626.45 1514437.14 1702846.67 1341894.50 1453768.14 1426313.39
5-(4’-hydroxyphenyl)-gamma-valerolactone 4^-glucuronide
13747.60 21834.26 11889.51 11079.35 12588.18 17400.04 17725.03 15113.57 15944.43 10398.52 15633.41 11822.58 10827.42 638572.59 988166.68 1029300.41 796056.11 1055131.56 1036058.31 955579.62 836804.12 819506.99 860290.87 808286.30 806158.80 801640.68
5,6,7,3^,4^,5^-Hexamethoxyflavanone
10984.12 9009.43 10583.67 8087.97 10379.62 17648.61 14209.66 12205.36 12592.73 8343.16 8689.36 9195.87 7610.83 486137.98 472879.63 658087.11 686650.55 610191.15 603421.78 725474.02 529749.10 506850.22 601249.70 520596.88 557515.83 518687.34
5,6-Dihydrouridine
82122.95 75320.73 290023.09 68058.10 36889.30 32997.77 15701.07 11078.41 12074.88 9056.75 16748.22 29777.11 6714.25 4269772.19 5046650.94 5059145.01 4633778.09 5664680.66 5546856.12 5230388.26 5641041.07 4687061.94 5334986.16 3643693.29 5481553.22 4515190.14
5,8,12-Trihydroxy-2-oxododecanoic acid
9043.43 7883.41 7684.41 7547.05 8531.56 10900.42 10990.05 10929.75 9856.48 7410.64 7662.53 7822.01 7321.32 228764.90 151368.35 229437.17 241364.66 288662.73 281764.29 205693.64 137790.35 157390.31 195086.09 131258.99 175689.49 216067.47
5-Acetylamino-6-amino-3-methyluracil
454068.69 207714.19 699046.80 359200.38 197250.46 197119.18 33184.16 32923.74 32346.14 21661.31 23521.60 62760.89 22353.02 6082656.56 7292068.90 7488873.16 7711684.25 8955725.62 7237828.58 8072311.73 7657658.61 6519780.50 6838984.27 7216149.39 7348676.42 6601830.92
5-Acetylamino-6-formylamino-3-methyluracil
15884.31 115009.35 75772.42 38683.97 29123.44 17415.25 19613.77 18424.98 17665.61 12762.15 12253.69 10402.32 10665.74 1914724.76 2037055.54 2467589.24 2031770.71 2996054.36 3284009.03 2428131.32 2674694.40 1951778.89 2189010.22 1685703.38 2219037.36 1930750.86
5a-Dihydrotestosterone sulfate
11508.12 8253.43 25786.16 8391.23 9328.15 14253.74 14459.39 11625.54 11255.87 7969.87 7633.27 7973.59 7393.05 1082177.92 1264197.51 1134122.47 1114375.03 1245338.57 1380374.91 1469527.47 1183461.33 1230826.68 1617109.68 1305481.22 1506263.32 1184006.35
5alpha-Dihydrotestosterone glucuronide
142499.29 125309.97 531159.02 101978.84 102851.15 45891.15 21374.51 13318.04 34621.82 9550.08 10424.68 32178.83 8030.25 25967108.84 27610229.92 28989620.54 25119853.92 31798010.20 32151776.82 28746964.00 25958578.14 29905642.45 32914853.84 30657337.75 29659782.35 30138615.31
5-aminosalicyluric acid
23480.90 15747.08 23288.05 14732.98 10082.76 22675.55 22780.64 22601.86 22502.02 14977.82 16147.37 18868.20 15345.15 280411.27 281897.97 290185.88 282005.71 279973.39 328653.69 283557.34 301838.39 236855.81 258837.74 239555.59 272446.07 255944.63
5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one
41091.89 18811.97 47594.97 20254.79 14165.70 21267.51 20033.56 21626.00 21246.61 14228.26 15450.20 18053.55 14682.61 319702.08 319311.17 355156.68 344753.77 364377.23 469153.18 355847.65 371401.51 273255.80 319773.83 235077.77 337279.50 305273.65
5-Ethyl-2-hydroxyphenyl hydrogen sulfate
12433.97 38816.00 49166.94 9477.89 11018.61 10988.59 10726.64 11824.60 11293.90 7904.24 8781.72 8970.45 8086.87 7713491.21 7730503.71 8989031.93 7247698.26 9469710.52 12052647.87 11030047.33 9233057.52 9567154.71 9438653.24 9406988.93 8578333.07 6832752.64
5-Ethyl-2-hydroxyphenyl hydrogen sulfate_
10430.01 8912.90 47014.51 7574.35 8298.19 10096.20 10625.93 10617.71 10887.96 7382.42 7820.04 8088.94 7557.51 4813475.05 5271630.75 5169574.17 4098043.01 5160366.12 7328800.34 7230487.43 5156644.98 5131435.10 6020296.31 4390257.57 4740751.81 4093579.79
5-Hydroxy-6-methoxyindole glucuronide
12473.09 9011.53 10790.13 9726.55 10773.41 14890.57 12143.27 12708.21 12340.17 8637.61 9836.92 10749.81 9373.70 5415691.13 5240091.53 4471014.91 5600589.68 3200954.09 4140655.36 5927702.72 4392027.79 4584165.34 4694270.70 4093225.70 5553280.24 5361440.30
5-Hydroxy-6-methoxyindole glucuronide_
11284.18 7115.60 8169.33 9279.94 10087.15 10598.76 11831.89 11692.55 11105.04 7536.34 7724.63 8691.18 8745.57 1016856.85 1304506.17 1025980.83 939389.40 710468.52 866795.58 1356081.13 1180269.38 938958.38 995723.60 911196.03 1566155.20 970712.72
5-Hydroxy-7,4^-dimethoxy-6,8-di-C-prenylflavanone 5-O-galact...
10122.41 8098.58 8755.05 8088.16 8978.37 12655.96 12483.04 11002.73 10306.00 7760.25 7400.76 7780.50 7111.65 264526.79 257626.03 310236.03 261354.36 260786.16 257552.85 269736.77 272733.06 302185.25 317576.79 263771.57 265693.26 246450.05
5-Hydroxyferulate
9482.37 8290.59 7550.18 7796.42 8840.50 11169.92 11410.74 11310.63 10462.32 7624.34 7947.44 7840.19 7463.11 268704.74 255252.89 323902.69 293795.49 343698.03 363257.49 260004.42 276929.02 260438.82 293007.38 227694.71 267447.75 259794.31
5-Hydroxyhexanoic acid
194642.32 196926.92 165704.14 146507.16 233425.15 159467.12 251789.26 151182.08 174907.16 161798.55 184662.75 133152.16 142725.74 2775860.92 2995300.30 3779771.99 3216738.09 3675129.71 4318458.46 3920947.07 3222894.75 3360999.05 3336152.97 3506751.09 3169044.42 2686784.60
5-Hydroxyindole-3-acetic acid
8847.16 11769.78 19046.21 7359.23 8329.56 10997.49 11965.83 10106.98 10442.51 6844.89 10553.82 7909.65 7108.27 1435862.24 1910415.58 1942892.24 1948102.57 2474057.44 2443562.12 1758330.10 2162960.67 1826023.67 1923596.08 1647361.46 1921686.86 1608402.70
5-HYDROXYINDOLEACETATE
10229.39 12281.30 19931.82 8230.93 11686.32 10043.83 10239.81 10371.64 10219.45 6769.71 7444.35 8150.37 8053.89 710362.68 1034039.39 1031412.49 879355.50 1291795.99 1003094.92 934439.73 1032628.94 827923.96 938686.72 901800.07 1016143.46 912632.58
5-Hydroxyindolepyruvate
11874.08 8104.54 8460.25 8729.00 9819.79 11669.34 12314.25 12268.35 12124.12 8189.44 8876.37 9128.08 8423.78 184079.24 295442.74 334757.99 261767.88 328727.07 387006.06 302062.97 263034.73 271685.68 280462.31 224623.14 264234.36 227060.98
5-HYDROXYTRYPTOPHAN
16173.57 11494.77 21311.27 10471.64 11368.88 18980.33 21058.87 19420.61 18026.45 13306.99 12461.81 12295.08 11596.99 826682.76 1283202.34 1492537.98 1131429.84 1614335.81 1603550.72 1286069.20 1099173.06 969814.47 984156.29 901080.30 1277495.21 970211.55
5-Hydroxyvalproic acid
25603.62 28371.47 24352.38 30106.16 26377.66 21303.40 95615.83 66705.68 82582.66 51445.31 36875.61 20107.21 19929.77 238499.53 267818.66 292604.18 333634.79 292973.16 290597.02 477604.94 304394.70 361198.19 335302.95 287652.90 270364.62 246618.80
5-METHOXYINDOLEACETATE
9922.68 10208.18 70359.41 11618.29 18398.92 10432.97 10594.91 10282.66 9892.17 7192.84 7672.93 7508.06 6997.75 4704550.23 5417556.46 6126412.51 6192105.98 6294716.63 7264196.11 5423428.75 6482930.74 5180588.34 6462384.25 4295698.48 6750343.80 5329887.46
5-Methyl-2-hexanone
8979.62 7937.58 7822.88 7465.14 8465.08 10511.27 11045.44 10579.99 9859.05 7297.17 7297.23 7617.93 6775.33 247195.29 233571.24 459544.81 459283.33 522339.80 507446.01 410608.04 358464.96 333384.96 369376.36 329822.56 309539.36 241138.60
5-Methylfuran-2-carboxylic acid
36985.89 295715.68 176954.78 49449.83 111441.55 26243.02 41984.61 25084.41 20221.25 42701.02 31962.34 22213.08 31438.24 523527.64 598049.93 730241.45 636000.24 697418.51 710075.77 723631.07 571262.98 627216.74 617777.72 640842.70 574080.85 487743.47
(5-Oxo-2-sulfo-2,5-dihydro-2-furanyl)acetic acid
17794.08 12610.14 10729.75 11860.46 12344.65 20394.84 23077.41 21026.15 19079.10 14292.00 13489.13 12505.48 12307.21 536636.89 708489.39 1025271.81 970385.61 1231015.83 977123.15 795714.26 665569.49 596229.17 536649.09 652989.52 750570.78 661191.19
5-Sulfosalicylic acid
21125.51 52429.74 159854.02 19736.77 23744.40 23046.91 25371.73 24484.05 22370.92 16965.14 15401.58 15834.66 15289.24 6800702.26 12178807.97 15933699.16 10132399.49 17800681.91 19892680.65 12144229.84 11037445.31 9836644.05 8308896.92 9886340.04 10740900.98 7062240.38
(5Z)-2-Amino-4,5-dihydroxy-5-{[3-(hydroxymethyl)-2,5-dihydro...
69889.36 57081.32 47903.43 56209.38 36508.66 76673.51 76895.14 67907.08 68087.69 54424.40 57770.18 56935.00 43033.08 793157.78 765049.01 844678.80 753063.49 863519.48 888813.44 908188.93 922006.31 726016.29 835080.21 538306.51 815613.15 767555.57
6-[3-(2-carboxyethyl)-5-hydroxyphenoxy]-3,4,5-trihydroxyoxan...
15447.43 26448.12 63226.07 12293.69 14899.77 14877.81 14897.88 15753.61 15321.45 10260.50 10763.68 12328.88 11962.04 1594454.98 2248445.01 2966253.74 2389979.39 2074171.73 4788526.76 1733793.81 2382733.41 1471702.53 3251840.77 1940401.34 2431254.11 2143578.61
6-[3-(2-carboxyethyl)-5-hydroxyphenoxy]-3,4,5-trihydroxyoxan...
14778.18 18274.41 27663.72 12098.32 14700.68 14336.90 15566.41 14919.99 15081.14 10525.49 10877.27 11428.91 11535.25 1818043.18 1835987.59 2210673.96 1893221.03 1880197.67 3212908.66 1713246.86 1838844.87 1261204.42 2323360.69 1612895.13 1765560.49 1505587.31
6-[4-(2-carboxyethyl)phenoxy]-3,4,5-trihydroxyoxane-2-carbox...
12080.98 8880.07 19428.14 10089.07 11004.37 11576.50 11935.40 12680.94 12478.79 8239.32 8886.84 13506.50 9639.44 1546847.01 1644340.30 1835945.49 1331358.18 1519491.28 2149369.58 1956876.19 1494021.36 1561230.88 1379815.36 1419634.38 1555796.69 1359858.66
6-beta-hydrocortisol
10958.46 8615.09 10119.22 8822.28 10034.03 14654.10 14275.23 12233.38 11496.27 8144.34 7992.27 8481.82 7549.63 169028.29 170461.24 190320.08 164841.73 206040.33 207546.58 179734.04 202801.81 199347.28 207894.01 219589.86 202090.51 186928.50
6-bromoindole-3-carboxaldehyde
8524.81 7102.64 7681.52 6862.99 7762.42 11269.85 10947.15 9496.24 8758.93 6522.84 6715.66 7129.11 6041.74 428176.47 501047.59 552523.78 540465.37 658907.51 586920.18 702754.64 608264.97 624626.09 639233.80 579720.44 545535.93 446843.33
6-CARBOXYHEXANOATE
192280.65 175717.20 223304.23 138098.64 177432.99 645929.50 177136.19 133116.44 155367.00 133461.06 410722.65 131273.24 132966.30 5116465.97 5076829.25 5841027.90 5607700.29 6671406.14 8279077.72 6490516.45 5296290.88 5260518.67 5755196.16 4659911.70 5134166.90 4787228.16
6-[(E)-Hept-1-enyl]-alpha-pyrone
211634.60 240796.47 464115.62 125948.76 136988.38 140916.25 161819.67 73091.95 85663.52 93923.34 95731.73 92900.06 105976.14 41477590.18 32693994.63 38090994.17 43108669.14 45701281.11 62708321.55 43001742.89 33299012.76 30963978.41 33692939.82 43880348.97 29960197.82 46741277.14
(+/-)-6-Hydroxy-3-oxo-alpha-ionol
11456.82 8448.96 11694.91 8574.10 9135.20 16058.60 17145.22 13248.95 18856.55 11801.18 7801.38 10103.14 8981.68 381645.82 312289.29 308891.27 279080.90 363998.27 360236.62 436968.73 302985.78 427404.77 371348.76 500364.84 387835.13 342570.82
6-Hydroxy-5-methoxyindole glucuronide
12473.09 9011.53 10790.13 9726.55 10773.41 14890.57 12143.27 12708.21 12340.17 8637.61 9836.92 10749.81 9373.70 5415691.13 5240091.53 4471014.91 5600589.68 3200954.09 4140655.36 5927702.72 4392027.79 4584165.34 4694270.70 4093225.70 5553280.24 5361440.30
6-Hydroxy-5-methoxyindole glucuronide_
11284.18 7115.60 8169.33 9279.94 10087.15 10598.76 11831.89 11692.55 11105.04 7536.34 7724.63 8691.18 8745.57 1016856.85 1304506.17 1025980.83 939389.40 710468.52 866795.58 1356081.13 1180269.38 938958.38 995723.60 911196.03 1566155.20 970712.72
6-Hydroxy-5-methyl-4,11-dioxoundecanoic acid
34165.95 99052.72 154045.73 42712.51 57294.02 36559.50 20953.83 14723.17 19917.92 16295.01 14560.45 12895.46 11543.38 7513804.65 5779144.13 7732566.31 6883609.63 13906786.37 10126204.17 6708469.10 6655733.15 6106376.97 7247957.19 6299317.88 7480927.05 6884459.09
6-Hydroxydaidzein
9396.02 7903.34 24630.33 7506.55 8533.81 12146.63 11681.02 10665.14 9767.06 7098.38 7225.46 7667.44 6683.94 502304.95 714883.12 697342.90 657343.17 897836.55 564196.09 768930.34 569473.41 849773.56 1982221.51 655190.28 586354.32 681219.72
6-Hydroxyindole sulfate
14843.73 27393.76 97113.60 17735.58 10444.84 11115.38 11891.99 12001.50 11616.93 8073.23 8064.03 9165.66 9159.96 6112940.51 8113286.37 7044228.73 6007424.13 6941996.66 6863896.93 7507232.25 7293323.10 7942840.45 8029364.13 8127312.45 6549331.55 6206992.06
6-Hydroxysordarin
18102.38 14151.41 15129.26 13554.50 16060.62 22872.17 21773.71 19095.17 17977.39 13351.38 13325.15 14041.25 12355.01 1208108.95 876990.46 1072827.40 1047018.90 1147876.65 1108567.57 1155207.32 1279827.84 993176.40 1007932.64 1189816.03 1067354.22 888920.58
6-Methoxy-2(3H)-benzoxazolone
126652.29 273387.70 230970.73 244191.40 301709.08 162899.87 234122.91 202253.91 228727.61 231219.42 224983.64 202983.86 228976.90 947064.85 1144029.12 1180425.33 1173933.22 1303337.84 1218179.77 1502609.26 1239257.42 1379583.54 1319333.56 1227530.16 1132851.38 992391.91
6-Methoxyluteolin 7-sulfate
8292.41 6440.25 6760.88 6872.03 7604.44 8956.82 9393.76 9266.36 8937.92 6298.32 7270.05 7267.22 6557.27 275317.14 315216.67 234947.68 264698.75 238522.97 246898.22 445031.31 215833.65 391536.31 283709.95 345511.63 330682.87 230794.31
6-[(methoxythio)carbonyl]pyridine-2-carboxylic acid methyl e...
8805.91 6917.41 7179.54 7297.58 8075.34 9511.46 10171.42 9932.38 9677.28 6729.98 8976.83 7717.23 7010.48 1533300.54 2300339.21 1839329.02 1784573.09 1786441.69 1732029.08 2193970.07 2305412.78 1933713.99 2714475.45 2228880.79 2289470.01 1593890.54
6-O-alpha-D-ribosyl-8-O-methylasperentin
9310.19 7753.42 7786.28 7489.18 8485.01 11169.15 11085.40 10443.43 9806.10 7267.32 7283.88 7488.28 6777.89 187722.91 188331.96 200191.22 191306.78 197659.08 234044.18 182906.33 181949.56 220032.03 242042.22 211885.96 199215.02 191346.40
6-Oxopiperidine-2-carboxylic acid
51369.67 34734.72 89148.57 45724.09 34701.65 28624.50 26698.99 26489.46 29526.51 22055.21 18924.78 24190.43 29053.58 1060506.50 1006144.41 959884.40 998607.13 1056410.70 1342089.06 1296010.11 1039368.93 1029132.41 1058508.82 993412.27 954631.94 958324.30
7,8-Dihydro-7,8-dihydroxykynurenate
10648.06 17875.40 56518.21 13841.78 11550.77 12613.01 10366.50 10649.26 10609.85 7307.01 8128.02 8959.75 8003.61 1227503.94 1615822.38 1637193.87 1530894.46 1785915.04 2008075.41 1524963.64 1358632.47 1266359.68 1221626.48 1152956.62 2202468.91 1074381.37
7alpha,12alpha-Dihydroxy-3-ketocholanic acid
14545.94 11245.38 17051.40 10309.51 21477.32 30287.42 25937.26 16382.22 25551.41 12260.48 14317.27 12965.94 8695.91 192242.11 213423.81 180714.86 160683.71 174093.11 208772.18 236639.20 166983.56 231529.36 201264.53 270622.57 207692.63 170039.74
7C-aglycone
9924.42 9143.41 9332.53 7635.51 9540.55 16599.07 14258.37 10573.25 11122.52 7510.61 8770.04 8802.48 6631.37 583585.90 626880.04 717530.58 762992.17 775721.52 745866.45 1351372.39 1439261.95 1344204.53 961150.35 1154965.81 775527.16 648612.00
7-Deoxyloganate
11969.49 10892.35 11308.37 9637.96 11393.04 16083.13 16173.98 13532.85 13909.49 9533.77 10440.19 10391.31 8771.47 350206.76 369560.12 404102.69 377922.82 577448.75 463697.82 391957.43 349324.27 357133.33 413225.27 351428.53 427242.20 371124.03
7-Hydroxy-4^-O-demethylsordarin
75692.11 8981.87 220282.24 41128.28 49245.98 16297.46 18348.59 14205.34 13436.88 13776.56 7869.69 8186.34 8085.30 6848615.07 6872808.19 6509011.58 8820712.42 10813749.06 9966876.17 8294543.20 5654085.92 6181581.43 7425565.72 8747201.60 7294443.04 8507025.24
7-Hydroxyindole sulfate
14843.73 27393.76 97113.60 17735.58 10444.84 11115.38 11891.99 12001.50 11616.93 8073.23 8064.03 9165.66 9159.96 6112940.51 8113286.37 7044228.73 6007424.13 6941996.66 6863896.93 7507232.25 7293323.10 7942840.45 8029364.13 8127312.45 6549331.55 6206992.06
7-Ketodeoxycholate
10994.47 8894.65 11630.91 8830.67 14699.81 17829.88 19754.82 12184.45 15606.46 9644.77 10354.94 8739.67 7501.26 296326.31 294194.22 318615.49 256088.53 286540.37 348213.06 372538.60 264807.68 290824.66 405181.13 393363.65 350271.09 261861.91
7-mercaptoheptanoylthreonine
13365.58 11040.99 10848.02 10700.65 12012.09 15072.81 15312.67 15007.45 14145.81 10541.62 10966.81 11141.08 10410.55 316291.74 359625.83 407873.94 387342.89 507130.39 537573.75 412740.56 330170.25 267872.84 401551.92 318995.51 392647.63 400429.46
7-Methyluric acid
576731.85 49971.22 433472.94 207724.96 100813.16 169460.20 38152.47 36564.74 35586.95 25084.50 27043.24 44223.50 25237.46 6836586.82 6993512.00 7452784.30 7074869.46 7321116.62 8671399.34 8313939.79 7563901.46 6619659.08 7092652.13 6753929.43 7344614.80 6623383.18
7-Methylxanthine
62356.40 39714.29 96182.15 115586.14 505297.85 57885.47 57452.98 57002.10 58933.05 39113.42 40723.83 47585.79 38700.62 3534988.55 3097951.08 3378860.18 4001284.58 3226150.41 3031358.68 3678469.95 3527338.65 3712088.71 3966520.05 3316637.50 3015146.91 3352457.41
7-O-(alpha-glucosyl)-cineromycin B
12940.43 10334.85 13768.56 9537.67 12436.12 20732.26 22490.44 13884.25 16930.50 9860.75 10677.14 10470.39 8338.02 773468.37 627794.48 713291.22 613545.32 823579.37 926506.99 587584.00 632720.65 585842.24 718110.14 757856.46 891270.76 704888.51
7-O-beta-D-galactosyl-brefeldin A
11775.66 9549.09 12980.67 9477.28 11706.84 18696.09 19690.07 13231.59 15134.22 10016.68 10164.07 9829.89 8016.95 446079.14 475546.60 501580.88 451147.37 615700.06 554791.93 513143.28 438616.55 507941.31 549995.91 550498.67 585217.65 506250.43
8-(2,4-Dihydroxy-5-methoxyphenyl)-7-[(2Z)-3,7-dimethyl-2,6-o...
11643.72 7658.81 9470.03 7743.55 8729.95 15754.10 18338.80 12219.18 13473.00 7606.00 8036.37 8366.55 6603.96 44658.71 62140.40 83554.86 73999.59 126160.32 83225.26 25132.23 60321.84 37608.06 109139.72 70562.83 108885.04 111230.73
8-acetylneosolaniol
12586.91 10220.74 10793.43 9899.88 11161.60 15801.32 15357.19 13884.46 13236.56 9616.98 9398.36 10164.10 9007.03 439791.35 458308.74 475754.21 473985.63 533833.60 533727.32 442429.82 493448.03 517529.90 487734.79 510590.26 568951.53 529962.58
8-Amino-7-oxononanoic acid
91295.45 41788.44 59415.55 14053.90 61781.35 153863.96 158075.23 46604.79 84758.44 28808.48 418204.30 115902.73 22355.97 603731.39 502057.82 648104.00 451513.59 547154.45 677952.90 741884.28 821601.41 561765.62 522267.33 685922.10 672111.12 606599.48
8-Hydroxy-7-methylguanine
17684.48 11651.89 29321.50 11124.66 12235.89 19058.95 21115.39 20549.75 18413.72 14453.99 12861.85 13511.91 12798.85 766693.61 1234432.27 1395942.04 1027114.53 1415139.38 1315738.27 1358669.14 1011214.47 1152218.30 967905.78 981059.00 1141109.11 888004.90
8-Hydroxydaidzein
9396.02 7903.34 24630.33 7506.55 8533.81 12146.63 11681.02 10665.14 9767.06 7098.38 7225.46 7667.44 6683.94 502304.95 714883.12 697342.90 657343.17 897836.55 564196.09 768930.34 569473.41 849773.56 1982221.51 655190.28 586354.32 681219.72
8-Hydroxyoctanoate
35395.14 50691.55 31281.01 40261.98 40379.92 27235.11 130498.89 80859.49 97340.03 67422.75 77145.96 32035.52 24380.06 739268.55 769903.35 729717.91 1193190.48 898435.96 1068519.58 1322137.47 934276.26 1049630.77 1132982.19 930416.48 714102.59 755389.43
8-Methoxykynurenic acid
11874.08 8104.54 8460.25 8729.00 9819.79 11669.34 12314.25 12268.35 12124.12 8189.44 8876.37 9128.08 8423.78 184079.24 295442.74 334757.99 261767.88 328727.07 387006.06 302062.97 263034.73 271685.68 280462.31 224623.14 264234.36 227060.98
8-methylsulfinyloctylglucosinolate
20382.04 12986.28 31221.96 12788.61 8765.06 19293.78 18174.34 19619.00 19274.82 12907.81 14016.34 15648.23 13319.99 696385.46 537305.78 580702.07 707365.74 616378.26 808144.54 703996.25 709398.74 567175.08 681048.96 357756.28 624284.19 599172.16
9-[(5R)-5-Ethyl-alpha-D-xylopyranosyl]-N-(3-methyl-2-buten-1...
10662.05 8899.15 11292.62 8389.35 9539.38 13125.55 12580.82 11828.20 10851.72 7921.51 8330.30 8570.94 7601.73 886570.18 650069.34 891269.94 894298.50 795904.12 1304781.58 999123.41 805769.10 1125970.72 698406.23 959152.08 814612.17 1283823.81
9-hydroxystreptazolin
11607.38 7411.37 15830.77 9463.37 10294.05 10959.30 11836.32 12016.34 11432.72 7894.76 7941.80 9072.35 9065.95 359878.55 511650.19 535795.76 405202.13 519671.34 595451.15 550055.15 473879.52 415630.32 442562.63 424290.13 467914.92 371176.23
9-Methyluric acid
20079.09 97153.96 125091.42 16836.51 13596.89 24051.39 26191.07 24330.83 22339.23 17064.11 16252.05 15650.79 15040.03 2670298.89 3187382.46 4584823.89 3342829.99 5160423.07 5338288.07 4180217.04 3167254.94 3092007.24 2663480.48 2567397.41 3471044.14 2557372.36
(9Z)-12-Oxo-9-dodecenoic acid
17726.98 21165.65 25772.05 11579.89 43425.36 14701.62 19571.15 13497.94 22518.16 16145.18 26051.98 17610.95 17247.11 1099494.02 923195.04 930619.18 966887.74 1088116.67 1236762.68 1242357.89 1195175.09 1086873.50 1045284.77 1266961.76 1175357.44 870118.54
A23187
9539.90 9076.25 12876.11 7737.86 9194.88 24015.27 15230.04 10649.45 11256.59 7118.76 8895.61 9934.92 6932.90 780460.50 479925.98 676825.51 632733.98 701874.24 967894.83 867485.37 746089.28 579779.27 650331.94 643542.16 647556.92 571247.22
Acesulfame
77537.36 44635.66 474740.81 103020.54 68951.76 38123.32 21830.11 20506.99 55552.11 14204.26 13638.34 11577.77 11870.96 14644244.79 20673478.91 29158665.11 21904389.12 27866624.31 31127034.94 34041152.14 21582211.03 30007776.80 21443190.44 24879292.34 28345183.08 14716109.08
Acetaminophen
73094.44 211380.13 161091.50 193331.95 178751.36 81889.85 119347.58 117478.90 222618.07 135266.08 169228.53 116606.23 187094.20 12644349.39 9066175.30 9505932.81 9873940.92 9774506.59 11733356.87 12806059.32 9164198.17 11937999.09 13501117.83 10738047.37 9032629.07 9218863.18
Acetanilide
215676.79 442589.24 969962.27 284668.92 508798.36 169315.88 70401.00 56852.25 155832.87 74146.95 28224.73 107400.59 113623.84 38357707.44 49705100.57 48676966.27 47566422.83 47341744.04 60027584.97 61580840.26 49783192.38 43741332.43 47142871.30 38905070.11 46422266.17 42247680.36
ACETOACETATE
410351.41 594218.49 493370.06 738815.27 655082.64 659500.78 949742.87 648859.47 587194.32 842935.99 485362.47 536859.74 728955.44 4263314.76 2333841.23 3860010.70 3252798.46 4294085.18 5991467.89 3141650.74 2557696.34 2882556.38 2546725.53 2315790.79 2031083.17 2286768.73
ACETOIN
52269.76 89727.07 155730.59 126813.37 222717.08 18981.38 114335.08 19198.81 62735.18 49166.98 82488.79 48540.83 97940.60 2139934.97 2051522.77 4066056.69 2833293.45 4003350.26 4141489.75 3268423.75 2698398.74 2360372.24 2294978.00 2101705.00 2598949.39 1918210.92
Acetyl-L-carnitine
10099.12 13863.31 55171.62 9981.53 14848.12 10953.07 11648.95 11327.91 10600.08 7947.55 10271.19 8258.52 7919.51 2584437.30 2740747.47 3646427.42 3037774.65 3759133.18 4614130.68 3917874.67 2995243.12 2842104.27 2907436.96 2653064.28 3186961.15 2778344.71
Acexamic acid
12473.35 15669.23 30633.04 19601.96 25648.98 12815.75 18315.11 13736.99 12958.02 11029.90 19116.88 10422.64 10806.69 737570.04 801070.98 857971.16 773566.82 848995.79 1261816.82 1098195.03 779251.52 812108.30 762047.89 751706.86 831520.00 726137.67
Aconitine
10308.21 8836.04 13716.42 8453.00 9425.39 21833.46 16101.29 11478.93 11544.30 8201.08 8849.53 10424.44 7219.50 87861.23 77149.51 64033.65 79691.19 86186.48 93449.84 75023.02 118362.33 95399.85 87624.55 93336.94 92857.02 82419.95
Acremonone H
11508.30 19266.42 92322.54 14346.36 16037.78 12351.80 12573.58 12453.67 12286.61 8805.47 9295.18 9280.58 8449.21 4959598.11 4285306.43 5090919.86 4205817.01 4748458.04 6223939.42 4326230.68 4150820.32 3914083.92 4603968.22 3977955.31 4632489.58 4249438.22
Actinofuranone H
12957.80 9858.49 22765.93 9658.17 10235.09 17101.35 20268.79 15383.07 15641.01 9630.53 9945.24 9943.97 7983.59 1429332.54 1626838.76 1629459.89 1500128.67 1914544.44 1930284.18 2594973.15 2366125.15 2043280.69 1933635.77 2528513.90 1740542.31 1559164.07
Actinoramide C
16609.25 20126.21 34580.57 10442.50 28723.12 60934.98 40117.14 21979.89 27593.02 18549.04 19084.82 22904.78 10827.95 318225.72 358649.87 364061.05 349371.98 458297.71 561580.23 395742.00 327303.82 314893.93 407669.16 441335.82 487570.22 400090.04
Actinozine A
90488.79 91230.57 384855.77 71855.76 69989.97 30329.93 14147.03 14136.07 14495.88 9974.59 10670.44 26238.34 10061.82 14402439.22 19344657.89 20951477.08 14085536.35 22444348.12 22524027.97 21515615.93 18271383.93 16718062.07 17268497.38 14460513.51 16305493.48 15011181.70
ADIPATE
262172.26 250365.99 398699.19 243745.36 339318.78 432225.41 365997.46 267908.43 302597.89 237652.80 420995.11 234889.29 249249.34 5584516.71 4844199.50 6470240.72 4573750.42 5743553.23 18777496.67 13832193.36 7377892.25 4574902.96 5144035.07 5655265.84 5373943.67 4348517.33
Adipoylglycine
15241.91 10835.47 29516.49 18884.13 14226.24 17886.99 19845.81 18649.77 16988.06 12540.46 11768.22 11586.84 11009.75 399723.84 427156.51 772340.50 581826.19 834953.35 824722.87 514860.11 458989.90 442662.59 418166.16 334183.35 501480.51 405268.14
Agrocybin
480250.99 684388.61 454984.93 462534.99 1073302.10 478205.90 606023.05 485533.70 539512.02 481861.18 536081.78 508607.23 612337.85 1455890.33 1770771.91 1472704.27 1431618.11 1545127.97 1571703.13 1931890.35 1563561.40 1858863.17 1886082.24 1808789.08 1437879.27 1750292.41
Aldosterone 18-glucuronide
9590.86 7902.33 7493.53 7354.20 8350.60 10620.44 10888.09 10821.58 9688.47 7262.04 7350.25 7505.28 6909.16 219845.19 251019.31 264763.51 226583.51 252359.42 244441.38 232430.08 261300.10 227441.75 238841.85 247876.51 255519.66 266186.74
Alkyldihydropyrone B
17975.94 17749.79 17820.67 22022.44 35521.21 12669.33 63711.59 37805.32 47009.21 41899.26 39711.83 22190.24 19595.18 283766.23 308523.01 315313.99 283092.19 403744.62 340208.94 419232.97 349006.73 361643.31 385657.25 382702.52 329811.39 276678.95
Allopurinol
27814.34 15687.74 64266.76 19980.77 12890.25 23307.35 21955.05 23700.23 27805.18 15592.95 16932.08 21972.19 16090.87 1197176.54 1337198.47 1190686.11 1169317.16 1533820.99 1418613.13 1545736.38 1504577.64 1468616.65 1434538.19 1370544.70 1292383.27 1178226.09
Allopurinol_
9140.79 7196.84 32720.90 8516.90 6256.86 9223.47 10411.07 10289.57 9302.59 6488.64 7592.24 6735.94 6415.59 382263.61 534449.08 497720.50 390576.90 601681.51 656647.01 697270.78 511576.29 606962.89 453355.78 471388.56 490554.04 403253.36
Aloenin
14196.31 12323.60 11838.20 11519.05 13107.62 15958.47 16670.63 16490.74 15498.44 11570.67 11698.39 11906.33 10443.44 1188767.20 733214.51 981383.50 1095493.42 1100515.35 2057359.53 847061.22 693608.51 534033.58 768300.36 600530.22 682993.87 1112478.49
alpha-Glutamyl-4-hydroxyproline
69889.36 57081.32 47903.43 56209.38 36508.66 76673.51 76895.14 67907.08 68087.69 54424.40 57770.18 56935.00 43033.08 793157.78 765049.01 844678.80 753063.49 863519.48 888813.44 908188.93 922006.31 726016.29 835080.21 538306.51 815613.15 767555.57
alpha-Ketoisovaleric acid
1627975.75 2311199.54 1068741.16 1183734.31 1170665.74 1250486.29 1824365.23 1423343.78 1354420.66 1294683.23 1235113.81 1115720.70 1354302.01 2823966.25 3281350.44 3109996.18 2751960.21 3149693.58 3696084.88 3401342.44 2826482.07 2812405.36 2661931.03 2741706.52 2534155.35 2658251.27
Alternarin A
10884.03 10513.29 12375.99 8973.80 11815.65 15796.30 18139.30 13451.48 14068.57 10587.08 8671.59 8004.53 7388.91 153374.03 185803.48 156270.52 167945.82 179929.70 171195.77 170088.11 218068.29 251705.69 192890.87 254528.80 229880.11 179048.58
Altersolanol K
9767.50 8337.48 8396.82 7813.04 8949.26 12344.86 12125.16 10939.52 10280.43 7436.44 7930.17 7839.15 7193.98 501715.92 434699.52 633252.15 492867.91 550157.74 723215.29 433773.43 492397.11 586790.01 553384.06 530194.34 602134.69 597233.13
Altersolanol L
9767.50 8337.48 8396.82 7813.04 8949.26 12344.86 12125.16 10939.52 10280.43 7436.44 7930.17 7839.15 7193.98 501715.92 434699.52 633252.15 492867.91 550157.74 723215.29 433773.43 492397.11 586790.01 553384.06 530194.34 602134.69 597233.13
Amamistatin B
13053.56 9888.40 10989.22 9041.06 10191.58 18032.36 16106.14 13953.44 13742.45 8956.96 9854.88 9957.06 8092.43 789851.21 601345.03 745902.91 776763.84 721620.67 717284.03 676593.93 803412.68 616979.08 687843.10 772652.78 635018.05 700583.51
Ambofuracin
9570.91 7442.18 9085.77 7594.08 8240.82 12906.91 13705.78 10718.47 10182.29 7131.66 6971.69 7214.77 6606.14 93960.68 100439.58 100817.68 95184.54 110209.30 121926.38 164114.09 101248.10 108871.83 132075.09 129211.83 107648.33 130751.79
AMINOADIPATE
128177.31 64903.17 59124.32 96977.25 62043.29 105782.17 96045.51 80719.81 79298.50 98260.02 70388.06 69187.88 48929.89 862954.44 630643.66 621669.46 661128.15 724792.82 969615.73 965234.12 876690.08 696686.31 711406.68 526245.40 745268.35 661410.76
Aminovaleric acid betaine
9615.89 8104.64 8664.67 7741.37 8755.92 12712.26 12348.26 10711.65 9879.97 7357.68 7631.43 8041.55 6895.78 635732.00 522593.62 574528.47 542416.38 584662.22 706298.62 751276.29 531280.88 690734.40 700862.13 688020.75 617929.43 560941.06
Ampelomin C
39840.10 37406.80 23361.49 12662.19 28278.13 13436.38 92520.43 42425.40 63517.94 48249.71 36241.39 14052.51 35297.82 384468.80 317757.81 391416.88 373365.78 386588.06 413834.23 504192.46 409111.48 399683.80 405768.31 381673.58 356111.77 298041.92
Ampelomin D
39840.10 37406.80 23361.49 12662.19 28278.13 13436.38 92520.43 42425.40 63517.94 48249.71 36241.39 14052.51 35297.82 384468.80 317757.81 391416.88 373365.78 386588.06 413834.23 504192.46 409111.48 399683.80 405768.31 381673.58 356111.77 298041.92
Ampelomin E
39840.10 37406.80 23361.49 12662.19 28278.13 13436.38 92520.43 42425.40 63517.94 48249.71 36241.39 14052.51 35297.82 384468.80 317757.81 391416.88 373365.78 386588.06 413834.23 504192.46 409111.48 399683.80 405768.31 381673.58 356111.77 298041.92
Ampelomin F
39840.10 37406.80 23361.49 12662.19 28278.13 13436.38 92520.43 42425.40 63517.94 48249.71 36241.39 14052.51 35297.82 384468.80 317757.81 391416.88 373365.78 386588.06 413834.23 504192.46 409111.48 399683.80 405768.31 381673.58 356111.77 298041.92
Androsterone glucuronide
103284.01 81680.89 341235.94 59613.42 79565.54 43730.67 21925.17 14039.16 18678.99 9604.90 12569.11 22943.44 8669.55 16908256.07 18103630.17 19573167.42 18225733.18 21067665.98 22300559.28 19405268.81 16817134.98 20547728.76 22186523.43 19900386.75 21104560.60 20228620.28
Androsterone sulfate
36982.67 84401.67 148132.55 47515.14 148243.49 123865.35 117552.15 68600.33 182526.82 47068.54 132239.12 98080.84 56556.57 6458225.86 6988046.89 7036341.85 6309005.63 7851185.17 7508948.66 8332240.90 7157133.63 9105324.08 9474285.68 10023665.57 8362993.95 7109737.46
Androsterone sulfate_
10957.40 14245.73 46440.15 10782.60 9979.21 16740.18 24620.36 13053.37 13253.95 8943.04 8821.35 9081.80 7674.53 1777118.06 1930474.59 1991480.39 1994942.94 2236768.22 2182077.54 2256304.02 1979477.02 2554012.03 2579059.68 2273115.04 2344966.30 1936536.28
Anisic acid
324957.93 1276539.09 1502605.33 317507.06 1278606.19 2157487.67 2669698.53 292594.47 1056809.50 351622.47 7612327.71 704911.24 296110.67 4213571.86 4343213.08 6076506.58 4352304.72 5781828.89 6469434.75 5413777.75 5961524.55 7679365.42 4854785.56 7140362.12 4377179.03 4714762.03
Anthracophyllic acid
9892.92 10322.27 9579.26 7867.77 9792.79 15619.91 14453.82 10907.87 11006.57 7551.43 8612.71 8860.55 6806.69 783059.92 963156.22 998457.01 893228.28 1049576.26 1089357.91 1129909.92 866745.04 1148150.40 1099135.16 985270.64 1035274.48 982914.72
Aphidicolin A4
12135.65 9057.41 11511.41 8854.86 9658.41 19300.61 18913.43 13383.96 13641.82 11896.74 8338.99 9076.56 7355.34 822517.43 907116.68 861132.64 781890.27 1088723.11 970571.22 981854.93 861702.40 845209.23 888386.60 982695.33 1029616.44 768710.53
Apicidin A
15880.51 12847.51 19005.38 12755.10 21232.54 27930.73 28534.03 18297.58 22877.67 14377.96 14956.77 13593.62 11041.19 463461.60 442763.57 415616.59 339807.95 485370.97 532589.73 532015.22 392528.46 516806.98 460809.53 502520.93 430432.11 402912.41
Apigenin
9396.02 7903.34 24630.33 7506.55 8533.81 12146.63 11681.02 10665.14 9767.06 7098.38 7225.46 7667.44 6683.94 502304.95 714883.12 697342.90 657343.17 897836.55 564196.09 768930.34 569473.41 849773.56 1982221.51 655190.28 586354.32 681219.72
Appenolide C
15669.13 9730.99 12123.76 9860.27 10996.49 19844.31 23381.38 15892.46 17376.66 11460.56 10221.04 10768.56 8450.27 332644.90 336907.66 393012.22 340622.46 453882.56 416875.12 406856.08 386021.06 393132.26 435964.53 469801.86 380673.99 292504.47
Arabic acid
370132.14 906724.30 8147909.28 219387.41 9017391.73 8180561.32 5397136.12 308355.27 12710847.75 309054.47 9874878.29 7788224.86 342468.82 788706.82 10153358.87 20647994.22 604418.14 19130150.66 15500577.52 2772761.23 1517257.87 7867442.93 288993.65 15573106.83 9733757.96 598389.32
Argyrin E
13099.74 11004.95 10402.24 10178.69 11475.68 14450.10 15054.83 14714.13 13390.47 10336.60 9929.86 10685.46 9568.29 4018987.45 2949099.45 5440562.48 5812028.95 7489743.95 11209715.89 2401192.91 2164263.85 1610155.11 3466198.05 1233351.03 1875545.55 5492988.61
Argyrin H
13099.74 11004.95 10402.24 10178.69 11475.68 14450.10 15054.83 14714.13 13390.47 10336.60 9929.86 10685.46 9568.29 4018987.45 2949099.45 5440562.48 5812028.95 7489743.95 11209715.89 2401192.91 2164263.85 1610155.11 3466198.05 1233351.03 1875545.55 5492988.61
Arthropsadiol A
13389.35 12520.44 17740.25 10457.49 12981.53 22729.78 19524.56 14398.45 15230.52 10133.07 12009.17 12053.60 9159.87 794231.73 779087.69 1074160.40 937600.45 1178016.91 1389509.95 740199.68 889559.68 756939.87 971810.03 809103.41 1000265.26 814543.29
Artonin T
9371.01 7570.55 10626.32 7477.32 8304.31 12626.73 12012.15 10499.46 9824.91 7026.86 6917.11 6970.52 6420.99 231204.50 289850.60 304017.62 282847.25 245765.13 254346.25 427147.72 329292.60 401305.27 381464.60 321032.83 215006.52 199499.86
Ascospiroketal A
10174.73 7890.67 10605.06 8183.95 9313.74 10829.92 10839.36 11081.58 10888.92 7645.86 8332.64 8669.91 7979.40 752928.68 914784.21 942829.34 884408.98 946808.91 943395.55 928953.43 1016858.26 888410.96 910325.87 865516.42 843982.81 802792.90
asn-val
13060.66 9239.36 10001.84 8496.13 9055.73 14991.28 16534.84 15756.86 14304.03 10749.54 10107.16 9451.49 9283.33 345493.55 427836.33 661432.96 540415.14 690945.71 696781.94 489079.03 411545.42 424297.55 454429.90 292656.43 459151.70 378124.20
Asparenomycin A
9988.89 10018.81 14076.89 7973.51 8852.91 9661.24 10657.49 10163.60 9865.12 6966.59 6427.71 7429.07 7629.85 569942.95 1000704.58 863681.09 546383.94 800404.57 1079155.15 1065432.78 762645.26 885166.58 672559.80 970395.43 862550.06 579501.50
ASPARTATE
205239.63 86649.31 234264.86 82178.81 50923.96 122908.13 120778.50 116331.59 105780.41 169780.17 82834.86 127025.15 76043.57 2849025.41 3541964.13 3292426.31 3073261.70 3385785.45 3667077.23 4070207.88 3594759.12 3248688.26 3347011.77 3053987.92 3340411.58 3082686.03
Aspartylphenylalanine
13007.57 8060.07 9746.41 10763.78 11669.79 13786.65 14471.34 14133.37 13429.51 10071.97 8758.55 9827.19 10006.05 370595.67 525506.12 460698.07 376087.41 483373.16 656345.90 482229.66 462250.67 411844.12 405849.66 381856.96 480685.91 377175.22
Aspergilate A
179301.32 478490.49 745601.12 156232.00 123789.41 140155.97 17939.20 14873.06 13769.19 10449.27 10102.15 10777.87 9661.91 82004134.07 64644192.79 77676778.12 85215201.59 91740667.09 134216629.89 77782789.40 57575441.45 54727286.24 77011181.95 55142183.13 59153661.60 86113477.41
Aspergixanthone J
9712.55 8057.68 8326.96 7653.14 8700.46 12176.50 11842.81 10879.40 9806.20 7237.00 7366.56 7695.36 6814.46 4626012.87 4529325.33 5761035.29 6996878.32 6266879.67 7947758.85 8344767.25 6396239.72 5069309.85 5133163.88 4342330.54 3238347.70 5454118.78
Aspergone O
10328.55 7975.43 8550.06 7558.19 8064.41 13787.75 12653.13 10913.94 10402.45 7532.61 7845.74 7568.66 6530.81 154020.93 154787.47 221874.13 181687.94 232265.59 280309.22 151685.04 170927.17 144453.59 225444.40 166390.33 215962.79 174599.17
Aspermeroterpene A
9402.55 8025.96 8083.08 7503.95 8691.88 11883.60 11672.11 10530.77 9896.31 7155.27 7633.86 7546.24 6925.18 122138.41 93850.55 167326.77 151607.61 99821.42 121782.17 138903.78 151311.48 153704.78 134037.93 98034.68 98652.64 93922.33
Aspermeroterpene B
9402.55 8025.96 8083.08 7503.95 8691.88 11883.60 11672.11 10530.77 9896.31 7155.27 7633.86 7546.24 6925.18 122138.41 93850.55 167326.77 151607.61 99821.42 121782.17 138903.78 151311.48 153704.78 134037.93 98034.68 98652.64 93922.33
Asperterrestide A
10585.03 8957.28 9187.52 8640.23 9899.13 13225.60 13026.39 12061.62 11132.45 8323.53 8346.30 8686.84 7699.74 1627091.72 1433937.47 1778697.42 1695993.21 1939419.43 1738537.19 1456067.03 1624829.05 1481064.48 1791334.44 1794334.56 1715143.00 1599310.23
Aspertoryadin B
9285.12 12402.94 8551.79 7647.80 8760.92 11965.36 11515.60 10684.84 9885.63 7187.15 7609.22 7852.14 6783.45 817417.35 708720.63 756331.96 695789.70 788186.53 967374.13 818846.48 693360.47 694132.21 689347.09 702118.19 777050.41 752092.83
Aspertoryadin C
9285.12 12402.94 8551.79 7647.80 8760.92 11965.36 11515.60 10684.84 9885.63 7187.15 7609.22 7852.14 6783.45 817417.35 708720.63 756331.96 695789.70 788186.53 967374.13 818846.48 693360.47 694132.21 689347.09 702118.19 777050.41 752092.83
Aspilactonol E/F
124957.46 133726.60 208191.30 137934.56 166851.61 117635.15 158757.16 140670.57 133870.99 122315.38 103795.97 113461.96 109672.26 7523631.63 6868088.67 9635181.17 7967382.63 10000983.08 11320043.57 7925393.61 8112694.58 7336634.71 8635563.14 6814649.69 8178349.33 7256180.59
Aspilactonol G
124957.46 133726.60 208191.30 137934.56 166851.61 117635.15 158757.16 140670.57 133870.99 122315.38 103795.97 113461.96 109672.26 7523631.63 6868088.67 9635181.17 7967382.63 10000983.08 11320043.57 7925393.61 8112694.58 7336634.71 8635563.14 6814649.69 8178349.33 7256180.59
Asteltoxin E
10118.39 8756.60 32980.00 7111.22 9485.04 12793.78 12546.16 9975.05 10262.90 6958.36 7703.13 7662.91 6639.41 485647.36 945817.15 623748.35 565618.04 840079.54 650901.61 797087.52 614080.21 710070.89 723159.38 658676.68 646232.09 546920.23
Atractyligenin 2-glucuronide
11006.96 33511.52 22135.52 8944.52 10608.43 21196.65 16844.38 12743.32 13374.48 8732.93 11100.82 11189.15 8192.05 3396801.50 2512454.98 3131735.50 2840186.59 3094586.75 4072133.51 2924172.08 2568080.64 2382977.99 2598062.75 2637448.21 3211681.11 2838969.83
Avenein
12049.77 23516.11 23645.41 9761.35 10978.80 13306.68 14002.68 13775.93 12967.35 9665.06 10165.38 10430.15 9680.00 1512027.88 1533452.56 2007704.20 1620839.61 1974643.03 2506738.72 1664194.31 1557123.35 1537245.90 1645884.10 1490597.81 1677659.23 1793569.68
Avenein_
13269.10 14168.81 21026.75 10407.47 13065.43 18679.79 15090.68 14297.33 14363.14 9893.66 11929.24 12490.39 9981.01 590357.92 622614.41 629224.92 536609.39 655460.64 820160.68 655499.44 584762.61 583790.47 681621.35 476941.05 569851.55 565186.47
Avertoxin B
10118.39 8756.60 32980.00 7111.22 9485.04 12793.78 12546.16 9975.05 10262.90 6958.36 7703.13 7662.91 6639.41 485647.36 945817.15 623748.35 565618.04 840079.54 650901.61 797087.52 614080.21 710070.89 723159.38 658676.68 646232.09 546920.23
Azamethiphos
8607.57 7183.39 6987.99 6974.09 7637.11 9622.77 9937.23 9644.36 9278.11 6746.34 7196.63 7042.00 6563.36 136708.78 142260.48 151205.76 177868.50 160012.82 178525.89 219964.66 232713.63 174505.36 196465.00 153918.92 192305.80 115427.95
AZELATE
333303.79 687022.03 672776.49 463672.79 513031.00 1463313.81 1139391.95 2103720.94 876762.49 822129.55 629294.71 526024.88 279283.25 22729544.86 22673597.46 27884782.99 30756509.78 36262017.52 31808984.40 27482196.27 26108383.12 25044848.69 29119849.36 23575251.03 27593396.22 25081541.36
Bacithrocin A
8565.24 7700.85 7154.42 7080.93 7851.24 10152.93 10468.03 9923.59 9345.72 6927.99 6955.78 7262.99 6705.86 166229.21 237148.42 293705.66 255262.83 311554.38 313597.71 225779.77 240985.29 169609.97 258899.49 169062.90 234475.20 211199.69
Barbatoflavan
76534.72 70385.61 56943.19 63599.99 41734.90 95245.67 92502.33 84035.83 80579.16 61022.59 68770.92 66635.49 49778.71 1096627.11 1022304.32 932993.67 1038071.07 903534.65 1118359.11 1563989.71 1258966.71 968082.76 1255356.62 825593.57 823489.82 943091.72
Basidiochrome
8282.93 7288.44 7039.31 6614.56 7579.18 10151.51 10059.57 9437.15 8678.35 6261.64 6772.06 6718.49 6053.84 535518.47 440745.33 825051.85 618671.84 741834.71 947463.36 351816.01 402793.97 414590.83 697196.74 508039.13 922480.14 708631.82
Bassianolone
9735.58 25237.39 42232.02 9571.48 28129.00 12153.80 12631.87 12625.92 12093.95 19888.59 12133.21 10202.91 24077.43 924110.91 813513.41 1084241.95 952714.24 1148238.78 1535149.37 835077.71 937253.10 721766.99 910030.88 699110.47 935517.49 867177.08
BENZOATE
5289775.11 6815837.78 2274888.45 4834810.83 2624034.55 2117688.60 3149064.74 5614850.54 2402993.58 8656878.99 6328510.10 5309198.87 2259517.22 64949854.09 39690188.20 45561127.47 67340691.81 65428656.47 65675006.46 63476203.65 57076089.05 47562036.55 44873230.02 58685402.68 54347023.63 70536142.77
Bergaptol
9233.98 9080.84 9093.65 7304.18 9483.80 17374.47 14886.44 10160.16 11262.55 7195.72 9412.47 9161.45 6819.81 378138.68 282716.21 330550.93 297712.99 988448.14 381758.52 721700.02 521794.70 721418.67 2605700.28 335749.77 281228.67 256586.16
Bergaptol sulfate
13380.53 8537.89 12702.72 11002.23 11846.22 12606.71 13487.53 13611.72 13271.59 9156.40 9145.97 15525.44 10388.95 1367395.11 931457.43 1159242.68 1555221.11 1574164.03 1648117.08 1860168.71 2054960.37 2224778.28 1486765.84 1713821.69 2191940.42 1339418.87
BETA-ALANINE
100592.30 84601.14 361545.71 76445.05 65479.63 114482.09 111184.69 101008.25 96853.44 73347.10 82660.34 80093.63 59832.34 5585240.49 5778373.82 5787181.07 6136317.30 6350051.91 7041767.91 6795010.35 6629533.62 6274541.98 6013858.59 5225064.17 6011542.42 6183267.86
beta-Aspartylleucine
15946.26 10181.76 11533.84 13101.85 14141.99 15055.91 16300.44 16508.08 15706.31 10854.95 11050.11 12500.68 12454.83 163444.17 244280.77 296332.41 209513.17 248235.60 341355.16 220562.22 199042.90 170446.08 199937.12 140701.17 237942.59 168489.51
Bilaid B
22558.28 21513.26 31920.92 18734.59 31700.75 49229.65 43301.67 27564.87 42964.39 18814.89 33737.86 25540.54 17179.60 1268349.49 1198221.91 1419707.82 1330208.28 1575341.82 1421142.31 1275346.87 1295827.31 1234850.29 1440695.74 1532412.61 1488317.13 1411648.32
Bilaid C
22558.28 21513.26 31920.92 18734.59 31700.75 49229.65 43301.67 27564.87 42964.39 18814.89 33737.86 25540.54 17179.60 1268349.49 1198221.91 1419707.82 1330208.28 1575341.82 1421142.31 1275346.87 1295827.31 1234850.29 1440695.74 1532412.61 1488317.13 1411648.32
Bis(2-Ethylhexyl) Phthalate
10964.49 8033.57 10196.03 8376.97 8692.84 13871.56 16378.77 14936.49 12841.55 13457.30 7429.69 7141.45 6672.17 105354.14 143012.21 157028.48 109099.77 188245.35 139417.81 219948.88 146174.67 208618.25 105770.70 402825.39 158346.75 84561.95
Blepharin
11365.56 7089.97 8077.94 9300.26 10015.10 10573.87 11542.64 11690.13 11447.56 7709.79 7756.41 9158.56 8984.75 364988.78 403567.93 359917.08 361838.01 333007.73 561702.28 448401.88 402435.39 359088.53 393120.78 283590.17 318563.77 311881.90
Boletunone A
15897.83 13700.50 12918.72 12398.86 13970.02 20380.02 19359.10 17002.69 16321.57 12143.63 12438.36 12662.12 11279.80 306672.02 322417.23 379400.82 306757.07 353821.48 401858.77 318886.34 293312.88 299085.82 338606.45 349628.92 366943.90 315287.49
Botryosphaerilactone A
12105.90 16671.09 31513.01 12752.29 10373.19 35558.47 15727.57 13525.05 12797.24 8757.20 15097.37 10452.07 9322.18 1916104.55 1619470.27 1780705.30 1694162.91 2151226.99 2429065.27 1630740.34 1663622.56 1706565.43 2171151.64 2309007.56 2179838.68 1801427.94
Brassicicene E
11321.23 7590.84 9340.67 7646.26 8642.81 15243.41 17639.20 11811.24 12482.16 7538.50 7595.07 7938.29 6545.34 73214.28 86018.98 93319.63 84970.14 107828.90 102133.68 105282.84 115784.03 96326.10 99710.50 96997.10 96327.59 79572.99
Brunnein A
15787.05 20356.49 81091.66 13647.45 19834.70 10081.63 10722.15 10426.65 9756.72 7315.24 7680.83 8001.87 7187.86 6808325.25 7404548.27 9266840.77 6795267.96 9140618.09 9100999.11 8360230.55 9942650.60 7026195.63 8344523.13 7448443.02 8999876.34 8594242.94
Butyl butyrate
10627.11 9346.59 9113.12 8448.71 9936.17 13510.78 12930.83 12097.28 11552.12 8341.46 8906.53 9031.79 7833.54 74848.12 65348.81 79522.31 75587.86 82492.23 90928.73 97641.37 67681.12 83224.16 101892.76 80535.99 77674.37 69970.81
Butyric acid
26027.11 87901.69 112117.39 44233.50 70676.76 27858.25 57776.65 29392.35 27295.32 48604.39 16994.81 47412.72 73882.24 1045667.77 1146468.50 1338269.33 1142985.92 1252331.48 1629846.94 1718734.08 1148398.93 1506255.54 1042240.69 1353061.39 1143186.06 965024.19
Caffeic acid 3-O-sulfate
15639.37 31290.34 39639.64 12718.58 13661.30 14238.02 15717.28 15998.14 15633.00 10528.63 10756.96 12507.09 12254.27 9305021.88 10719162.48 12579062.99 9026450.31 11348893.74 15266153.36 13024973.60 10931526.98 9193286.30 10932290.28 10079952.83 9778903.59 8327121.03
Caffeic acid 4-O-sulfate
15639.37 31290.34 39639.64 12718.58 13661.30 14238.02 15717.28 15998.14 15633.00 10528.63 10756.96 12507.09 12254.27 9305021.88 10719162.48 12579062.99 9026450.31 11348893.74 15266153.36 13024973.60 10931526.98 9193286.30 10932290.28 10079952.83 9778903.59 8327121.03
Caprylic acid
10627.11 9346.59 9113.12 8448.71 9936.17 13510.78 12930.83 12097.28 11552.12 8341.46 8906.53 9031.79 7833.54 74848.12 65348.81 79522.31 75587.86 82492.23 90928.73 97641.37 67681.12 83224.16 101892.76 80535.99 77674.37 69970.81
Capryloylglycine
26084.07 28157.99 105220.08 26913.75 23476.48 14949.11 12361.36 10723.01 9890.45 7365.49 7639.53 11483.23 6903.09 7331781.05 6678051.14 8340385.34 7722632.64 9011800.96 10781034.10 8448761.98 7869619.52 7463857.55 9148264.93 7759406.76 8251591.43 7025180.88
(Carbamoylamino)(4-hydroxyphenyl)acetic acid
23480.90 15747.08 23288.05 14732.98 10082.76 22675.55 22780.64 22601.86 22502.02 14977.82 16147.37 18868.20 15345.15 280411.27 281897.97 290185.88 282005.71 279973.39 328653.69 283557.34 301838.39 236855.81 258837.74 239555.59 272446.07 255944.63
Carbofuran
9238.49 7898.81 7955.03 7566.88 8554.18 11695.35 11587.61 10474.44 9687.72 7055.72 7512.93 7507.08 6815.47 501137.90 501515.74 626446.81 544930.96 695229.87 685574.48 570566.69 516925.11 538297.95 616389.33 511502.38 615493.51 515873.22
Carbofuran, 3OH-
10408.32 8666.03 16107.68 8325.33 9293.90 11515.98 11771.83 11712.21 11172.30 8290.64 8598.18 8676.98 7940.34 742116.92 733464.85 1030313.19 838263.94 952237.31 1150784.83 978929.68 832188.47 811402.22 807948.31 822307.11 879954.50 820284.65
Carboxycelecoxib
10146.37 7101.15 6037.31 6621.84 6865.40 11810.77 13234.88 12073.30 10999.98 8622.84 8212.49 7886.99 7556.84 245666.80 460720.17 832655.97 624041.70 947060.33 701405.90 430222.23 385160.67 326831.85 291772.91 339089.52 447297.07 337714.53
Carboxy-ibuprofen
14361.36 37869.36 104992.35 21191.60 20511.22 13154.94 10949.10 10058.39 9066.18 6690.86 6810.65 7064.41 6300.21 21154019.52 15252098.95 20976988.15 22370131.47 26049129.05 37287966.04 20812089.89 17661636.32 14788111.02 16534704.27 23803528.28 13380946.89 25565591.77
Carnosol
9310.64 7724.25 7982.38 7336.45 8340.43 11672.63 11352.74 10429.20 9400.41 6937.53 7061.73 7376.92 6532.48 630010.32 477519.39 469382.53 496686.37 448819.61 471613.81 861402.90 560304.63 753260.35 581367.30 720502.41 499509.95 486058.87
cartazolate
9562.55 8342.01 8043.04 7638.99 8828.27 11775.12 11452.93 10771.42 9808.88 7202.77 7552.73 7912.51 6956.93 514211.80 382877.60 526197.51 451264.39 548123.35 682022.86 506333.20 467707.59 418199.71 523465.04 436560.47 488588.44 451282.38
Catalpol
19181.42 15472.74 16588.91 15458.54 17752.57 22729.58 24730.95 21087.29 22246.56 14508.60 21812.60 16495.52 14964.76 596115.31 728486.92 854111.43 566352.98 802761.21 1093263.37 690186.07 592697.12 683813.16 714169.68 552915.36 824415.00 640775.67
CDP-DG(20:1(11Z)/18:2(9Z,12Z))
13109.28 48652.84 69851.55 31323.88 97728.04 63912.46 49269.99 21006.51 70885.87 23398.00 87177.32 64658.81 37284.35 79937.50 70069.74 120649.91 182159.36 207583.74 149231.06 57150.79 122624.53 181622.32 272861.51 146262.86 136735.19 199330.52
CDP-Diacylglycerol(38:3)
13109.28 48652.84 69851.55 31323.88 97728.04 63912.46 49269.99 21006.51 70885.87 23398.00 87177.32 64658.81 37284.35 79937.50 70069.74 120649.91 182159.36 207583.74 149231.06 57150.79 122624.53 181622.32 272861.51 146262.86 136735.19 199330.52
CDP-Diacylglycerol(40:6)
19414.12 51208.76 102785.07 32969.44 102862.05 85946.73 51858.32 36994.28 74609.77 24627.18 91757.06 68055.58 39243.04 95582.72 84762.61 118611.11 147410.70 169827.36 131491.29 74646.98 143775.87 207023.45 248867.97 152652.48 128730.28 165897.08
Cephalosporolide C
19053.69 109989.17 99039.84 50708.75 38676.75 22368.47 23433.99 35123.68 21379.38 18431.69 15524.24 20531.76 20461.35 2521061.58 1646378.91 2439162.64 2554289.75 2772102.54 2946518.50 2029284.95 2265606.16 1519808.86 2115149.71 1534183.84 1773231.26 2048583.91
Cephalosporolide G
19053.69 109989.17 99039.84 50708.75 38676.75 22368.47 23433.99 35123.68 21379.38 18431.69 15524.24 20531.76 20461.35 2521061.58 1646378.91 2439162.64 2554289.75 2772102.54 2946518.50 2029284.95 2265606.16 1519808.86 2115149.71 1534183.84 1773231.26 2048583.91
Cephalosporolide J
19053.69 109989.17 99039.84 50708.75 38676.75 22368.47 23433.99 35123.68 21379.38 18431.69 15524.24 20531.76 20461.35 2521061.58 1646378.91 2439162.64 2554289.75 2772102.54 2946518.50 2029284.95 2265606.16 1519808.86 2115149.71 1534183.84 1773231.26 2048583.91
Ceramidastin
11419.81 10396.10 10068.64 9072.80 11389.90 16284.27 13155.43 12348.40 12600.48 8650.33 10399.41 10888.61 8715.99 345153.04 369862.57 432548.08 286804.36 323320.26 435004.66 383956.56 371212.59 350898.81 276499.70 278649.20 409815.25 353460.73
Cerulenin
12603.56 9760.47 66686.33 9876.21 11891.22 18077.37 15834.69 13563.52 13279.61 8888.94 9515.15 10071.14 7865.01 4303570.84 4337471.06 5248725.54 4504068.59 5594769.54 5613788.95 4658440.51 4438095.16 4808846.42 5506663.84 4829072.15 5426427.63 4549832.88
Cheimonophyllal
11402.84 8348.16 25560.38 8209.10 10273.95 13795.66 14064.19 11982.43 11519.54 8141.52 8417.77 7954.47 7203.32 583529.98 515660.67 628586.91 594717.21 725225.02 846713.46 522243.80 587750.11 506050.37 656612.63 592681.98 692865.10 591586.26
Chenodeoxycholic acid 3-sulfate
11199.30 10817.83 12360.79 9233.75 11280.08 17408.20 18664.74 13841.13 14476.09 10800.75 8922.78 8236.40 7602.94 1826153.20 1932593.55 1891654.06 1796932.88 2162426.78 2341202.72 2236489.80 2252636.92 2412457.13 2197350.00 2657040.19 2677835.05 1907656.44
Chlokamycin
17510.21 13542.14 15952.83 13821.52 15181.89 23657.42 24065.77 19311.17 18629.22 13135.84 12210.51 34356.06 12011.65 1641122.79 1199117.25 1202438.50 1156971.31 1976108.47 1228375.68 1400732.23 1311671.61 1118554.12 1344966.64 1245578.92 1446123.34 1035607.27
Chlorprothixene
1640166.81 5576325.11 13944148.79 1338215.90 13180701.65 19202775.67 7090949.50 2722717.37 4909185.58 924664.31 5465496.24 7815433.85 1967878.75 1730542.72 15332767.46 28428968.24 1050801.78 36795647.72 30503154.73 4637494.50 2538100.61 7005277.72 1229882.80 18078951.65 18518266.75 1843798.78
Chlorsulfuron
8049.40 6711.60 6635.14 6489.47 7347.13 9105.17 9251.34 8982.40 8490.84 6447.72 6562.61 6814.38 6367.56 55356.85 51079.16 74797.55 67712.83 70439.66 68220.74 107908.42 73037.89 63546.88 76301.76 77752.20 58950.77 40899.79
CHOLATE
11039.25 8399.97 10546.68 8360.10 9113.97 13632.83 16873.12 16059.04 13478.28 14651.48 7397.45 7160.01 6724.66 496816.69 501901.94 454940.67 435000.52 513491.11 600639.33 655481.11 498448.06 525974.90 507755.83 646013.30 534521.18 373253.52
Cholesterol sulfate
32984.12 22510.51 24181.31 22308.02 20585.56 39645.13 48361.52 40504.92 35669.47 256308.99 45805.43 18067.05 17805.52 1032537.26 299525.87 458061.07 812808.54 647160.51 590919.71 602666.04 645732.19 772949.69 833068.09 1169859.79 476794.06 593138.27
Cholic acid glucuronide
14627.84 13594.77 20030.80 12250.97 20091.51 30941.76 28333.25 17612.49 26893.89 12311.69 19515.25 15993.84 10743.17 263367.60 260616.45 255587.76 253362.19 518619.96 382687.46 431254.79 236595.04 231791.07 254720.16 463122.32 258654.53 245120.56
Chromosulfine
8937.74 7348.39 7243.47 7213.56 8117.78 9839.03 10314.90 10185.99 9457.89 7146.39 7434.90 7297.91 7157.44 176443.67 182875.24 248015.20 181595.96 186982.52 178996.63 448495.96 1226001.24 233340.04 231986.81 191927.01 193795.89 152462.38
Chrysin 5-xyloside
12273.99 12698.32 13240.97 9717.13 12798.86 22032.84 20359.78 14383.96 16006.27 9565.81 12002.80 12893.37 9320.09 220728.11 251278.84 175590.65 169228.45 187504.08 228375.16 191311.53 248662.79 259808.90 290893.71 255213.91 215213.35 192329.55
Cinatrin B
58072.04 74811.87 112358.82 44188.01 89773.94 198567.94 147053.46 87775.78 169289.31 50970.77 120202.85 108594.81 39251.05 638267.33 713558.53 769597.99 677021.01 916124.35 875548.24 744476.16 663903.09 758533.24 854810.05 792404.15 888465.58 734278.98
Cinnamoylglycine
9922.68 10208.18 70359.41 11618.29 18398.92 10432.97 10594.91 10282.66 9892.17 7192.84 7672.93 7508.06 6997.75 4704550.23 5417556.46 6126412.51 6192105.98 6294716.63 7264196.11 5423428.75 6482930.74 5180588.34 6462384.25 4295698.48 6750343.80 5329887.46
Cinnamyl alcohol
9683.23 7921.18 8220.29 13852.92 8541.57 12197.17 13985.55 10846.55 10199.66 7370.36 7281.82 7672.13 8061.10 1134411.89 939200.03 982462.09 1007123.25 1086163.02 1659317.47 1266579.78 941834.74 1198302.24 964928.85 1607629.56 944528.99 1184329.91
cis-4-Decenedioic acid
111025.77 115868.15 319351.52 117316.72 185710.54 100995.54 129887.18 112222.86 134368.58 421344.97 95432.43 105020.68 104066.27 6846127.70 5698997.58 8314150.22 6770262.92 9290476.70 8782964.37 6658081.26 7004079.81 6485279.55 7620245.73 6496251.98 7416290.03 6663871.54
cis-5-Decenedioic acid
336928.14 77388.49 160567.26 78682.45 131097.36 750509.67 90653.35 511947.17 245358.53 736738.53 289552.01 74174.45 69518.77 1506147.84 1540907.95 1994760.70 2442590.32 3522806.50 2246662.01 1634365.41 1674206.78 1765726.77 2318198.21 1609843.96 2090663.84 2032967.23
Citraconic acid
827084.74 1031117.33 3138302.93 725326.01 622148.04 436450.35 293238.26 262519.08 400010.94 212454.44 193376.25 385343.38 214952.62 71696994.74 55470597.30 65648450.06 65100256.37 69800555.14 88805718.25 94965284.60 75033558.62 68878583.83 64084720.79 68066639.47 62124151.10 58261633.67
CITRATE
3167995.22 2467308.32 24897833.57 4217800.54 2465315.18 2184528.30 929934.97 585997.42 1226669.87 645353.60 611880.60 1536065.59 562648.29 580898310.11 392952864.78 557224386.48 580213403.16 629017592.95 732245124.11 591078329.12 613226086.95 450029539.69 529402338.80 362007875.85 456466408.04 476484083.93
Citreodiol
67823.00 53953.70 53693.61 52030.26 74861.37 58969.11 99309.13 179351.89 298519.79 140623.78 63595.07 63868.71 51236.02 623694.32 678461.50 717394.32 928427.14 1485103.09 920118.22 645855.47 708944.09 774577.16 1081760.70 686628.55 1013540.78 929048.59
CITRUSIN C
9769.52 22252.81 44896.47 7698.03 9051.30 12230.68 12016.99 10943.21 9863.71 7307.85 7283.13 7740.50 6723.86 5383522.29 3640035.52 6676016.65 4602050.08 5409805.89 6806451.41 5570076.89 3790094.86 4828182.93 6146821.17 5006353.37 6072918.26 5216033.14
Cladosin F
10268.96 8288.46 21461.40 8021.91 8948.69 11043.76 11506.26 11343.37 10670.07 7836.33 8356.13 8522.71 7819.83 1260502.22 1065253.86 1332469.11 1168818.52 1378402.48 1552727.41 1271833.52 1200245.97 1169298.43 1330181.82 1021072.68 1190769.27 1089581.35
Cladosin L
203910.09 255957.25 878326.47 168762.73 147380.51 55152.31 21841.40 15430.70 59795.13 10773.19 12876.27 36047.18 9998.33 54532806.61 49079913.14 61616538.78 52619342.34 63813075.62 69047752.57 61134335.26 55339674.63 57182534.32 58857244.35 50313902.25 57944378.54 50383784.76
Cladospamide A
10203.98 8439.70 21513.75 8252.50 9140.74 11400.08 11673.02 11457.46 10983.75 7982.72 8355.32 8478.82 7919.02 1272603.89 1310339.71 1604155.91 1364370.09 1750288.41 1882454.70 1527399.75 1366269.00 1469386.36 1474099.35 1237494.96 1450034.42 1328474.86
Cladosporester C
12390.13 10871.09 11582.68 9856.34 11556.83 15714.50 15140.09 14116.69 13436.35 9693.16 10359.25 10218.50 9152.88 1159338.04 923700.82 1217055.61 1237076.09 1446048.80 1613754.38 1149475.93 1103262.76 1051855.59 1161161.93 1033787.80 1172203.82 1054420.92
Cochlearoid A
9120.02 10105.69 9850.17 7171.42 9404.33 19090.94 15873.67 10251.56 12648.35 7269.37 9401.36 10125.18 6649.14 1173174.56 591374.97 1034166.41 781662.19 1028074.04 1798538.07 816463.24 797974.32 882403.87 1329441.83 1045821.43 1166193.69 900143.63
Cochliodone F
13802.75 11389.89 14496.41 11157.84 11903.39 19042.52 21917.34 17320.10 16333.61 16699.31 9403.19 9941.65 9313.65 223673.95 274941.32 198133.31 234399.64 198211.83 200470.98 202372.64 320937.79 313578.42 151015.65 260264.85 218484.60 225168.54
Cochliodone G
13545.93 14900.80 15924.98 11230.45 14490.31 19237.97 23557.05 17487.60 17239.95 13767.57 10530.15 10420.98 9182.17 79662.74 111138.52 207664.10 159281.56 190678.17 175064.03 102563.38 31917.26 64842.43 114451.26 114303.37 115653.04 112308.12
Conflamide B
9242.82 7667.98 13205.28 7283.00 8279.67 11784.90 11429.72 10347.53 9476.20 6886.99 7010.28 7271.49 6484.89 1900177.06 1508879.42 2030885.16 1774863.38 2181549.03 2387499.87 2030641.63 1821647.53 1949848.59 2196540.85 1982669.13 2090513.76 1959336.22
Conflamide C
9242.82 7667.98 13205.28 7283.00 8279.67 11784.90 11429.72 10347.53 9476.20 6886.99 7010.28 7271.49 6484.89 1900177.06 1508879.42 2030885.16 1774863.38 2181549.03 2387499.87 2030641.63 1821647.53 1949848.59 2196540.85 1982669.13 2090513.76 1959336.22
Coniferin
15918.49 15908.98 60748.75 12708.42 14533.96 21085.20 19870.69 18193.87 16863.77 12565.26 12349.12 12746.97 11738.67 2640917.22 2872442.57 3296747.97 2778210.52 3684085.49 3364565.10 2896789.09 2818857.62 2742024.16 3243338.66 2761913.13 3496535.61 2949697.76
Coniferyl alcohol
88149.24 47881.13 39397.84 37803.10 48002.65 36785.44 66517.72 32662.24 34753.09 40001.98 44296.92 33776.33 50306.32 522452.05 437462.37 457971.11 452786.67 464296.68 577578.22 554099.20 407382.61 544725.48 541571.00 491551.06 506123.29 391816.54
(-)-Corey lactone
82348.14 82659.95 90475.13 615305.32 98686.64 70846.03 100878.28 84270.82 85553.44 76190.11 65572.97 152928.53 74179.91 1759486.72 1681782.25 2049704.29 1762389.00 2053093.45 2687616.81 2067974.27 1800299.27 1734492.27 1902034.73 1480838.16 1714298.80 1629525.22
CORTISOL
9233.84 8198.11 8597.34 7471.06 9287.17 12353.79 12162.81 10314.31 10123.08 7130.36 7490.21 8344.56 6550.26 274232.16 200747.92 198060.72 188535.50 172489.85 199720.52 347424.96 207071.59 296599.50 234218.04 327161.61 220023.69 198153.47
Cortisol sulfate
9458.55 8013.57 8383.32 7744.64 8856.19 11781.14 11694.74 10698.50 9959.57 7401.13 7565.62 7803.52 6888.52 1687896.75 1685510.91 1798648.46 1837020.22 2106411.20 1954906.49 2007097.70 2042567.78 2111362.06 2044306.11 2333025.00 1960261.84 1614099.69
CORTISONE
9023.85 7486.32 7736.51 7110.47 8083.52 11313.09 11003.05 10107.96 9110.85 6723.83 6844.21 7099.23 6331.26 240567.09 229992.70 246482.02 259703.28 257254.97 247132.80 317497.50 279683.55 282191.24 277646.53 269475.73 236191.72 227184.70
Cortolone-3-glucuronide
45678.12 41079.71 161082.30 37783.17 34848.64 20132.21 12850.34 11326.48 14861.33 8061.55 7636.95 13394.38 7166.38 10572440.17 9609597.66 11028847.34 9540192.14 11952277.53 13311887.22 10744449.19 9871424.22 10060909.48 10957708.96 10247319.05 11870448.01 11347873.09
CREATINE
90122.23 64852.65 412492.43 82968.94 41479.13 87112.22 87364.02 77152.27 77357.48 61834.00 65635.30 64686.40 48891.81 3012953.59 3465803.78 3760277.17 3835130.32 4710237.33 4662680.03 3752557.41 4464572.83 3611481.39 3849035.63 2640113.11 4060361.97 3942279.93
Cristatumside A
16768.51 14415.89 22072.12 13678.07 15372.07 19614.44 19841.28 19736.28 18279.95 13589.26 13830.67 14010.06 13026.43 1704581.44 1273572.78 1576338.33 1472234.20 1648588.80 1843615.72 1443284.55 1343076.20 1368808.86 1734502.78 1377104.00 1675154.24 1439030.46
Cryptoporic acid B
10999.09 7919.33 8358.10 8538.28 9826.03 11108.16 11251.00 12113.38 11426.48 7939.72 8421.24 8895.07 8316.52 300344.69 288480.22 305921.67 296232.64 315577.01 327694.65 324971.06 337976.56 302764.38 293883.96 312113.16 285328.64 284016.19
Cryptoporic acid Q
13707.14 10524.11 12488.01 10819.61 11750.78 18519.23 18481.71 15116.95 14386.65 10187.96 9554.94 10091.92 9360.30 838719.19 885462.43 952766.30 917448.55 931788.81 1098832.56 835540.09 834381.35 937256.85 1047325.89 908824.46 963074.25 963490.67
Curvulalide
9852.62 16906.69 17297.11 9271.70 14737.81 10907.46 11477.97 11292.10 11077.40 11911.68 11451.11 9460.68 7934.68 665295.59 638271.11 881763.97 752743.95 953047.22 1149627.83 647033.27 701708.88 549025.56 722015.42 527606.26 723104.37 653536.44
Curvularin-7-O-beta-D-glucopyranoside
10122.25 14120.03 35079.52 8088.71 10251.44 12616.47 12325.77 11138.53 10625.50 7729.94 8196.35 8150.21 7184.94 3302914.41 2881292.88 3250359.33 2883676.82 3284751.19 4232178.05 2826266.80 2790806.86 2747844.21 3149125.24 2898133.89 3126415.30 2877075.11
Cutinostatin B
12191.54 20385.71 64643.99 12275.19 13943.76 13279.97 13433.56 13315.70 12196.24 8975.93 9335.25 9450.03 8786.11 4680073.08 3283216.87 4400362.92 4334096.24 4289421.31 6798636.78 3877407.72 3342110.01 2732640.39 3708325.65 3159751.71 3967331.26 3780253.76
Cyanocycline A
10505.43 12948.70 37095.36 8325.97 10789.66 19766.82 16936.20 11643.02 12813.33 8186.52 10708.51 10422.92 7758.86 2220519.11 2225471.03 2537847.80 2023859.73 2203066.16 2401833.71 2370002.46 2111857.80 2116902.87 2236870.70 2028865.10 2406877.16 1970573.31
CYCLIC AMP
18174.57 11875.44 13097.43 13804.96 14911.95 19544.55 22075.85 22010.62 19154.71 15213.65 12673.80 14198.29 14045.91 434236.07 573468.15 656602.38 444982.91 626426.28 695445.41 577785.52 427674.22 521433.46 412384.43 417691.69 509604.94 401610.14
Cyclic-(Tyr-Ala-Leu-Ser)
23715.30 47609.36 144579.55 13083.23 23760.58 24166.01 21143.19 18110.62 17773.99 11868.91 12705.06 17314.71 10501.71 6496958.28 4360397.34 5378530.44 6613060.51 6494732.52 8190265.60 5728183.25 5408897.06 4369360.58 5986447.99 4556071.58 6272063.17 5857251.40
Cyclocarbamide A
10026.98 8360.19 10692.39 7791.11 8730.32 11060.59 11383.19 11313.65 10129.02 7888.47 7621.45 7899.87 7223.33 1280726.45 1147654.32 1625245.65 1446891.92 1419235.27 1723008.37 1616641.63 1296507.40 1287178.59 1449374.56 1314535.67 1441092.81 1099910.67
Cycloepoxytriol A
18043.38 27721.41 113866.56 32990.54 45927.44 37864.65 28244.17 25333.85 32358.78 27799.21 24337.59 20838.90 14346.71 2929544.52 2030019.32 3201265.98 2615796.87 3774098.86 4541940.93 2335559.46 2430759.76 2067814.03 2659582.34 2240377.07 2649488.94 2531985.38
Cycloepoxytriol B
18043.38 27721.41 113866.56 32990.54 45927.44 37864.65 28244.17 25333.85 32358.78 27799.21 24337.59 20838.90 14346.71 2929544.52 2030019.32 3201265.98 2615796.87 3774098.86 4541940.93 2335559.46 2430759.76 2067814.03 2659582.34 2240377.07 2649488.94 2531985.38
Cyclo-(Leu-Ile)
9899.15 10136.15 11582.11 8499.75 10919.73 18259.76 15192.63 11758.28 14000.97 8367.38 10489.91 9943.22 8030.74 133380.29 107862.27 151229.81 114595.41 160221.57 167937.59 156867.66 138045.10 139603.70 139447.01 123400.56 140278.83 109679.87
Cyclo-(Leu-Leu)
9899.15 10136.15 11582.11 8499.75 10919.73 18259.76 15192.63 11758.28 14000.97 8367.38 10489.91 9943.22 8030.74 133380.29 107862.27 151229.81 114595.41 160221.57 167937.59 156867.66 138045.10 139603.70 139447.01 123400.56 140278.83 109679.87
Cyclo(L-prolyl-L-valyl)
8109.02 6870.81 6737.75 6718.41 7441.53 9196.43 9503.07 9327.58 8941.93 6498.78 6763.01 6695.12 6397.07 96949.02 68332.72 88310.44 71253.10 77826.03 99940.46 116959.87 62958.69 94965.29 88493.99 99471.25 75726.60 71122.59
Cymoxanil
31332.74 30268.29 49608.09 51322.69 26321.06 34683.52 37843.98 37798.55 33318.49 26174.16 22130.74 24621.48 24608.47 1408801.60 1880848.97 2311941.53 1919813.13 2778861.22 2715243.86 2255179.81 1766537.98 1947907.45 1602017.81 1765798.00 1651469.15 1323550.50
Cyschalasin B
13003.18 8959.74 11335.91 9227.16 9816.48 16516.15 19233.79 14129.87 13541.35 13883.66 7858.45 8280.40 8148.16 446006.62 473023.44 440863.23 407672.57 604381.48 513789.75 406767.92 500298.08 587510.72 486023.95 661215.23 576898.17 450302.23
Cytochalasin V
12027.08 10674.76 14706.64 9898.47 14141.02 22583.95 22589.00 13495.96 18008.06 9528.37 11555.69 11087.85 8835.95 76393.17 93188.84 84591.24 84058.81 109731.15 89738.18 71341.25 82674.22 109389.40 128725.03 120989.22 117699.87 111116.62
Daidzein
9219.87 9138.54 40448.77 7370.13 9800.58 17465.67 14613.74 10526.39 11104.20 7111.57 9306.22 9219.66 6750.10 1582236.10 2080335.26 1705352.39 1668499.69 1923303.45 1602523.93 1777126.01 1491237.55 2366468.20 2398764.82 1798207.85 1510116.41 1571107.94
Daidzein 4^-O-glucuronide
11407.55 7991.55 9065.24 8639.25 9845.46 11104.73 11992.49 12137.33 11354.25 8038.18 8551.47 9151.94 8430.69 522931.47 576023.44 392001.78 480071.61 300760.25 435493.63 335217.45 217852.80 513000.71 405532.50 396525.04 348285.40 324405.76
Daidzein 7-O-alpha-4^-anhydro-4^,5^-didehydroglucuronide
9813.60 8202.95 7733.39 7525.00 8740.70 11089.67 11322.23 11025.64 10028.36 7476.47 7520.95 7679.58 7117.62 195942.59 222399.98 294065.07 260938.20 248319.62 211614.87 305152.48 274125.99 334980.96 273462.79 238263.35 203522.10 203925.67
Daidzein 7-O-glucuronide
11407.55 7991.55 9065.24 8639.25 9845.46 11104.73 11992.49 12137.33 11354.25 8038.18 8551.47 9151.94 8430.69 522931.47 576023.44 392001.78 480071.61 300760.25 435493.63 335217.45 217852.80 513000.71 405532.50 396525.04 348285.40 324405.76
D-ALANINE
100592.30 84601.14 361545.71 76445.05 65479.63 114482.09 111184.69 101008.25 96853.44 73347.10 82660.34 80093.63 59832.34 5585240.49 5778373.82 5787181.07 6136317.30 6350051.91 7041767.91 6795010.35 6629533.62 6274541.98 6013858.59 5225064.17 6011542.42 6183267.86
Dandamycin
9635.68 7834.14 11766.04 7555.25 8668.95 10671.99 10756.98 10696.35 10346.14 7482.30 8047.02 8106.17 7409.59 656581.46 807507.63 1455355.27 923573.46 1303527.30 1407212.34 997088.10 1144946.33 753042.35 984374.62 739489.90 1065119.82 697852.66
D-Apiitol
30425.42 24713.24 26762.97 25888.38 27869.01 29560.73 48384.14 32808.11 31218.95 24629.50 35701.42 22983.92 18892.96 546941.07 615582.86 641930.87 677566.93 775880.07 873825.42 768339.90 812223.75 640634.91 652748.06 538596.23 694722.57 610755.82
DEHYDROASCORBATE
154176.81 329988.95 1948333.48 148685.67 135039.51 133647.11 103503.28 84633.71 91648.17 66062.62 77760.49 110590.08 50729.04 32929994.00 23962831.49 29510291.79 30544901.02 31035895.98 39143797.64 43279720.28 35667073.88 34111988.42 32552011.82 17935445.40 31104982.12 26884770.83
Dehydroradiosumin
13613.67 10524.15 12148.27 11076.91 12069.94 17084.89 16883.30 15091.06 14002.28 10227.97 9878.56 10425.58 9265.24 404668.27 389152.08 425464.33 380353.89 454424.28 455526.44 342977.70 320946.58 426782.71 390397.35 426806.95 471478.18 406149.79
Dehydroxynoreupenifeldin
11253.82 9152.22 11868.86 9275.38 9663.00 15354.87 18151.40 13934.43 13275.48 13549.07 7841.28 13579.14 7477.97 1512777.47 1842276.16 2747699.90 2776545.17 3637705.02 2650095.16 721395.24 3393574.57 1732148.71 2617392.56 2649570.07 3846393.11 3267870.22
dehypoxanthine futalosine
10320.39 10414.61 9173.80 8650.97 9365.44 11231.14 11099.44 12036.39 11743.35 8087.39 9153.25 9251.25 8051.76 738499.25 889398.10 1120624.02 1087860.43 990622.32 1222676.86 822023.93 772697.71 748475.38 956050.25 743752.47 824316.44 817996.16
Delta-12-Prostaglandin J2
12134.20 9654.00 11706.09 9513.46 9580.59 16676.43 19182.82 14540.95 14831.32 9391.48 9661.12 9393.76 7782.89 200426.15 161997.38 158062.25 144931.92 170331.81 186571.81 352545.38 218500.51 279112.74 211374.68 335132.36 165684.06 160430.32
Dendrodochol B
17777.71 17892.40 17150.19 43751.54 15656.30 22251.01 21182.38 28953.30 23550.24 12988.79 12963.26 13572.76 11801.52 1070213.40 973896.26 1212556.71 1017765.58 1343062.04 1343420.29 1222928.26 1051199.22 1148391.90 1293018.33 1185663.96 1203281.05 1040750.65
DEOXYCHOLATE
12745.53 9405.63 11094.68 9579.49 8964.69 14464.20 18660.40 20707.87 15461.47 14645.85 10515.99 8563.07 7120.42 152876.98 180717.24 179262.63 147051.31 215710.84 234012.06 222253.56 169500.71 207732.92 205906.61 433967.99 187904.32 152454.79
Deoxycholic acid 3-glucuronide
11502.04 9346.75 12313.53 9167.42 12501.33 18581.19 20425.11 13204.85 14559.91 10300.53 9371.78 9492.95 7814.90 1627367.30 1606982.71 1730080.67 1495004.64 1972169.64 2251886.40 1839632.29 1758774.33 1756723.34 1619547.01 1874984.59 2036745.80 1709895.96
Deoxycholic acid 3-glucuronide_
17710.83 13159.99 17391.62 13417.34 15456.18 22291.25 27070.40 25970.76 22444.37 23247.54 12084.57 12060.51 11044.60 644560.00 591711.95 682194.23 568762.69 712365.59 935799.75 666287.64 560746.70 627814.96 609304.07 677694.01 716781.18 675420.63
Deoxycholic acid glycine conjugate
12277.30 9449.35 11880.46 8788.53 15945.08 17612.83 18576.16 17335.69 15691.57 14508.31 7975.26 8309.10 6992.51 79406.88 94161.27 93403.63 74137.30 109274.66 125126.00 104849.38 110797.35 107539.04 97540.21 133369.23 130945.87 79358.16
deoxylimononic acid D-ring-lactone
9395.24 7692.94 12762.53 7814.04 8796.36 11613.81 12636.42 10621.96 10694.54 7228.49 11061.65 8352.92 7506.63 396309.54 511305.41 383347.94 289808.88 519065.89 544571.12 517385.19 356571.59 345861.25 400873.62 334229.03 330646.02 293038.02
Deoxyloganic acid
11969.49 10892.35 11308.37 9637.96 11393.04 16083.13 16173.98 13532.85 13909.49 9533.77 10440.19 10391.31 8771.47 350206.76 369560.12 404102.69 377922.82 577448.75 463697.82 391957.43 349324.27 357133.33 413225.27 351428.53 427242.20 371124.03
Deoxyloganin
13052.57 11092.04 10568.27 10370.70 11861.86 14737.78 15338.54 15164.58 14101.86 10465.93 10695.04 10849.77 10078.76 676122.33 600990.12 736881.41 694924.86 796077.42 799524.01 656333.40 610087.82 629820.92 767299.13 599787.30 714000.57 642191.56
Desferrioxamine Te3
8101.27 5989.35 6787.46 6365.35 7000.60 9355.56 8322.51 8598.82 8189.89 5696.89 6231.57 6812.42 6293.16 217802.84 388358.27 444544.51 280441.07 653881.70 464091.09 331280.86 320281.16 284939.90 336105.25 251119.94 342120.59 276810.77
Diaporol B
9929.14 7805.88 9168.73 7993.61 14759.38 13277.66 12934.37 11084.31 10412.74 7379.35 21920.09 7685.13 6834.71 247568.93 238376.84 233084.06 214836.14 330865.20 298351.44 320304.57 300741.10 283594.37 313029.38 356870.85 252524.36 243571.39
Diaporthalasin
12420.08 9590.93 14559.37 8802.79 18338.45 25860.97 22146.57 13987.98 21817.11 10468.63 12224.83 11070.99 7425.02 64180.28 74221.75 94584.96 84317.20 146462.72 140477.43 38931.90 72901.61 59448.22 119557.86 109982.02 179364.57 138850.55
DIBOA-Glc
25295.31 16963.89 18109.53 15871.42 10861.87 24427.73 24540.93 24348.34 24240.79 16135.18 17395.11 20326.18 16530.90 252434.32 214986.97 214914.34 278705.76 238556.39 309953.80 250006.20 381998.56 314107.12 255617.29 203066.13 219528.23 323491.62
Dibutylmaleate
228586.90 121436.21 294329.53 117142.49 149176.45 507951.84 795047.24 633379.29 771587.00 523772.71 371998.49 597198.17 360093.82 5467563.46 4226341.41 4434978.88 4410327.13 4536983.76 5437867.64 4137907.08 4235371.13 4898472.43 5636998.00 5876288.97 5544830.57 4458095.82
Dibutyl Succinate
126873.88 45303.51 56143.79 28258.61 208123.56 32067.00 37866.18 66592.01 41367.80 64042.71 63662.52 36496.88 35742.61 1407474.44 1160363.61 1207726.37 1218996.21 1290809.77 1381557.33 1290352.32 1240121.24 1265136.34 1271898.87 1555063.64 1344124.60 1085843.59
Dichotocejpin C
18697.83 25462.70 75891.61 19811.77 15213.59 15529.30 13763.97 14627.41 14136.17 9619.54 10925.59 11324.59 10239.90 2307149.68 3483664.63 3518783.45 2912230.45 3655731.70 4140718.20 3686200.82 2809702.11 2989385.97 2913835.28 2863540.83 3466692.59 2582378.12
Dictyoquinazol B
9531.51 7485.96 8428.34 7633.59 8718.94 12513.64 12620.35 10517.60 10087.06 7059.07 6803.67 7331.16 6441.99 93652.11 86154.31 96466.04 82118.58 108148.99 100882.94 87108.74 88331.63 102237.47 122492.34 115430.13 109876.87 98094.28
Diethyl(2R,3R)-2-methyl-3-hydroxysuccinate
13578.05 10630.53 14726.74 10816.16 16862.55 14464.40 14629.21 14890.72 14131.00 10684.84 10983.19 11629.01 10861.78 479030.77 457504.12 586203.67 558408.73 682113.28 775091.67 538518.59 506328.87 409880.95 564746.38 378914.47 478898.73 440428.89
Diflufenican
8946.66 7360.51 7711.81 7215.28 8074.18 10812.64 11764.71 10031.40 10405.99 6863.23 10376.43 7776.70 6926.70 193779.24 220756.70 195817.10 157196.40 195317.81 226285.96 353581.86 271865.00 363555.96 274261.46 250201.92 228042.59 160851.52
Dihydrocaffeic acid 3-O-glucuronide
15447.43 26448.12 63226.07 12293.69 14899.77 14877.81 14897.88 15753.61 15321.45 10260.50 10763.68 12328.88 11962.04 1594454.98 2248445.01 2966253.74 2389979.39 2074171.73 4788526.76 1733793.81 2382733.41 1471702.53 3251840.77 1940401.34 2431254.11 2143578.61
Dihydrocaffeic acid 3-O-glucuronide_
14778.18 18274.41 27663.72 12098.32 14700.68 14336.90 15566.41 14919.99 15081.14 10525.49 10877.27 11428.91 11535.25 1818043.18 1835987.59 2210673.96 1893221.03 1880197.67 3212908.66 1713246.86 1838844.87 1261204.42 2323360.69 1612895.13 1765560.49 1505587.31
Dihydrocaffeic acid 3-sulfate
15892.43 64491.17 80941.73 12030.13 15556.67 14106.35 15338.37 15157.74 14396.12 9769.80 10156.34 11266.89 11337.40 12835324.57 15684347.78 16697169.53 12530932.88 14854759.14 24147796.49 18984501.40 16154351.97 14427214.30 16306052.20 15469371.92 14088774.21 12266399.00
Dihydrocortisol
11960.28 9515.62 11538.30 9377.10 9443.27 16437.40 18907.87 14332.53 14618.73 9256.87 9522.64 9259.11 7671.33 71181.85 68661.10 59213.45 54331.28 71459.13 71204.79 122276.40 87363.60 99164.47 80854.37 118080.33 68720.05 65593.07
Dihydroferulic acid
18718.20 64895.87 83237.71 47587.99 45168.56 12408.28 29758.60 12760.67 14840.44 22006.11 11007.53 26731.47 12635.13 2697483.81 2781062.73 4110445.88 3286787.70 3698595.74 3933246.47 3533317.68 3419761.30 3208871.61 3496787.19 3661761.68 3174908.16 3020522.92
Dihydroferulic acid 4-O-glucuronide
16574.23 24405.13 106761.44 14846.69 18672.76 18546.30 16204.63 17421.86 16250.91 11092.33 12616.09 13264.35 12253.31 2126447.63 2350088.70 2233804.24 1702753.39 1934991.40 3787587.08 2455443.84 1625102.39 1578852.06 2017738.05 1897288.52 2263828.54 1847263.94
Dihydroferulic acid 4-O-sulfate
11309.85 30806.99 73256.79 12435.81 10707.98 10781.65 11149.34 11871.52 11299.50 7718.63 8319.60 9493.23 9024.16 7352912.20 8033312.08 8635504.97 7333187.67 8774692.35 10617228.37 10875989.15 8062730.00 7697386.73 7942470.06 8688923.73 8276403.76 7268441.02
Dihydrogenistein
8446.68 8540.09 8246.79 6887.49 8218.12 16321.90 13151.84 9812.65 10298.65 6645.86 8696.79 8615.90 6308.06 67753.13 84521.34 104330.26 71100.43 174722.88 136325.54 143365.22 81889.99 84482.35 159629.43 92180.04 73877.45 82395.22
Dihydroisoferulic acid 3-glucuronide
12393.91 57106.39 69109.80 13971.26 15013.95 11870.25 12228.29 13006.09 12809.47 8502.31 9123.76 10400.51 9886.61 2895855.88 2842437.08 3648046.71 2609492.41 2627627.01 4806778.46 3160081.65 2761040.54 2405325.31 2591026.91 2343289.40 2766890.71 2755954.24
Dihydronaringenin-O-sulphate
9534.91 7949.91 7586.03 7408.77 8301.88 10517.80 10824.57 10758.44 9631.95 7501.35 7247.43 7512.19 6868.85 549354.42 469749.12 568293.28 482182.25 572435.39 772950.39 718393.01 486282.08 687240.04 653887.81 693989.41 544979.95 429691.81
dihydroresveratrol 3-glucuronide
128579.53 196279.91 614588.61 107773.96 85627.48 61838.22 16830.55 15416.45 14312.80 10605.08 10571.98 10701.01 9876.54 22701325.13 24299269.47 26479212.63 29183341.04 28987297.14 30236009.54 26546455.66 29362772.01 24459613.96 26642768.26 25229540.03 27911010.67 39358607.47
dihydroresveratrol 4^-glucuronide
128579.53 196279.91 614588.61 107773.96 85627.48 61838.22 16830.55 15416.45 14312.80 10605.08 10571.98 10701.01 9876.54 22701325.13 24299269.47 26479212.63 29183341.04 28987297.14 30236009.54 26546455.66 29362772.01 24459613.96 26642768.26 25229540.03 27911010.67 39358607.47
Dihyroxy-1H-indole glucuronide I
26073.62 55699.41 169265.37 16780.31 19912.52 21434.27 23586.94 22019.38 21210.51 15558.47 14054.30 15721.38 15700.17 4329810.12 5664598.33 5387575.42 4432260.95 5400303.37 7105869.25 5336223.93 4800948.71 4527191.17 4653335.18 3709029.43 5059154.40 4433948.12
Dimethyl Phthalate
15781.99 43649.45 56930.72 47272.16 80020.58 35639.45 35343.02 12917.26 12139.98 10863.70 64090.64 11487.91 44819.64 857058.91 869922.95 1151422.90 1102355.79 1236504.60 1304761.71 1011813.10 974217.65 1039248.93 914829.58 871589.80 961315.10 743109.75
Dimethylvinphos, Z-
7672.57 6403.09 6228.92 6192.00 6807.53 8577.49 8851.98 8596.74 8270.27 6013.51 6414.89 6277.06 5850.41 59467.33 40097.26 39297.73 62249.04 51529.44 48373.84 66676.47 54206.73 62332.83 48195.91 53760.10 64765.38 59325.53
Diphenol glucuronide
14495.20 8981.87 10861.07 11875.67 12977.35 15363.39 16005.12 15812.75 14736.35 11223.86 9576.85 10779.81 11131.79 463071.41 567679.25 648181.89 474079.67 613102.90 870711.34 583845.06 500119.75 413483.19 425629.94 412481.47 489267.54 453798.04
Dityrosine
8864.51 7387.99 7186.33 7133.18 8058.40 9815.25 10328.63 10139.24 9564.95 7117.10 7498.17 7693.47 7140.14 284199.43 271215.30 315805.83 285621.05 319619.59 344550.26 300559.75 284715.68 291535.45 311023.52 270986.44 310144.61 298251.16
DKxanthene 504
9601.95 7472.27 8648.36 7629.94 8510.96 12937.90 11946.10 10758.20 10067.04 7297.60 6829.24 7209.77 6579.23 178494.48 123379.96 172917.43 166844.61 172168.67 169290.98 167654.61 215726.65 129201.96 138486.24 207830.68 161114.57 135415.49
DKxanthene 508
11488.04 8372.32 10512.37 8497.30 9411.70 14104.03 16669.90 15310.17 13357.65 14004.19 7637.67 7373.65 6869.20 574575.15 670097.32 708803.18 576272.30 873183.57 958508.59 717682.17 562512.29 734997.48 841663.20 913963.89 811764.87 589883.26
DKxanthene 520
9278.35 7919.94 8047.16 7434.10 8501.08 11595.43 11328.26 10237.10 9765.59 7064.02 7533.02 7490.62 6833.70 183173.13 179129.24 204904.92 178209.49 204001.67 226830.43 192164.07 175708.18 202293.07 211207.68 175262.92 194701.84 191737.55
DL-Lactic Acid
1730957.64 1113002.22 1214186.39 1146122.59 1189042.87 1214068.08 974802.03 837418.69 1229828.18 665634.84 441866.55 1098228.46 1341725.87 10802725.05 9080846.10 13434237.42 11806504.21 14492851.16 15566201.45 11839831.96 10593385.61 10899096.75 10668630.37 7851324.75 11141234.72 9831973.87
Dnacin B1
14210.14 20201.78 43814.79 11419.56 14594.60 26737.53 22908.70 15748.89 17331.92 11073.48 14484.83 14098.54 10495.00 2716199.02 2900472.05 3205614.11 2994925.11 3059694.67 3570407.33 2853973.72 3051121.09 3539730.29 3254617.35 2767707.12 3456186.39 2702863.87
Dodecanedioic acid
126873.88 45303.51 56143.79 28258.61 208123.56 32067.00 37866.18 66592.01 41367.80 64042.71 63662.52 36496.88 35742.61 1407474.44 1160363.61 1207726.37 1218996.21 1290809.77 1381557.33 1290352.32 1240121.24 1265136.34 1271898.87 1555063.64 1344124.60 1085843.59
Dongtinganthracene B
11574.56 10212.18 14284.34 9460.64 13682.84 21046.78 21055.23 13482.12 17937.85 9223.80 12070.40 11336.63 8325.56 58869.67 113360.00 152900.09 127803.77 147947.37 114688.15 87992.33 43595.40 71979.16 48347.06 102607.98 93912.38 100650.12
Dopamine 3-sulfate
57499.76 24690.06 87254.06 24338.36 10519.19 25668.89 21811.53 23545.31 23132.24 15491.02 16821.40 19655.81 15985.69 791424.99 803646.02 618136.33 693607.78 843675.79 669372.27 913215.87 884638.46 863409.38 839681.77 763964.28 897413.59 938926.88
Dopamine 3-sulfate_
37482.96 22164.00 19366.93 12546.03 11157.45 16553.41 18643.13 17513.18 16791.39 12130.58 11647.28 9887.54 10137.92 811456.81 1249994.45 1035318.88 846862.90 1442928.76 1082576.28 1486950.14 1014774.98 1351285.03 882591.54 1049991.64 1287711.53 1216551.57
Dopamine 4-sulfate
57499.76 24690.06 87254.06 24338.36 10519.19 25668.89 21811.53 23545.31 23132.24 15491.02 16821.40 19655.81 15985.69 791424.99 803646.02 618136.33 693607.78 843675.79 669372.27 913215.87 884638.46 863409.38 839681.77 763964.28 897413.59 938926.88
Dopamine 4-sulfate_
37482.96 22164.00 19366.93 12546.03 11157.45 16553.41 18643.13 17513.18 16791.39 12130.58 11647.28 9887.54 10137.92 811456.81 1249994.45 1035318.88 846862.90 1442928.76 1082576.28 1486950.14 1014774.98 1351285.03 882591.54 1049991.64 1287711.53 1216551.57
D-Phe-L-Val-D-Val-L-Tyr
22558.28 21513.26 31920.92 18734.59 31700.75 49229.65 43301.67 27564.87 42964.39 18814.89 33737.86 25540.54 17179.60 1268349.49 1198221.91 1419707.82 1330208.28 1575341.82 1421142.31 1275346.87 1295827.31 1234850.29 1440695.74 1532412.61 1488317.13 1411648.32
(E)-2-octenal
16761.16 29555.86 33378.82 11060.20 22638.21 81079.28 72178.07 15397.99 43490.52 29986.91 49878.02 28583.41 11692.43 1574985.15 1472023.51 1637615.02 1861270.43 2019939.62 1821508.26 1937234.72 1481608.55 1790096.68 1874822.65 1681723.49 1760789.04 1653363.39
Ecgoninemethylester
9616.15 8157.57 15239.56 7676.99 9910.93 12737.28 11868.57 10628.48 9904.54 7582.11 7457.04 8833.35 6922.81 848768.87 845721.83 1091530.06 883658.94 1213523.94 1037092.14 991733.21 918129.03 1080876.56 1124203.80 910217.30 1033164.02 960424.55
Enamidonin
11853.58 9136.10 11114.41 9280.21 10180.36 15776.01 16493.79 13098.32 12568.06 8861.99 8386.52 8752.66 8072.92 116979.67 78310.04 168768.33 90927.88 119038.22 102498.04 125389.05 97969.26 159940.45 90260.49 190858.67 161932.43 86122.24
Endolide B
10162.35 8736.83 11176.79 8182.49 9461.73 12740.51 12742.68 11638.65 10673.36 7923.52 8231.26 8580.38 7538.55 518511.67 519094.21 561970.32 553716.87 592415.82 639916.61 509573.27 523806.10 562260.21 606533.30 539720.38 557791.36 577613.01
Enterodiol glucuronide
11356.67 9393.09 9211.19 9184.75 10206.61 12687.90 12991.67 12751.75 12224.53 8957.16 9299.18 9436.63 8845.79 340195.98 481390.52 398008.41 433811.26 373714.48 414904.27 334082.66 850396.71 341781.16 361618.50 335094.55 380691.04 306068.73
Enterodiol sulfate
10056.02 8414.46 8016.69 7989.84 9088.23 11354.36 11817.19 11683.17 10864.42 8063.21 8083.60 8358.93 7764.93 221552.22 184773.40 226870.49 282034.60 306552.73 302864.27 277626.25 564477.10 299005.82 324764.72 314106.82 305095.47 216166.20
Enterolactone 3^-glucuronide
15982.80 13826.41 36119.08 12737.05 14150.49 17278.49 17374.02 17916.46 17709.25 12371.93 12979.60 13302.64 12031.05 3379117.72 3351132.53 3746897.25 4318915.00 3938021.58 3910755.56 3856458.78 3913935.20 3788833.43 4020184.40 3450495.28 3916583.14 3455706.25
Enterolactone 3^^-sulfate
10684.21 9242.70 8834.28 8514.48 9459.34 11550.35 11330.91 11976.82 11838.31 8270.41 8676.62 8892.57 8042.54 805611.82 699908.66 781844.05 831454.63 893881.23 859642.19 1243956.95 1647630.10 1284437.84 980943.07 1021546.79 1047320.75 588072.49
Enterolactone 3^-sulfate_
10684.21 9242.70 8834.28 8514.48 9459.34 11550.35 11330.91 11976.82 11838.31 8270.41 8676.62 8892.57 8042.54 805611.82 699908.66 781844.05 831454.63 893881.23 859642.19 1243956.95 1647630.10 1284437.84 980943.07 1021546.79 1047320.75 588072.49
epiandrosterone sulfate
36982.67 84401.67 148132.55 47515.14 148243.49 123865.35 117552.15 68600.33 182526.82 47068.54 132239.12 98080.84 56556.57 6458225.86 6988046.89 7036341.85 6309005.63 7851185.17 7508948.66 8332240.90 7157133.63 9105324.08 9474285.68 10023665.57 8362993.95 7109737.46
epiandrosterone sulfate_
10957.40 14245.73 46440.15 10782.60 9979.21 16740.18 24620.36 13053.37 13253.95 8943.04 8821.35 9081.80 7674.53 1777118.06 1930474.59 1991480.39 1994942.94 2236768.22 2182077.54 2256304.02 1979477.02 2554012.03 2579059.68 2273115.04 2344966.30 1936536.28
Epicitreodiol
67823.00 53953.70 53693.61 52030.26 74861.37 58969.11 99309.13 179351.89 298519.79 140623.78 63595.07 63868.71 51236.02 623694.32 678461.50 717394.32 928427.14 1485103.09 920118.22 645855.47 708944.09 774577.16 1081760.70 686628.55 1013540.78 929048.59
Epinephrine
10435.09 20449.29 42375.70 8290.45 10399.45 14880.08 12021.04 11520.04 11513.94 7904.41 9230.19 9949.68 7964.41 2629562.29 2380149.67 2595328.45 2531192.94 3124624.76 3870685.30 2920380.36 2607732.24 2169640.59 2572557.78 2047408.12 2598268.83 2491487.53
ERYTHRITOL
118140.85 103759.23 89107.99 94186.04 107010.34 147177.78 143701.36 127955.68 124079.78 90720.59 99191.58 99600.22 80706.52 974222.99 1351782.62 1435390.35 1328713.38 1402696.30 1624503.50 1703934.98 1098409.44 1163709.35 1196449.14 1061407.72 1279708.44 1256819.12
Erythronic acid
671208.81 563759.94 2861372.01 583705.61 371613.27 311475.93 130390.07 127088.09 114198.44 81789.80 89426.87 230430.20 83143.91 52829559.33 60007376.26 62937494.30 58814847.21 60732576.17 62579668.34 76591893.12 64899151.48 63085413.28 62572739.99 61392011.03 60262341.27 54956104.79
Estriol-16-Glucuronide
9891.46 8237.50 8386.07 7956.75 9014.76 11866.48 11777.50 11095.45 10418.33 7721.05 7819.70 7955.80 7201.05 387726.25 288263.45 432979.25 382332.62 349179.13 505446.60 353622.78 310805.57 389408.10 418276.37 386875.35 389311.80 381230.73
Estriol-17-glucuronide
10600.90 10425.09 10439.80 8385.43 10887.71 19946.45 17090.11 11672.85 12929.77 8260.92 10805.82 10517.64 7829.37 566437.13 443598.53 609723.98 575270.06 561702.33 520903.67 464540.35 561457.28 467336.39 539958.95 585916.37 627879.59 554505.92
Estriol 17-sulfate
9120.84 7636.81 7499.80 7231.97 8163.20 9909.95 10508.22 10445.50 9719.00 7178.82 7717.11 11314.74 7237.59 1721876.78 1205232.19 1578345.78 1512962.58 984093.60 2010792.46 1678998.81 2171953.45 1896012.10 1546109.35 2895136.14 1289215.94 1416581.12
Estriol-3-glucuronide
10364.56 9043.17 27864.22 8547.00 9512.17 11351.40 11727.14 11854.75 22120.28 8423.82 18130.77 127153.86 7797.02 28885312.67 21969004.03 32286992.31 30539820.19 30728600.86 27001944.50 25850179.34 30012288.59 24569867.17 26829803.97 30691206.40 30763018.19 25071368.09
Estriol 3-sulfate 16-glucuronide
15024.90 12336.83 12925.63 12193.51 13726.38 18122.90 19718.64 17732.87 17268.67 11383.24 17391.77 30847.28 11713.80 2754647.93 2003812.83 2808068.98 2574681.05 2464237.98 2736520.49 2151477.37 2568926.03 2108163.66 1852150.06 2542691.17 2545976.26 2144451.87
Estrone glucuronide
9664.46 8249.52 8308.23 7712.97 8933.99 12214.62 11997.24 10824.11 10171.97 7354.59 7846.50 7756.44 7118.08 1906343.89 1448377.70 2200771.80 2105517.40 1765560.80 1817140.39 1685360.67 1836899.54 1869738.98 1965721.70 1807152.29 1938019.37 1837356.87
Estrone sulfate
9336.86 7971.03 8186.97 7454.02 8434.15 12080.84 11473.76 10637.11 9544.39 7370.05 7205.28 7476.63 6733.54 492717.42 254420.78 438610.29 538919.23 259363.47 616811.06 547199.30 579699.40 780534.14 732317.39 848652.00 444441.66 428655.14
Ethyl 5-amino-1-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyri...
9501.23 7929.19 7713.50 7698.16 8430.02 10621.83 10968.94 10645.67 10241.38 7446.76 7943.80 7773.12 7244.79 1367677.11 1113599.85 1050058.42 1525882.72 1504689.07 3190145.77 1169138.15 872092.50 858325.02 1451224.91 907864.35 942277.95 3097502.86
Ethyl acetate
26027.11 87901.69 112117.39 44233.50 70676.76 27858.25 57776.65 29392.35 27295.32 48604.39 16994.81 47412.72 73882.24 1045667.77 1146468.50 1338269.33 1142985.92 1252331.48 1629846.94 1718734.08 1148398.93 1506255.54 1042240.69 1353061.39 1143186.06 965024.19
(+)-ethyl homononactyl nonactate
9746.57 7665.78 8848.21 7774.01 8459.63 13064.15 12910.16 10767.96 10192.28 7415.80 6985.00 7258.51 6720.46 127387.28 153261.98 158884.95 141257.41 167194.55 162905.94 170648.38 149013.61 166445.72 159243.80 182247.92 166403.20 147709.89
ETHYLMALONATE
338150.99 543165.28 1428906.70 614602.80 716396.37 528765.18 615382.21 571901.92 496418.81 451600.99 387947.49 487249.25 603981.93 2619049.13 2839924.43 5152807.32 4044996.15 5261188.29 5913127.26 3420385.86 3491186.07 2915445.08 3001075.32 2569603.69 3215801.84 2944410.27
Ethylparaben sufate
12727.43 8290.85 73114.01 10281.44 11101.75 12330.75 13364.61 12798.84 12492.56 9066.36 8549.10 27010.29 9855.99 983676.38 1298414.42 1159051.19 929464.52 1227101.20 4193966.22 1561013.85 3686352.45 1212498.41 3163225.05 1358765.43 1123724.14 3686180.93
eugenol sulfate
9318.23 7919.97 17686.48 7211.14 8130.87 9983.00 10477.20 10086.46 10012.36 7255.58 7452.74 7405.57 6659.03 2648212.67 2652557.94 3229227.15 2640044.67 3789908.93 4441968.90 4548990.10 3780328.17 3747695.36 4627885.79 3523506.59 3771229.75 2784510.06
[FAhydroxy(18:0)]9_10-dihydroxy-12Z-octadecenoicacid
13780.88 62291.29 52462.42 80779.86 29252.01 18062.49 467471.10 265297.82 436604.37 59934.00 111549.31 13273.45 51118.98 211686.11 377181.11 379576.45 280071.96 470712.44 324296.34 1002516.89 536346.07 534504.15 390063.24 601198.97 332522.23 318999.69
[FAoxo(12:0)]12-oxo-10E-dodecenoicacid
27178.88 23401.44 34577.83 9108.24 56751.96 22878.06 23228.17 18892.31 25531.76 34815.02 26613.52 62129.53 25828.03 879669.18 955169.33 1188619.34 1071096.41 1547415.14 1175375.64 1073631.93 1223262.96 1109294.77 1118533.38 962344.27 1108770.41 807299.65
[FAoxo(12:0)]12-oxo-9Z-dodecenoicacid
27178.88 23401.44 34577.83 9108.24 56751.96 22878.06 23228.17 18892.31 25531.76 34815.02 26613.52 62129.53 25828.03 879669.18 955169.33 1188619.34 1071096.41 1547415.14 1175375.64 1073631.93 1223262.96 1109294.77 1118533.38 962344.27 1108770.41 807299.65
FERULATE
26235.74 38468.51 81790.80 47029.14 66892.28 21137.37 25424.26 12201.97 16582.71 25839.51 98575.56 19062.05 28134.37 1640342.41 1956113.62 2449271.23 2038810.20 2631562.27 2589374.43 2600587.37 2111112.98 2167139.04 2221517.96 2276542.64 2098076.00 2003957.89
Ferulic acid 4-O-glucuronide
14656.26 29363.66 39214.99 11397.70 12780.33 16118.14 14205.43 14852.46 14446.69 10057.55 11053.13 11773.03 11139.21 1398936.45 1494447.54 1662322.85 1306253.66 1671648.68 2386988.89 1706268.78 1354502.62 1204171.93 1262413.86 1247146.26 1407335.21 1365614.55
Ferulic acid 4-sulfate
26841.82 92353.09 159479.17 24239.10 21686.08 19922.18 14044.50 14127.72 13930.03 9317.16 10210.36 11237.15 11046.39 22287340.15 22996288.07 25942064.79 23330062.05 23959837.35 29178693.96 27204303.88 25003988.05 19219920.59 26384832.49 22599384.33 22477161.31 23488448.37
Ficiolide J
12544.45 15320.53 38526.06 10344.04 14897.63 13830.16 14277.79 14538.27 13494.70 9754.90 10354.61 10686.75 9926.51 1835530.51 1509048.95 1994647.37 1950955.36 2102327.45 2721758.02 1794549.48 1670683.70 1423142.79 1674513.51 1510710.41 1721673.66 1658133.62
Fluorescein
11406.65 10839.75 16035.31 9293.76 10428.97 10679.33 11038.14 11909.38 11531.60 7756.71 8113.30 9338.89 8850.67 624235.81 1228471.23 1133732.93 742879.30 1021117.42 1069431.58 1370557.34 1007266.23 1244271.24 1078184.26 973689.28 963815.87 811925.43
Fluvastatin
9125.00 7789.05 7844.48 7244.78 8275.88 11532.82 11327.57 10219.92 9604.19 6944.06 7408.52 7323.49 6720.76 96937.59 128882.47 117247.93 85176.57 117009.85 117616.36 96541.94 143154.82 124043.50 84116.91 120031.43 203467.32 102448.84
Fluxapyroxad
9008.17 6985.99 7041.80 7245.64 8245.90 9588.25 9568.51 9811.06 9683.61 6769.24 7296.10 7671.71 7032.78 281074.76 300968.81 339904.88 300287.00 334145.68 383556.05 410259.08 307836.39 379666.56 374364.60 332377.57 295549.38 277451.46
FMNH
9923.01 7768.92 7867.12 7874.52 9023.32 10221.05 10548.36 10882.33 10290.58 7379.47 8026.65 8385.84 7921.63 217710.11 291532.18 316684.22 207450.28 291182.39 340602.77 303583.30 255272.18 278611.13 256517.79 227738.60 279603.81 246857.84
FR209603
9437.92 7615.35 9769.85 7632.31 8049.39 12740.27 14968.56 11618.02 11030.95 11427.77 6254.24 6803.33 6321.93 107872.92 106815.00 78584.78 103913.77 101709.30 96612.70 64517.58 145619.29 130942.16 64616.35 145590.65 141460.18 127213.55
FUCOSE
71539.46 57505.13 151039.24 46548.46 60460.73 75715.73 90836.45 72492.54 71868.87 59045.21 75139.44 57528.55 34757.51 1771554.24 1955415.41 2423006.14 2279080.92 2667940.84 3171087.21 2297709.51 2308106.43 1702371.52 1921944.10 1960204.89 1997790.10 1939319.70
FUMARATE
56396.66 88728.51 148224.24 41699.39 22967.15 56758.43 79491.67 55096.44 48705.40 56404.47 46707.51 41250.18 45240.95 1786380.97 1782571.15 1939958.04 1614970.98 1718499.82 2225962.14 2974046.45 2027185.79 2186085.32 1852166.89 1712597.94 1740680.70 1763473.68
FUMARATE_
89822.02 108862.43 187025.77 92388.99 70706.59 137284.87 142189.90 79626.78 76131.83 66900.85 103308.76 89675.82 44943.49 1396422.65 1468501.93 1975879.12 1730038.46 2152029.95 2282268.18 1952304.98 1924306.99 1524493.55 1576292.21 1892734.16 1647229.94 1347668.43
(±)-Furaneol
118188.56 757467.89 278082.21 140204.34 136967.04 156991.10 136583.29 109048.56 109456.98 105981.20 276300.42 107898.00 126196.83 962030.98 1055666.26 1215938.15 1090732.74 1211744.09 1509843.27 1536560.18 1146570.18 1057174.08 987159.73 1175457.66 988115.89 889839.97
Furcatin
12577.96 11016.85 105729.03 10047.83 17613.83 15859.47 15263.33 14168.03 17245.89 9526.20 10303.57 10407.60 9150.70 1862201.63 2088836.67 2196976.16 2355939.78 1794144.72 1808374.16 2732691.44 2054633.81 2546058.77 2455300.89 1772645.03 1862101.95 1652059.66
Fusarenon-X
10925.29 9801.25 9824.13 8277.49 9984.63 18740.26 15474.73 11787.96 12234.90 7967.25 9864.97 9491.93 7530.92 321305.93 355000.86 1509861.76 348383.56 394029.17 625737.37 385814.18 327926.45 299359.16 487758.18 480123.29 1763726.65 328862.27
Fusicoccin P
15380.46 13523.11 19005.05 12535.03 18025.27 27726.25 27741.84 17900.21 23894.85 12244.82 16219.09 15261.21 10967.79 630502.85 501818.38 715550.63 654140.28 606317.00 856928.32 579536.98 713898.57 639297.69 618477.62 697420.13 702316.60 731706.79
Fusicoccin Q
14366.39 12593.26 18584.16 11935.34 17453.30 27543.29 27693.03 17282.80 23955.19 11603.09 15628.29 14132.52 10417.75 595254.39 683446.98 698092.18 491979.80 681017.36 701436.76 605730.83 652954.67 698804.69 781898.07 721317.46 723767.14 581428.22
Gabaculine
16781.09 12042.60 55112.11 38243.57 37646.68 20812.91 21889.17 20219.12 18670.00 14261.32 13582.64 19857.96 21554.39 1202829.11 1849312.81 1999224.65 1713023.89 2316802.83 2661468.66 2607665.26 2771325.40 1875417.14 1744050.39 1734571.82 1679219.10 1184007.45
GALACTARATE
39475.31 26473.47 38172.28 24768.59 16975.89 37367.60 38298.04 37997.48 37829.64 24999.45 27146.42 31720.59 25797.75 886061.30 412704.48 795492.60 666341.65 624077.22 891030.99 798202.45 891071.77 919033.33 722979.32 459200.57 725023.68 852922.86
GALACTURONATE
579759.09 236182.95 2135041.28 564155.25 318556.23 160013.42 183161.70 178523.33 160416.96 114891.86 125619.82 132012.73 116794.01 11176886.26 9727236.91 13487666.44 20165200.97 10709917.55 8081087.82 8450081.96 8613317.70 7955100.08 7248125.39 8444262.42 17019222.86 17801940.58
gamma-CEHC
9492.05 7511.88 8481.45 7869.84 8644.95 12054.75 11994.93 10677.87 9907.77 7279.90 7036.24 7402.58 6522.83 1160564.04 1157846.44 1189284.86 1125068.06 1413159.75 1299109.02 1303301.58 1510247.85 1093871.45 1247067.37 1367915.39 1269307.58 1121712.96
gamma-Glutamyl-gamma-aminobutyraldehyde
12181.19 8616.41 24518.80 7973.19 8449.05 13869.69 15797.98 14169.39 12983.82 9750.87 9232.17 8382.82 8425.08 923822.25 900543.51 1474844.22 1011764.30 1571100.91 1725136.29 1299032.76 1002332.15 917496.65 995562.42 657608.46 1153654.82 838267.29
gamma-Glutamyl-gamma-aminobutyrate
24819.40 16644.73 27653.75 15572.81 10657.52 24260.48 24079.22 23890.25 23784.72 15717.97 17067.83 19943.76 16219.88 278823.84 287105.37 477990.39 286149.30 479497.58 366908.90 311493.35 313924.00 235644.83 270133.39 239020.13 305908.06 272982.06
GE20372 B
11305.72 8931.30 13107.19 8292.49 15212.56 20907.83 20420.00 12389.02 16908.59 10107.05 10378.71 9378.87 7172.97 92663.02 115121.14 100090.75 107097.32 104584.87 95021.78 114808.92 171419.98 147422.60 105667.77 106130.89 95968.03 73937.43
Genistein
9396.02 7903.34 24630.33 7506.55 8533.81 12146.63 11681.02 10665.14 9767.06 7098.38 7225.46 7667.44 6683.94 502304.95 714883.12 697342.90 657343.17 897836.55 564196.09 768930.34 569473.41 849773.56 1982221.51 655190.28 586354.32 681219.72
Gentisic acid
14167.05 28794.24 43849.77 11192.27 16569.39 12995.25 16296.17 14492.05 14039.88 10017.65 9872.75 11405.63 10778.78 2381787.31 2640344.88 2993721.24 2620415.90 3132129.77 3426429.05 4394929.75 3245929.23 2970901.93 3173514.35 3159269.67 2774062.14 2105862.01
Ghanamycin B
12711.01 13867.95 26665.35 9914.29 11251.84 13198.53 13057.37 13489.88 13268.83 9265.28 9795.82 10321.51 9540.29 2898101.98 2342738.05 2750112.02 2158077.62 2629570.40 4023211.45 3165059.67 2418281.96 2164492.31 2568705.27 2114516.24 2383680.59 2257302.32
Gibberellin A14
8352.86 6410.03 6529.53 6696.48 7646.04 8890.74 8816.23 9041.17 8939.17 6276.80 6822.30 7113.62 6521.17 101414.74 89885.17 73154.44 71885.32 71565.99 82563.31 129878.89 88807.67 127711.92 88315.10 106125.42 78388.07 75589.01
Gibberellin A53
8352.86 6410.03 6529.53 6696.48 7646.04 8890.74 8816.23 9041.17 8939.17 6276.80 6822.30 7113.62 6521.17 101414.74 89885.17 73154.44 71885.32 71565.99 82563.31 129878.89 88807.67 127711.92 88315.10 106125.42 78388.07 75589.01
Glucoiberverin
10149.11 7587.96 9749.10 7700.35 8204.26 14422.12 15253.31 11695.70 10942.07 10598.57 6907.51 7403.87 6396.34 49310.54 60420.61 44666.53 54391.55 66269.85 42515.12 34908.54 68036.90 70183.71 45301.64 82121.72 74704.19 77921.05
GLUCONOLACTONE
112590.83 114160.15 473421.40 124883.74 86119.85 140116.65 136080.90 123625.77 118540.63 89770.81 101169.44 98028.00 73229.85 3680357.82 4196410.16 3958139.58 3341025.65 4428119.14 3761134.20 4753633.88 4385313.82 4045149.68 3755786.01 3766881.67 3869264.20 3397063.77
GLUCURONATE
579759.09 236182.95 2135041.28 564155.25 318556.23 160013.42 183161.70 178523.33 160416.96 114891.86 125619.82 132012.73 116794.01 11176886.26 9727236.91 13487666.44 20165200.97 10709917.55 8081087.82 8450081.96 8613317.70 7955100.08 7248125.39 8444262.42 17019222.86 17801940.58
Glutaconic acid
145966.88 206210.62 615198.52 210769.70 176670.16 95408.75 70936.60 76771.38 100704.50 43252.57 63384.11 46755.94 72986.19 18733575.28 9058311.90 10402656.68 21604923.44 15898420.57 11458010.17 10995639.33 18932849.18 13086302.49 15778082.66 10765994.26 10232938.89 12062371.67
GLUTAMATE
136849.22 107677.44 359248.57 102122.04 63282.23 152735.58 150089.14 138890.38 128765.34 181763.42 102937.30 103361.37 85567.04 3003857.31 2808065.17 2797678.92 3204975.33 3287553.70 3438569.35 3954074.23 3683458.08 3321925.37 3093019.40 2949584.73 2920569.36 2926204.21
GLUTAMINE
163555.22 125511.24 149688.41 119035.74 74376.98 178032.02 174947.26 170516.92 153222.58 109739.19 119986.03 126092.23 111556.04 2679890.58 2527524.03 2564535.88 2587835.99 2669557.95 2903819.44 2957122.98 2489544.97 2383271.07 2435248.05 2594545.06 2734251.30 2494348.71
GLYCERALDEHYDE
2040849.80 1681194.18 2017093.00 1285104.60 3320343.34 4240336.29 2908477.00 1804387.67 2667805.91 1705414.96 5559664.47 4327360.73 2121866.24 25736195.76 25477100.09 49857596.21 30601335.03 54324186.53 70702098.50 37290538.59 41463122.13 31132645.10 30301033.25 28311998.68 26574020.12 35332827.49
Glyceric acid
103445.53 134633.81 254776.38 92630.45 86097.34 103711.09 122784.22 98161.75 89258.56 66554.91 69896.88 73453.99 78243.73 2531888.11 2919260.26 3443213.05 2529728.62 3066267.20 2664757.53 3343925.24 2829522.43 2939288.40 3231426.67 2387926.35 2936678.23 2507623.81
GLYCOCHENODEOXYCHOLATE
11012.10 8068.45 10240.30 8413.35 9193.07 13931.78 16449.89 15001.34 12897.31 13515.73 7461.95 7172.45 6701.14 68764.21 83909.85 72893.43 56265.35 132157.58 95686.75 100696.02 78252.70 66353.26 81927.34 118341.31 87939.55 58292.85
Glycochenodeoxycholate-3-sulfate
24231.55 10472.68 20856.77 13402.46 13061.10 21605.24 21700.83 28994.96 17302.54 14867.98 11023.21 13635.81 8632.42 2072732.15 2384064.39 2119686.12 1691368.95 3941673.16 2600999.72 2919132.57 1892466.66 1715270.71 2140496.57 2717122.10 2795720.78 1781204.48
Glycochenodeoxycholate7-sulfate
24321.86 17700.98 24756.53 13283.64 12730.45 20195.37 21023.43 28911.30 16347.87 15205.45 10979.14 42238.14 8515.37 4778476.72 5272197.27 4852954.77 4384249.80 6121093.18 6469809.82 5513234.08 5359675.74 5447534.25 4561528.04 5499258.49 7861756.41 5107174.63
Glycochenodeoxycholicacid3-glucuronide
12293.29 10601.84 13471.60 9575.97 11880.24 20901.36 22469.28 14997.26 16023.44 13316.37 9941.31 10829.77 8168.64 1292407.24 1039183.26 1177408.47 1196592.22 1183249.17 1832049.84 1279942.06 1397246.55 1292367.63 1110223.87 1275495.73 1672458.00 1241121.98
GLYCOCHOLATE
14667.24 10993.05 13606.60 10747.21 11516.08 23425.29 22773.63 16323.44 16557.17 14642.68 10121.10 11016.29 8927.23 201790.84 218895.49 219851.33 212688.57 235977.56 279755.27 263484.53 208069.43 196795.42 232736.08 270515.34 301207.30 190075.64
Glycocholic acid 3-sulfate
15968.67 10676.95 12920.86 10634.04 10825.25 19405.18 24097.01 16681.08 17414.70 10546.16 10876.45 10842.23 8743.60 387365.92 616610.11 298649.20 294356.46 1124809.41 348329.41 872769.81 318410.09 206207.22 955113.99 453525.81 604268.35 223866.55
Glycoursodeoxycholic acid
13076.69 11001.66 23300.58 9594.80 24608.12 30388.25 23317.39 14727.48 22970.51 11646.96 12917.20 11747.23 8302.09 1812749.90 1868248.52 1851207.10 1621846.91 2149253.76 2412201.28 2041926.88 1893143.42 2034416.15 2106285.01 2247078.59 2459120.18 1881122.99
Glycylleucine
14821.39 15608.35 74032.05 10836.55 8396.04 16103.77 17839.21 12124.58 12626.46 9744.69 17513.27 9803.17 7162.88 1718160.73 1617534.00 1681767.17 1614803.75 1826674.84 1921466.16 1945852.99 1716959.68 1605347.69 1663684.68 1481478.68 1734690.28 1551914.08
Gombapyrone E
13894.38 10201.32 12964.91 10580.78 11698.13 18517.13 20852.93 14949.69 14398.29 10142.31 10554.18 10280.16 9014.57 350326.44 367367.16 364983.15 368348.30 443664.76 397503.11 613699.75 692458.02 672294.20 632339.00 751556.19 437199.04 449361.01
Gombapyrone F
9066.49 7878.10 7415.22 7162.83 8292.49 10331.70 10772.75 10355.38 9771.28 7191.76 7471.24 7561.51 6787.75 150577.35 176449.88 218407.73 166385.05 267684.10 222752.54 171517.41 203071.42 120774.19 157740.52 121325.34 183067.48 175011.39
Guignardin E
10753.45 6854.18 7942.19 8761.55 9831.76 10067.78 10406.04 11227.39 10871.25 7312.52 7648.69 8804.10 8296.70 177693.66 494328.18 561915.75 277955.79 428331.51 428787.15 543032.46 463515.21 427694.58 517187.72 323510.72 303135.96 249162.65
Haematopodin
9617.52 8372.37 8012.70 7979.22 8873.47 10720.98 10902.11 10983.67 10368.10 7676.53 7912.03 8126.55 7291.46 226425.87 220343.58 286549.97 254512.84 325613.69 291767.09 243778.18 272115.02 239249.43 261733.53 232505.42 337485.85 252841.09
Hapalosin F
10007.00 7808.28 9348.23 7967.65 8740.49 13544.72 13939.46 10969.98 10790.48 7608.58 7200.37 7514.72 6862.06 1311137.18 1171096.91 749471.21 1115785.62 1504032.67 1009676.26 999788.55 1074664.75 772241.96 941975.62 1128218.36 1275975.62 948412.58
Haplopappin
11875.37 9976.37 9430.00 9227.34 10390.29 13099.52 13647.73 13338.88 11844.40 9342.65 9001.77 9686.75 8566.22 563991.19 532149.83 935694.34 1074785.55 1045286.98 1645883.13 492507.18 681091.26 406461.42 852076.47 457329.67 575153.81 849427.68
Harzianoic acid A
9629.25 7782.45 25560.38 7561.72 10230.51 12055.08 11844.46 10786.09 9722.09 7202.92 7178.56 7629.36 6627.32 3720435.69 2230008.11 3544521.10 2980144.86 3732678.15 5512398.83 2925559.75 3004178.88 2751607.82 3474762.61 2962128.68 3559534.73 3099071.34
Hellebrigenin 3-acetate
8026.42 6487.03 6763.42 6261.91 7080.10 10110.23 9872.90 8990.70 8233.08 6072.44 5962.32 6359.42 5522.47 4138413.85 4392100.84 7161363.71 5608005.23 8435397.10 11200405.45 4377402.44 6208404.69 3457756.10 4849980.24 6257226.29 4267285.78 6185897.31
Heptan-2-one
8979.62 7937.58 7822.88 7465.14 8465.08 10511.27 11045.44 10579.99 9859.05 7297.17 7297.23 7617.93 6775.33 247195.29 233571.24 459544.81 459283.33 522339.80 507446.01 410608.04 358464.96 333384.96 369376.36 329822.56 309539.36 241138.60
Heptenal
17184.37 8568.18 15873.56 7584.48 19529.18 85932.36 15243.99 10117.84 11949.73 9107.22 25177.89 13568.05 6778.39 1047220.21 937892.38 1134881.27 1204612.37 1414711.34 1394890.82 1043323.58 995018.03 971225.09 1175932.13 931194.93 1073752.98 1009051.56
Hepteneoylglycine
17193.61 37679.77 76767.90 23196.24 21222.31 14150.37 10912.62 10977.92 10315.66 7415.04 7915.31 11282.51 7545.93 5194804.13 4808980.53 5671918.70 5372054.53 6604711.68 8563196.95 6361404.30 5634830.13 4779998.72 5608647.78 4436762.68 5558316.75 5414502.19
Hesperetin 3^-O-glucuronide
9894.91 8152.85 17462.30 7688.49 8615.33 10957.12 11233.26 11164.64 9995.61 7784.57 7521.07 7743.21 7128.19 812097.39 742398.80 948300.72 1111438.55 1829793.14 1709682.42 1085661.29 1160113.35 772196.47 1603084.35 1441086.64 1378837.78 1086648.56
hesperetin 3^-O-sulfate
9850.77 8628.66 8203.14 8057.44 8977.96 11152.00 11526.35 11560.27 10569.28 7978.06 7931.04 8362.60 7335.12 681962.57 640517.61 753184.80 984333.85 1575817.38 1260599.87 967095.62 1126380.65 871596.39 1220539.06 1317585.00 1519263.43 927064.66
Hesperetin 5-sulfate
9850.77 8628.66 8203.14 8057.44 8977.96 11152.00 11526.35 11560.27 10569.28 7978.06 7931.04 8362.60 7335.12 681962.57 640517.61 753184.80 984333.85 1575817.38 1260599.87 967095.62 1126380.65 871596.39 1220539.06 1317585.00 1519263.43 927064.66
Hesperetin 7-O-glucuronide
9255.71 7744.79 10301.57 7353.97 8359.89 10439.10 10876.71 10753.35 9999.77 7421.49 7440.26 7658.52 7146.95 191644.79 171969.93 208627.47 273516.89 426816.24 421330.57 223416.68 269183.76 153151.07 380772.01 293913.50 297559.24 286212.72
Hesperetin 7-sulfate
9850.77 8628.66 8203.14 8057.44 8977.96 11152.00 11526.35 11560.27 10569.28 7978.06 7931.04 8362.60 7335.12 681962.57 640517.61 753184.80 984333.85 1575817.38 1260599.87 967095.62 1126380.65 871596.39 1220539.06 1317585.00 1519263.43 927064.66
Hexadecanedioic acid
10649.13 12005.79 11285.21 8295.24 15405.05 18105.91 19464.12 12991.45 13774.06 11535.37 10088.90 9264.72 7004.45 174033.24 196497.52 188025.86 177776.72 293120.89 251873.70 243275.05 182786.86 174836.30 199665.32 305904.74 223316.17 205336.85
Hexanoylglycine
11514.15 11303.06 26336.31 20153.80 9722.82 10620.96 11176.48 10995.49 14375.51 9572.05 8113.67 8098.08 12849.24 785288.43 743795.93 958889.48 792537.67 971877.88 1151836.27 949855.34 817089.10 900048.91 948019.62 735871.36 815221.54 801452.08
HHPAA glucuronide
25295.31 16963.89 18109.53 15871.42 10861.87 24427.73 24540.93 24348.34 24240.79 16135.18 17395.11 20326.18 16530.90 252434.32 214986.97 214914.34 278705.76 238556.39 309953.80 250006.20 381998.56 314107.12 255617.29 203066.13 219528.23 323491.62
HHPAA sulfate
77457.63 51945.68 55453.81 48600.41 33309.75 75713.31 75147.61 74557.87 74228.54 49408.08 53266.14 62241.48 50619.81 4186307.46 2235241.12 2607625.78 6576330.35 3972233.07 6250267.17 5786584.70 6518403.36 7586482.71 6675419.32 3888111.85 2917204.06 5918248.31
Himeic acid F
10173.48 9528.07 9268.53 7698.00 9474.35 17428.28 15009.39 11035.98 11698.16 7567.74 9174.34 8852.87 7006.10 546547.88 551767.19 668060.67 481964.37 585726.52 595571.75 626206.64 582614.30 721878.45 598681.55 695771.56 808655.40 540881.88
HIPPURATE
2381116.89 5007958.96 10826917.31 3011096.01 5093346.40 1723684.47 1169177.22 1017089.84 8469971.66 1120296.18 923377.63 1264235.88 1430317.86 461736962.50 544544206.40 566122582.88 546615514.03 564334997.66 712442956.78 674224060.48 589090008.98 480096371.51 529439254.94 433901950.29 535524520.06 463272114.96
Hiroshidine
12477.99 9697.50 10583.86 8704.93 10038.75 17981.79 15732.53 13476.01 13225.52 8831.59 9453.76 10006.17 7814.26 137818.19 136470.44 147045.73 133045.03 168121.84 189964.15 153371.30 115541.42 147632.44 145167.97 155507.19 156856.98 159354.62
HISTIDINE
3936849.25 3905024.73 3949715.18 3952997.78 2804158.82 5085336.28 4142707.89 4548380.76 4278545.52 3531741.03 3695192.11 4024258.75 3228314.52 19470640.24 17051323.89 17781355.52 18428299.02 18184454.88 20326009.42 24549676.49 19533695.70 21286975.66 17908044.89 19609373.58 18667193.62 18184743.34
HMBOA-Glc
19783.22 22555.98 14868.40 15243.72 17557.57 22303.02 24593.06 24384.54 21531.93 17008.16 13828.09 15777.11 15768.77 1403091.57 1767826.03 1926879.50 2151197.09 2401549.05 2399333.69 1716741.93 1733760.22 2622692.72 1895500.40 1375051.10 1335649.53 2463632.20
HOMOVANILLATE
25174.66 452634.59 85647.14 71116.45 155092.90 50162.62 65336.09 39637.41 36073.64 84742.54 29275.69 46772.62 43356.75 1558230.76 1823359.80 2232651.89 1932845.27 2547190.40 2818566.53 1852527.22 2184934.17 1668760.42 2115381.50 1741217.93 1865408.29 1707126.24
Homovanillic acid 4-glucuronide
15447.43 26448.12 63226.07 12293.69 14899.77 14877.81 14897.88 15753.61 15321.45 10260.50 10763.68 12328.88 11962.04 1594454.98 2248445.01 2966253.74 2389979.39 2074171.73 4788526.76 1733793.81 2382733.41 1471702.53 3251840.77 1940401.34 2431254.11 2143578.61
Homovanillic acid 4-glucuronide_
14778.18 18274.41 27663.72 12098.32 14700.68 14336.90 15566.41 14919.99 15081.14 10525.49 10877.27 11428.91 11535.25 1818043.18 1835987.59 2210673.96 1893221.03 1880197.67 3212908.66 1713246.86 1838844.87 1261204.42 2323360.69 1612895.13 1765560.49 1505587.31
Homovanillic acid sulfate
16590.10 67513.59 39885.04 12621.16 15925.20 15594.30 16869.60 16376.51 15615.36 11238.79 10720.33 11759.37 12077.18 8236480.34 5173184.66 6531683.31 5593172.35 5744366.51 10508146.81 6115307.65 7755150.18 5290194.17 6982209.88 6337804.79 5604006.73 5290011.30
Homovanillyl alcohol glucuronide
12443.51 8695.87 8922.26 10106.94 10881.88 12055.69 13066.48 12513.33 12288.15 8864.12 8632.21 9426.14 9636.13 300634.24 397007.50 497558.39 379117.51 383719.72 661884.73 342456.85 348437.17 247534.10 427528.24 380465.46 380181.53 332245.37
Homovanillyl alcohol sulfate
12194.88 10793.35 26902.47 9942.35 10815.08 11513.99 12435.41 12624.54 12011.39 8294.34 8343.77 9531.54 9524.82 1744837.01 2447106.32 2095673.79 1476442.91 1954201.32 3280148.35 3301049.16 3707596.21 2591937.49 2539099.02 2681620.15 2343870.45 1705610.57
Hostmaniane
8862.48 7619.08 6958.94 7105.06 7981.97 10200.53 10346.68 10295.89 9614.90 7182.19 7134.89 7348.11 6770.85 263735.39 229629.47 283906.40 262607.63 324335.65 322156.49 313208.77 254965.73 287738.54 325251.61 242347.38 261598.55 232162.05
HPAA sulfate
13901.07 14005.14 28487.19 11290.81 12156.51 13467.82 14597.01 13990.84 13727.50 9902.40 9643.33 10530.26 10764.84 3267211.40 5016044.68 4269220.42 3669805.96 4643376.36 5985470.11 6514494.49 5660281.69 4681873.74 4557481.60 4941803.10 4385554.74 3101881.73
Huimycin
9336.93 7731.95 7580.12 7535.19 8356.26 10438.16 10779.26 10461.58 10029.04 7288.86 7585.22 7638.70 7174.79 160109.88 192502.25 200135.29 236120.06 237185.13 220668.25 254424.37 225690.12 220973.49 196790.68 222180.88 210516.09 175091.24
hydroxybutyrylglycine
128177.31 54496.55 242003.64 96977.25 62089.04 68290.59 25265.60 25067.33 52417.92 74583.52 17908.77 36059.29 17019.04 3309637.83 3052255.43 3715935.25 3472410.62 3815231.10 4513640.44 4010702.40 3899126.15 3116773.57 3256504.85 2983975.23 3194540.71 3088215.65
Hydroxyisocaproic acid
183369.50 172477.27 140855.68 137040.75 211369.82 134487.63 266764.07 189448.49 210891.04 185315.34 165758.53 145023.00 147503.92 2671213.01 2252144.65 2846497.57 3600512.48 3858555.24 3877640.10 4335248.23 3689112.81 2639819.88 3566182.68 3635745.41 3043694.72 2371821.70
Hydroxy-lacosamide
10206.61 12475.13 22477.41 8465.76 9218.37 11192.91 11138.42 11564.96 11552.62 8012.84 8852.54 9208.27 8008.33 1457441.53 1426648.04 1665857.18 1439903.54 1741637.57 1926549.38 1625387.14 1478500.63 1478340.84 1632568.26 1295353.89 1499172.74 1385103.45
Hydroxymethoxyphenylcarboxylic acid-O-sulphate
17638.19 10822.28 12528.24 14248.45 15440.48 17088.47 18537.91 17945.63 17312.70 12564.54 11847.69 13361.19 13658.83 403978.51 539034.24 484206.35 345173.69 448655.79 584949.58 671706.86 609667.00 539216.80 502076.20 590804.02 530945.18 354714.44
Hydroxyphenylacetylglycine
10821.37 56941.29 80219.49 32680.44 22947.15 10363.50 12582.00 10806.34 10738.49 7276.20 8291.18 13465.26 13705.53 3567874.20 4111076.41 4737462.94 3408757.77 4109381.62 4914885.06 4965868.31 3825479.01 3695705.06 4015938.23 4381132.38 3893669.71 3593215.57
HYDROXYPHENYLLACTATE
29387.12 85579.13 110200.45 118196.86 187709.17 75427.51 46797.35 27707.42 38468.55 127938.02 99472.08 49139.97 47932.74 4618646.49 2793985.31 3894956.14 4614185.54 3875386.34 5280705.06 3192402.95 4636205.20 2808798.39 4648125.10 3055867.13 3052411.51 4039626.71
Hydroxypyruvic acid
263055.82 556364.39 1065561.51 319713.62 139264.93 223444.23 194759.07 120978.43 168290.61 117276.02 168928.29 129765.41 106265.22 2518459.94 2023093.74 2938356.59 4663451.07 2072378.78 1207154.27 1744208.97 1260013.61 1342879.01 1268953.99 1493183.66 4173182.57 4171872.98
Hydroxytyrosol 3^-sulfate
24728.32 34825.64 75972.33 15888.63 17077.06 26546.64 29596.71 28929.46 25647.92 20593.67 18217.48 18820.33 18131.77 2487578.18 6720812.35 6214532.78 2811088.91 5538250.65 5399789.86 3137835.56 4387186.37 2906113.20 2924148.60 3976128.18 3489474.27 2990432.52
Hydroxytyrosol 3^-sulfate_
27187.83 17750.48 23330.40 20815.18 23971.84 30334.87 33460.32 32992.46 29132.85 23197.18 19054.57 21752.74 21370.46 1586456.09 3393188.65 2554852.67 1489215.01 3008368.12 2926349.12 3476407.21 2767524.82 3134267.13 1950238.93 3214037.08 2825759.49 1656018.68
Hydroxytyrosol 3^-sulfate__
13586.77 10632.50 18571.50 11043.47 12028.80 12801.02 13812.64 14198.37 13341.65 9297.53 9286.94 10555.63 10579.70 2227385.32 2692973.37 2424715.87 1739804.43 2322514.41 2802353.70 4503337.76 2183499.95 2686703.20 2374901.81 2648689.18 2179768.49 1620977.54
Hydroxytyrosol 4^-sulfate
24728.32 34825.64 75972.33 15888.63 17077.06 26546.64 29596.71 28929.46 25647.92 20593.67 18217.48 18820.33 18131.77 2487578.18 6720812.35 6214532.78 2811088.91 5538250.65 5399789.86 3137835.56 4387186.37 2906113.20 2924148.60 3976128.18 3489474.27 2990432.52
Hydroxytyrosol 4^-sulfate_
27187.83 17750.48 23330.40 20815.18 23971.84 30334.87 33460.32 32992.46 29132.85 23197.18 19054.57 21752.74 21370.46 1586456.09 3393188.65 2554852.67 1489215.01 3008368.12 2926349.12 3476407.21 2767524.82 3134267.13 1950238.93 3214037.08 2825759.49 1656018.68
Hydroxytyrosol 4^-sulfate__
13586.77 10632.50 18571.50 11043.47 12028.80 12801.02 13812.64 14198.37 13341.65 9297.53 9286.94 10555.63 10579.70 2227385.32 2692973.37 2424715.87 1739804.43 2322514.41 2802353.70 4503337.76 2183499.95 2686703.20 2374901.81 2648689.18 2179768.49 1620977.54
HYPOXANTHINE
27814.34 15687.74 64266.76 19980.77 12890.25 23307.35 21955.05 23700.23 27805.18 15592.95 16932.08 21972.19 16090.87 1197176.54 1337198.47 1190686.11 1169317.16 1533820.99 1418613.13 1545736.38 1504577.64 1468616.65 1434538.19 1370544.70 1292383.27 1178226.09
HYPOXANTHINE_
9140.79 7196.84 32720.90 8516.90 6256.86 9223.47 10411.07 10289.57 9302.59 6488.64 7592.24 6735.94 6415.59 382263.61 534449.08 497720.50 390576.90 601681.51 656647.01 697270.78 511576.29 606962.89 453355.78 471388.56 490554.04 403253.36
Ibuprofen
9403.81 7587.83 9758.90 7604.73 8020.30 12694.23 14944.41 11576.04 10991.09 11386.48 6231.64 6778.75 6310.81 579662.01 743616.85 890511.45 987342.13 1248535.04 1372039.70 972997.16 1303008.82 748614.11 883322.08 1851619.77 747421.18 1028368.73
Ibuprofenacylglucuronide
173468.88 461994.51 854582.85 142949.45 138269.99 137109.67 26085.28 19595.78 20244.64 13488.02 12882.73 12780.17 10306.44 77676205.77 75575868.56 82468265.70 86048072.36 101193006.99 118426019.29 73606921.26 62030853.85 67922615.74 96399629.53 74432383.84 76646083.50 104896324.07
Imidazol-5-yl-pyruvate
92007.16 55880.53 132724.52 61093.85 36434.54 38387.03 14776.05 10738.35 31077.76 12178.86 15761.50 30842.45 11213.03 2384714.74 2262553.32 1738602.90 1780920.83 1735128.63 2024847.88 3013126.79 1902743.64 2677634.79 2164927.20 2195326.35 2219063.07 2038313.58
Imidazolelactic acid
92662.65 77338.77 228863.08 73873.92 47751.19 115437.48 112710.79 99993.40 95409.64 71155.83 77799.97 78120.48 58692.34 3964136.79 3548125.75 3398333.25 3672614.93 3430729.98 4033858.10 5301377.29 4070596.94 4321369.75 3686869.52 4020095.29 3554877.88 3749810.46
Imiprothrin
8958.57 8053.92 7992.03 7136.51 8111.41 14296.47 12841.25 10263.67 10152.05 6928.41 7826.65 7703.21 6377.64 224741.53 191187.55 251544.35 203575.48 204230.86 262006.54 203957.70 271932.86 252448.19 269189.97 202416.16 246619.81 229043.14
IN00107
11170.49 8762.45 9848.81 8874.72 11132.34 15928.73 12868.20 12078.80 12247.81 8461.47 10172.36 10650.88 8525.69 247148.96 247511.83 264311.96 213296.02 236673.56 382105.19 307354.11 211943.04 207121.61 254457.07 184348.45 197749.28 198556.30
Indacaterol-8-O-glucuronide
10199.14 8162.79 9193.98 8299.95 8931.09 13687.63 13147.38 11320.82 10538.24 7740.74 7501.56 7641.22 7019.21 331744.81 269626.69 382051.22 368663.51 318645.09 314801.15 266471.23 406288.52 331563.45 433614.28 429302.56 362755.59 420664.81
INDOLE-3-ACETATE
8518.71 11000.38 22950.35 7020.60 26667.58 9810.14 10010.64 9897.11 9062.95 6709.19 6829.44 7081.06 6708.66 1269276.83 1347122.01 1792332.09 1419450.43 1936189.48 1663228.71 1378448.73 1807696.89 1488504.93 1687016.90 1464779.02 1662435.37 1215686.87
Indole-3-acetic-acid-O-glucuronide
43943.17 130975.03 229571.07 43620.05 39163.40 30144.07 18084.14 19218.60 18573.16 12638.87 14354.86 14879.10 13453.94 12578969.42 14310047.35 14652186.94 13331531.67 16040805.86 15500780.83 14290286.71 14152967.61 12198913.97 13717195.89 11493595.20 14098835.78 11961923.70
Indole-3-carbinol
8804.34 7249.44 7805.68 7323.61 8289.25 10944.27 11907.92 10009.60 10077.99 6811.77 10502.74 7871.37 7073.87 271654.03 323706.58 294171.33 308851.60 353056.04 372512.60 333472.85 325012.32 352819.17 325458.49 308467.42 319964.72 282635.12
Indole-3-carboxaldehyde
129207.77 204163.75 208384.58 201400.46 415743.55 202353.19 250866.11 183260.17 224466.39 207558.76 199895.12 179503.58 191732.65 2794131.64 2443391.86 3060067.55 3362686.41 3325607.54 3549048.01 4640174.40 3530104.62 3218827.68 2946192.99 3735034.89 2914374.68 2311883.43
Indole-3-carboxaldehyde_
139728.09 247479.44 251763.85 244162.97 513622.73 244264.25 316695.16 230309.50 256934.67 237847.96 240801.44 218760.30 243556.71 593293.27 860715.63 804179.71 685620.62 1007457.20 889677.64 1006636.04 678049.78 802819.92 727424.78 906624.85 775959.50 651189.72
Indole-3-carboxilic acid-O-sulphate
8845.45 9037.76 8206.61 7442.22 7955.33 8537.21 8777.58 9282.02 9212.71 6114.96 6534.19 7366.74 7110.56 3675372.22 5524746.32 5439808.13 3648367.51 4454393.76 5760503.57 8874731.97 5240044.14 4309036.73 5162176.24 4154854.70 5542330.14 3492726.76
Indole-3-ethanol
9142.01 7629.41 7421.87 7407.10 8111.30 10220.25 10554.23 10243.18 9854.18 7165.22 7643.46 7479.23 6970.88 633837.05 649375.83 627358.87 665372.12 605673.37 745282.77 753000.47 670406.10 727307.90 751047.56 578906.09 778052.78 647484.71
Indole-3-lactic acid
9306.61 7745.27 47587.51 7670.24 18580.41 10301.57 10900.18 10706.40 10084.67 7273.40 7782.77 8018.51 7376.96 2132048.52 2220995.76 2858331.23 2380782.00 2565563.68 2811162.25 2431106.41 2352009.18 2216747.08 2515022.18 2297570.78 2441817.84 2397622.46
INDOLEACETYL GLUTAMIC ACID
9323.76 7453.60 7805.46 7551.08 8312.75 10097.40 10512.81 10540.07 9928.00 7136.38 7617.85 7818.00 7262.35 282817.06 301180.16 376485.99 325551.54 356156.19 393835.84 275133.35 309597.89 272186.02 326384.29 250464.40 327052.34 312140.88
Indoleacetyl glutamine
21733.63 35566.38 119860.39 23502.81 23233.95 21165.64 11387.42 11830.03 11121.50 7837.64 8573.23 9372.35 8657.97 6951579.54 8093714.79 7728675.86 6613796.30 9039681.87 8728479.41 8159060.06 7532438.26 7139868.67 7166334.59 6663091.67 7264647.27 6396502.82
Indoleacrylic acid
8912.53 7693.68 7574.38 7117.35 8188.94 11101.28 10779.34 10154.48 9377.25 6737.60 7286.81 7350.42 6514.01 1212254.41 824908.08 813670.77 1535333.38 1342763.33 1209452.63 1395299.91 1520795.16 936897.24 839058.68 1881052.73 1383189.98 1211485.71
Indoxyl glucuronide
16550.00 13460.00 21931.42 13210.83 14667.86 16056.41 17657.76 16839.45 16344.92 11552.62 10933.54 12308.78 12641.44 1443919.53 2447034.67 2208303.93 1851118.63 2059813.06 2416524.07 2066912.55 3663484.51 2085096.57 2734989.64 1683330.34 1946680.51 1648222.20
INDOXYL SULFATE
979389.57 1069568.80 4404664.89 803269.07 571842.92 326966.57 24442.77 24029.35 206796.50 17547.33 31062.98 255359.09 16492.44 167596662.07 213728956.60 189249059.93 172346791.30 188726439.84 225059524.57 213527779.01 213316536.86 227328330.08 207992355.34 223302668.64 178301726.09 176327940.75
Iridodial glucoside tetraacetate
14321.74 12647.07 11999.45 11402.67 13430.95 18359.17 17600.97 16308.24 15568.34 11298.03 12195.19 12171.80 10556.96 278333.89 251444.76 297973.75 230407.17 371683.58 273660.46 227838.84 236898.71 208472.86 251053.71 234084.67 288800.30 227179.22
Iridotrial glucoside
25252.49 19556.08 40047.28 17554.45 20244.24 36672.65 31726.37 27175.86 26670.72 17809.87 19064.55 20178.53 15758.32 1976236.84 2123944.32 2948248.45 2213503.94 2649682.05 2478816.20 2492278.39 2070604.08 2170963.99 2636893.24 2205167.67 3370890.05 2099424.15
Isobutyl pentanoate
13368.64 11701.11 12357.51 10520.79 11844.96 16726.41 16333.77 14874.25 13987.16 12366.58 9985.81 10521.06 9174.21 514158.97 570744.77 586453.27 521138.60 645237.28 611993.87 703625.59 551812.16 650624.71 640157.32 616995.76 596054.55 522896.27
Isobutyric acid
26027.11 87901.69 112117.39 44233.50 70676.76 27858.25 57776.65 29392.35 27295.32 48604.39 16994.81 47412.72 73882.24 1045667.77 1146468.50 1338269.33 1142985.92 1252331.48 1629846.94 1718734.08 1148398.93 1506255.54 1042240.69 1353061.39 1143186.06 965024.19
Isobutyric acid_
73522.10 110876.00 159583.96 88028.59 77594.93 60208.51 101683.54 31913.72 55441.52 31500.29 58018.45 33785.15 18254.82 2922336.14 2567880.56 3450841.98 3145354.26 3373737.20 3800819.53 3935314.36 3696809.94 2905942.49 3404540.33 3137567.48 2954654.12 2653247.16
Isoferulic acid 3-O-glucuronide
12514.82 22786.35 16263.22 10290.39 11049.66 11791.06 12674.27 12731.05 12403.40 8575.52 8554.23 9593.18 9716.78 1095273.22 1555897.06 1887443.22 1186602.94 1714232.20 1881016.44 1527687.28 1131547.87 1237096.55 1423629.78 1193732.12 1443091.03 1446947.49
Isoferulic acid 3-sulfate
20407.90 40072.11 22873.16 9049.94 9925.73 12063.09 12696.02 12400.72 13009.09 8820.62 9343.50 9588.70 9010.74 4054459.62 4814060.38 5009156.73 4536612.15 6010442.15 5779751.67 7035411.93 5246702.91 5354605.54 5186620.77 5741469.01 5042526.98 4091748.63
Isohomovanillicacid
11539.48 32152.03 119959.31 48510.41 114712.47 16959.93 47524.40 16562.96 18955.33 67117.53 25293.19 24368.52 34793.44 552883.04 641709.80 860982.75 793341.08 1039397.69 1864375.72 840804.81 938992.86 566805.61 885224.70 826705.95 813957.96 664635.96
Isonocardicin C
12582.74 33570.02 88397.87 11218.70 15010.69 10879.61 11196.94 11078.40 9837.19 7759.39 7471.77 14018.03 7105.14 7146258.14 5620597.64 6888772.20 6085594.40 6957033.63 8422833.50 6468704.76 6086279.16 5848839.34 6654625.55 5523037.75 6652675.05 6394911.83
Isonocardicin C_
10661.43 34359.72 23294.83 8737.64 15472.80 12935.79 13100.70 12383.46 11751.45 8541.05 8659.77 14533.98 7930.25 2519983.70 2410022.97 2867261.29 2402348.60 2861712.34 3456738.92 2394720.17 2278234.36 2408045.08 2528023.59 2418577.03 2719908.96 2470588.47
Isotrichophycin C
10491.78 7894.73 8326.69 8405.12 9539.07 10944.71 11069.77 11412.39 11069.02 7666.51 8304.69 8750.36 8088.06 874736.40 921519.61 1264126.52 909898.31 1300250.33 2163346.02 1254821.14 1334000.90 658879.30 1069142.31 558784.74 808979.67 1205461.26
Isovaleryl 6-deoxy-alpha-L-talopyranoside
8947.42 33197.52 26584.04 10888.56 22549.54 90804.60 14477.69 10318.17 9611.26 11263.73 19685.00 13290.24 9244.88 253431.07 249340.89 317394.96 317034.62 413445.74 357047.79 298367.59 247583.38 251933.40 301281.08 241387.38 272552.46 253177.43
Isovanillic acid
33982.52 68658.36 66860.93 54501.24 94236.04 37396.81 41880.35 57630.07 46883.43 39960.42 43446.12 44191.48 42686.42 1004485.61 1298332.33 1978654.94 1027387.50 1811442.56 1983639.91 1073518.16 1636989.39 1002079.57 1187044.72 1327843.51 1009498.83 1048988.67
Isovanillic acid glucuronide
21001.03 39543.78 46259.04 16181.03 18591.32 23613.88 25846.17 26174.66 22469.97 18077.29 14383.71 16691.87 16380.43 1556553.00 2517570.68 3204650.72 1842183.47 2784592.93 3703816.12 1903348.68 2024437.72 1504473.70 1592420.48 1645943.06 2237662.30 1899678.08
Istradefylline
10940.08 10264.27 8551.54 8692.25 9881.24 12338.83 12856.07 12710.27 11819.55 8772.07 8728.75 9052.23 8447.56 623865.18 525308.58 632616.86 575037.92 628211.40 662751.00 593064.43 562217.68 521798.34 661982.80 523264.95 652728.01 565669.81
Itaconic acid
827084.74 1031117.33 3138302.93 725326.01 622148.04 436450.35 293238.26 262519.08 400010.94 212454.44 193376.25 385343.38 214952.62 71696994.74 55470597.30 65648450.06 65100256.37 69800555.14 88805718.25 94965284.60 75033558.62 68878583.83 64084720.79 68066639.47 62124151.10 58261633.67
IV B
9743.99 7663.75 8845.87 7771.95 8547.37 13060.69 13089.52 10765.12 10313.75 7413.83 6961.55 7256.58 6774.25 91375.70 68220.85 93491.28 94297.95 62349.74 76876.58 118261.42 133183.67 106888.97 78686.57 59780.82 58404.85 49151.20
JBIR-57
15522.51 11963.92 17109.58 12152.63 13331.39 20659.02 21933.05 17152.53 16458.14 11604.96 11156.64 11545.63 10571.66 906578.19 1063285.90 1288985.77 966553.95 1111507.06 1106763.65 1591882.24 1159453.73 818022.19 1134751.92 1162704.69 1255870.01 1312312.50
JBIR-81
14215.22 10724.58 13093.08 10943.47 12004.95 18603.50 19750.76 15445.89 14673.22 10277.10 10047.27 10396.87 9519.81 651266.10 664000.20 641678.30 705146.89 1007639.25 769745.75 1088430.71 757639.94 939504.94 647724.21 1358765.41 700510.45 747323.49
KYNURENATE
15402.17 15904.66 41006.36 12664.53 13771.65 14511.43 15637.66 15668.28 15276.77 10554.02 10527.81 11966.02 11958.58 1039939.74 2037644.16 2186267.25 1364958.03 2111563.22 2348378.90 1855345.86 1497362.50 1397938.35 1580656.27 1431234.09 1656090.33 1195119.86
L-ALANINE
100592.30 84601.14 361545.71 76445.05 65479.63 114482.09 111184.69 101008.25 96853.44 73347.10 82660.34 80093.63 59832.34 5585240.49 5778373.82 5787181.07 6136317.30 6350051.91 7041767.91 6795010.35 6629533.62 6274541.98 6013858.59 5225064.17 6011542.42 6183267.86
L-Ascorbic acid 2-sulfate
425006.38 466052.91 1803845.55 356505.43 247940.90 178042.85 110130.13 92556.99 177761.74 70956.89 75319.03 192755.22 56105.23 6907835.60 6477311.55 6503583.98 6530061.93 7427848.14 7175901.31 9604669.72 7093680.33 8081185.05 7449563.72 7325480.75 6737670.73 5607403.13
Leflunomide
62211.08 50810.18 45964.73 51697.11 32497.70 68249.90 75190.31 63192.41 60607.35 48445.15 51423.36 50679.93 38305.32 427744.83 579286.37 568247.76 561542.07 588480.79 485880.07 679823.27 572510.08 483434.96 551035.52 646043.60 550107.57 509113.50
Lentzeoside C
11086.86 9308.70 9012.40 8579.83 9674.13 11992.98 12489.75 12000.90 12204.69 8746.76 9233.20 9218.71 8154.92 316071.28 217468.32 293871.38 314636.29 419006.13 424030.71 251495.38 235503.14 242045.72 321039.85 218203.37 266830.17 299889.64
Lentztrehalose
9377.67 8360.88 8061.23 7656.26 8848.24 12084.62 11630.38 10791.33 9831.06 7258.79 7685.06 7930.40 6972.66 1130145.11 993305.35 1145307.90 1180784.61 1280188.26 1262610.55 1166822.02 1205972.35 1254176.21 1296503.71 1481003.27 1397838.95 1188238.21
Lepistamide C
10173.48 9528.07 9268.53 7698.00 9474.35 17428.28 15009.39 11035.98 11698.16 7567.74 9174.34 8852.87 7006.10 546547.88 551767.19 668060.67 481964.37 585726.52 595571.75 626206.64 582614.30 721878.45 598681.55 695771.56 808655.40 540881.88
Leptosphaerin
23963.91 16704.92 23797.68 15491.48 10683.05 21864.29 24166.30 20828.37 20190.73 33904.18 17129.56 20015.89 14139.28 264735.92 251178.26 281869.17 275159.97 297143.77 349925.25 304424.53 273578.54 228842.78 255783.92 230648.95 247351.99 247326.61
LEUCINE
19353.42 27230.15 45302.97 13148.92 28727.92 29631.97 24087.95 22266.46 30979.36 29669.49 15721.86 33269.77 18061.85 1140371.61 1081304.31 1284963.73 945905.35 1325056.10 2003713.43 1916767.23 1094796.67 1382135.64 1148255.63 1049124.03 1094464.47 885183.62
leucyl-4-hydroxyproline
38055.83 49926.40 185393.37 29800.64 27888.90 16356.23 12619.01 12093.09 32231.46 8331.99 9689.34 10444.62 8428.01 11389211.71 10687490.90 12697724.77 10245316.17 13239316.86 14477701.87 11809925.90 11497308.94 11197847.28 12152648.55 9567078.08 10938629.29 10501967.03
Levulinic acid
1627975.75 2311199.54 1068741.16 1183734.31 1170665.74 1250486.29 1824365.23 1423343.78 1354420.66 1294683.23 1235113.81 1115720.70 1354302.01 2823966.25 3281350.44 3109996.18 2751960.21 3149693.58 3696084.88 3401342.44 2826482.07 2812405.36 2661931.03 2741706.52 2534155.35 2658251.27
L-gamma-Glutamyl-L-hypoglycin
11603.67 6958.37 8241.98 9279.34 10121.53 11242.02 12078.86 11668.77 11389.54 8265.85 7794.26 8587.70 8917.93 391036.88 481106.14 534245.52 379438.24 454353.97 666668.88 522118.13 393011.17 376439.42 348147.89 358770.85 419644.13 358335.09
L-gamma-Glutamyl-L-valine
18434.07 11301.76 13818.94 15295.31 16746.70 19589.39 21076.84 20014.91 18901.06 14122.83 12373.75 13942.04 14234.15 188868.75 339602.97 411761.99 273657.27 368900.04 525372.80 286209.56 256818.82 220444.48 237278.62 189554.03 355270.88 209225.20
L-gamma-Glutamyl-S-[hydroxy(methyl)carbamoyl]-L-cysteinylgly...
13352.27 74194.83 238040.09 11164.33 12123.80 12750.83 13293.64 13970.93 13796.49 9139.10 9885.87 11246.67 10620.03 1924131.96 4195057.90 4476436.31 3187579.57 2525192.35 3662707.83 7377734.46 4166661.63 4123889.48 3023557.59 2023283.99 2124149.09 1826433.44
L-Glutaminyl-L-Tryptophan
19125.05 15501.85 19597.63 14934.88 16972.91 25014.88 23851.53 21003.08 19210.00 14593.22 14596.74 15381.17 13534.02 949821.56 1061192.79 1163286.53 974175.94 1236930.26 1464647.58 1024215.32 996569.94 1031248.08 1279295.97 1032479.92 1172404.65 1030482.22
L-GULONOLACTONE
112590.83 114160.15 473421.40 124883.74 86119.85 140116.65 136080.90 123625.77 118540.63 89770.81 101169.44 98028.00 73229.85 3680357.82 4196410.16 3958139.58 3341025.65 4428119.14 3761134.20 4753633.88 4385313.82 4045149.68 3755786.01 3766881.67 3869264.20 3397063.77
LimonoateD-ring-lactone
8866.44 7165.94 7565.83 6917.27 7902.11 11168.33 10906.16 9931.63 9094.72 6707.96 6586.32 7024.98 6102.32 1354122.30 1075047.31 1705027.17 1850786.26 2812539.53 3366078.08 1189760.61 1507340.65 849719.10 1181666.15 1387137.78 899878.23 2020315.77
Linalyl oxide
18840.66 15064.65 16543.25 14964.31 16788.76 24756.98 23301.39 20737.46 19193.45 14488.77 13808.97 14403.25 13157.62 742517.91 774766.82 785074.47 708975.65 883382.28 808055.87 916352.16 716338.80 888199.64 862614.40 881261.08 812434.38 730566.20
LINOLEATE
107874.03 1929880.38 382364.99 152625.67 203797.05 77351.92 1134932.05 605986.55 557757.46 441852.64 438835.03 160552.73 104418.51 826903.85 808813.48 697294.34 627608.14 898155.46 1802572.79 1838006.30 1274852.24 1546538.89 1503331.59 1090418.64 616865.83 758060.60
L-rhodinose-2-deoxy-L-fucose-L-rhodinose-eta-rhodomycinone
15578.97 10600.94 12828.87 10549.11 10810.14 19267.03 21972.24 16505.98 17052.54 10333.52 10799.01 10765.04 8681.36 2375759.66 2284823.18 2305978.44 2685644.54 2789094.21 2966789.18 2079311.88 1785577.32 2561335.18 3185687.51 2522429.33 2197299.92 3235453.32
L-Tyrosinemethylester4-sulfate
14219.16 11675.69 22019.95 11133.99 12164.01 14228.80 15657.81 14617.22 13926.77 10328.24 9071.71 10398.98 10339.01 2278337.87 4278515.60 2943313.76 2233216.45 3456354.43 4151214.94 4878336.37 4104659.06 4510501.62 2827887.34 4252773.98 3673665.60 2372210.52
L-Urobilin
9277.93 7827.07 8064.37 7474.81 8579.70 12270.70 11631.63 10555.70 9673.09 7177.38 7143.03 7675.88 6747.48 222482.90 310655.20 384094.99 164056.98 228260.45 229752.84 225806.32 241268.03 214548.78 180257.94 310363.67 406016.82 213137.50
Lyxonic acid
370132.14 906724.30 8147909.28 219387.41 9017391.73 8180561.32 5397136.12 308355.27 12710847.75 309054.47 9874878.29 7788224.86 342468.82 788706.82 10153358.87 20647994.22 604418.14 19130150.66 15500577.52 2772761.23 1517257.87 7867442.93 288993.65 15573106.83 9733757.96 598389.32
Macrolactin P
13134.38 10830.38 17951.20 10379.66 10915.51 17182.93 20456.96 15593.38 18960.56 15162.14 8810.78 52414.52 8368.26 8533496.18 8308937.66 8518303.49 8368115.36 7569170.74 8334315.41 10041894.24 12823107.19 11179794.36 8127379.87 7901498.80 6634206.21 6282268.78
Macrosphelide A
11269.54 15803.19 50645.06 8272.42 15768.47 11376.86 11629.62 11570.73 11037.34 8190.49 8527.48 8530.10 7870.00 2097171.66 2317582.88 2802756.61 2286772.07 2591194.86 2868140.30 2076246.20 1862784.82 2213311.38 2671062.00 2044591.59 2381701.84 2580003.70
Macrosphelide D
11269.54 15803.19 50645.06 8272.42 15768.47 11376.86 11629.62 11570.73 11037.34 8190.49 8527.48 8530.10 7870.00 2097171.66 2317582.88 2802756.61 2286772.07 2591194.86 2868140.30 2076246.20 1862784.82 2213311.38 2671062.00 2044591.59 2381701.84 2580003.70
Macrosphelide I
15030.05 21691.13 74679.28 11999.14 13962.24 19447.19 18663.99 17246.47 16011.82 11863.97 11826.93 11882.44 11048.95 4833163.43 5283490.87 5973140.25 5747819.85 5797834.04 5020677.81 4852918.70 4403936.59 5345243.90 7046008.88 5709148.13 9332594.53 5901141.60
Macrosphelide L
11269.54 15803.19 50645.06 8272.42 15768.47 11376.86 11629.62 11570.73 11037.34 8190.49 8527.48 8530.10 7870.00 2097171.66 2317582.88 2802756.61 2286772.07 2591194.86 2868140.30 2076246.20 1862784.82 2213311.38 2671062.00 2044591.59 2381701.84 2580003.70
Macrosphelide M
11269.54 15803.19 50645.06 8272.42 15768.47 11376.86 11629.62 11570.73 11037.34 8190.49 8527.48 8530.10 7870.00 2097171.66 2317582.88 2802756.61 2286772.07 2591194.86 2868140.30 2076246.20 1862784.82 2213311.38 2671062.00 2044591.59 2381701.84 2580003.70
MALATE
110408.42 392038.24 880812.75 161597.49 165970.32 249111.93 586917.55 81646.80 132338.67 81414.40 147804.82 117061.13 76955.02 7985446.52 8673252.53 12965185.68 10469707.12 11601899.78 13948489.36 15394257.14 12901923.41 10495233.97 10432240.82 8149276.97 9346754.24 9405735.02
MALEAMATE
65547.25 73422.02 121520.22 45433.75 54700.32 35758.56 47711.20 47097.16 57308.39 36957.24 43186.73 27802.82 42603.35 848013.03 1056317.76 1062301.56 1000493.74 1158897.69 1014825.45 1195300.60 1077010.97 1143162.95 1135827.96 1115674.07 965494.90 974574.03
MALEATE
56396.66 88728.51 148224.24 41699.39 22967.15 56758.43 79491.67 55096.44 48705.40 56404.47 46707.51 41250.18 45240.95 1786380.97 1782571.15 1939958.04 1614970.98 1718499.82 2225962.14 2974046.45 2027185.79 2186085.32 1852166.89 1712597.94 1740680.70 1763473.68
MALEATE_
89822.02 108862.43 187025.77 92388.99 70706.59 137284.87 142189.90 79626.78 76131.83 66900.85 103308.76 89675.82 44943.49 1396422.65 1468501.93 1975879.12 1730038.46 2152029.95 2282268.18 1952304.98 1924306.99 1524493.55 1576292.21 1892734.16 1647229.94 1347668.43
Marinopyrone C
14847.40 11443.57 13921.54 11624.08 12751.58 19760.51 20659.57 16406.52 15742.33 11100.23 10671.41 10970.01 10111.87 462269.14 460143.42 515031.79 486253.08 594986.77 619871.72 424460.61 437975.71 468609.83 606198.46 591929.97 601010.94 470360.78
Matteucinol 7-O-glucoside
9566.19 7965.38 8296.81 7664.73 10591.28 11955.16 11679.70 10554.68 10068.55 7289.98 7766.72 7723.00 6808.32 206447.78 222905.13 250665.23 227860.63 207609.90 223532.60 227812.96 234334.29 263524.80 253403.85 206476.03 199144.86 207190.45
m-Cresol
50596.24 117182.12 158216.39 78239.02 73325.48 18746.02 26451.29 24984.16 25255.85 20033.56 12892.42 57074.89 38736.50 2224810.39 2006641.70 2051915.38 1947536.11 2019921.28 2562013.45 3060422.96 2117666.53 2736489.58 2397151.65 2428307.10 1983790.23 1846177.20
Melithiazol I
10097.11 8200.76 12465.14 8056.44 9074.62 11171.39 11260.36 11403.22 10939.15 7832.44 8423.58 8485.50 7756.32 433645.22 369395.38 349182.44 370337.04 364733.98 469637.62 340142.58 395798.76 351415.60 373013.00 284844.06 348465.22 351972.35
Menthol-glucoronide
12324.62 8855.91 11407.98 9385.87 10393.72 17081.65 18510.22 13161.48 13905.11 8790.06 9147.02 9024.57 7895.30 294350.91 307765.12 317825.92 322965.96 403716.26 422717.71 291729.22 283438.38 323528.34 357934.87 401096.00 397795.11 340441.65
Merochlorin C
23462.75 20276.59 27663.61 17963.31 20613.86 25199.77 25583.96 26519.02 25148.48 17972.04 18776.85 19227.44 17476.97 2654255.03 2289687.59 2362749.80 2040226.37 2467914.17 3284462.57 2492823.51 2350120.58 2493000.69 2558134.85 2369687.49 2666556.87 2173015.76
Mesaconic acid
827084.74 1031117.33 3138302.93 725326.01 622148.04 436450.35 293238.26 262519.08 400010.94 212454.44 193376.25 385343.38 214952.62 71696994.74 55470597.30 65648450.06 65100256.37 69800555.14 88805718.25 94965284.60 75033558.62 68878583.83 64084720.79 68066639.47 62124151.10 58261633.67
Mesotartaric acid
115799.90 91115.15 413938.99 86414.24 26097.44 129242.72 127003.33 117527.10 108959.44 79665.40 87104.11 87462.95 72405.63 2121089.68 1493830.35 2271121.52 1383256.21 1276467.08 4479222.04 4649629.31 1357877.48 823998.18 1372701.06 2808375.86 1238305.89 1104552.57
meta-O-Dealkylated flecainide lactam
14501.75 9973.81 402688.34 11079.37 12488.12 53737.76 13442.66 14307.53 14146.53 9568.54 10491.67 11362.38 10959.98 703526.91 864796.15 1115585.07 955773.59 602228.94 720873.75 1959531.00 1191991.28 917110.11 756526.28 385335.11 482615.55 468321.48
Metatacarboline F
10648.28 9033.03 8894.30 8728.20 9777.40 12003.68 12270.37 12208.22 11645.45 8641.75 8997.31 9000.07 8270.79 1298262.88 1238193.98 1847413.85 1503679.01 1622322.66 1510441.83 1304463.38 1506841.05 1166487.27 1488910.04 1569258.58 1586492.16 1320472.89
Metatacarboline G
10898.49 8814.73 9336.98 8604.65 10051.52 14424.59 11933.89 12015.13 11831.93 8136.64 9380.56 10199.75 8369.89 725248.71 594556.05 848070.21 740598.85 796631.48 715084.59 686455.37 756497.70 592845.29 640249.33 773771.86 701348.58 642549.08
Metazachlor
15170.18 12531.73 13327.07 12145.43 13633.94 17107.92 17380.16 17033.72 16055.75 11964.92 12447.53 12645.33 11816.16 1186334.54 897222.66 1457717.58 1082864.68 1486306.15 2139714.49 1045096.31 1059992.16 749577.79 1047364.17 772443.46 1028106.89 1026020.48
Methyl {2-[(2E)-5-(hexopyranosyloxy)-2-penten-1-yl]-3-oxocyc...
15872.82 10789.81 11649.70 11508.92 12383.33 16401.71 15250.71 16130.36 15678.02 10752.76 12048.18 12108.20 11182.59 946424.00 519929.42 666514.04 645574.22 567800.09 762247.10 799890.75 686061.47 512258.80 674395.10 541005.28 578115.53 567978.71
methyl azelate
35554.65 51109.40 63570.84 49623.87 72631.45 22309.54 44174.46 69451.12 71626.17 92665.95 51755.85 36464.44 53372.75 788427.81 753561.92 861872.19 828166.14 1024614.91 1026104.95 881064.14 837707.11 880132.93 1005958.74 926266.80 936347.79 792217.06
METHYLGLUTARATE
262172.26 250365.99 398699.19 243745.36 339318.78 432225.41 365997.46 267908.43 302597.89 237652.80 420995.11 234889.29 249249.34 5584516.71 4844199.50 6470240.72 4573750.42 5743553.23 18777496.67 13832193.36 7377892.25 4574902.96 5144035.07 5655265.84 5373943.67 4348517.33
Methylhippuric acid
10349.94 35195.30 45972.75 8558.57 37272.43 11679.30 12707.68 10835.43 14089.44 8002.65 11434.93 8400.02 13029.10 3101288.18 3841043.34 3979182.52 4364294.94 4468718.83 6656868.17 5567598.26 3857060.67 3903363.17 3664500.61 3099603.65 3883277.79 4069931.75
METHYLMALONATE
600246.50 800536.10 1169269.89 734199.67 645698.60 1005099.61 737296.14 505659.40 585394.29 457541.12 452181.96 497635.50 434393.09 10608993.35 11065761.53 12365680.16 12188259.87 14172302.42 17337692.95 19269961.11 15408635.23 10992820.62 13988676.09 16067900.44 11132499.54 10894730.57
Methylparaben
862954.22 581067.12 2068663.96 292495.59 1054452.29 1614624.71 3597568.44 295774.33 813743.30 278845.93 1766525.04 1844126.37 294110.13 1389620.32 1285411.13 1755918.75 1513444.61 3027565.95 1595552.87 1296627.92 1396655.71 1523660.71 2006599.28 1732800.57 1233914.19 1143228.80
Methylpyrogallol sulfate 1
20694.75 49914.06 87534.16 13719.97 15100.63 22363.34 24371.37 24998.82 21634.29 17357.68 15022.53 16234.12 15317.07 2736297.04 3000966.83 2902216.64 3155920.17 3422476.98 3192434.79 3876899.20 3026115.58 2484314.12 2431812.04 2565329.72 2517961.72 2054891.20
Methylpyrogallol sulfate 1_
43893.02 57863.01 157419.90 23764.15 22892.49 27789.14 19692.23 19990.21 17037.29 14083.56 10569.02 12761.38 13118.39 14864251.69 14615745.31 11693463.68 11324489.73 13801038.10 16931302.84 21977918.02 18356483.60 15322073.54 14781826.39 16444237.33 13106356.85 9944836.49
Methylpyrogallol sulfate 2
20694.75 49914.06 87534.16 13719.97 15100.63 22363.34 24371.37 24998.82 21634.29 17357.68 15022.53 16234.12 15317.07 2736297.04 3000966.83 2902216.64 3155920.17 3422476.98 3192434.79 3876899.20 3026115.58 2484314.12 2431812.04 2565329.72 2517961.72 2054891.20
Methylpyrogallol sulfate 2_
43893.02 57863.01 157419.90 23764.15 22892.49 27789.14 19692.23 19990.21 17037.29 14083.56 10569.02 12761.38 13118.39 14864251.69 14615745.31 11693463.68 11324489.73 13801038.10 16931302.84 21977918.02 18356483.60 15322073.54 14781826.39 16444237.33 13106356.85 9944836.49
Methylpyrogallol sulfate 3
20694.75 49914.06 87534.16 13719.97 15100.63 22363.34 24371.37 24998.82 21634.29 17357.68 15022.53 16234.12 15317.07 2736297.04 3000966.83 2902216.64 3155920.17 3422476.98 3192434.79 3876899.20 3026115.58 2484314.12 2431812.04 2565329.72 2517961.72 2054891.20
Methylpyrogallol sulfate 3_
43893.02 57863.01 157419.90 23764.15 22892.49 27789.14 19692.23 19990.21 17037.29 14083.56 10569.02 12761.38 13118.39 14864251.69 14615745.31 11693463.68 11324489.73 13801038.10 16931302.84 21977918.02 18356483.60 15322073.54 14781826.39 16444237.33 13106356.85 9944836.49
Methylsuccinic acid
296047.20 916906.08 505052.78 539718.35 588022.01 464534.30 546146.51 488790.39 438042.21 405730.22 340516.53 415069.85 534843.50 2308164.19 2417500.49 3280701.73 2537133.80 3558409.17 4333356.10 3099234.78 2533527.78 2470277.11 2117608.44 2275905.62 2396602.54 1996595.69
MEVALONATE
56045.92 62645.72 120880.74 76802.37 83292.89 79462.44 89079.92 47419.20 76338.91 35823.16 37974.88 41264.35 42026.48 3272874.74 2138676.28 3188840.22 3799430.37 3087619.08 4201782.58 3351913.46 3144955.05 2548003.81 2912030.24 2437436.21 2695563.66 2618744.13
Mevinolinic acid
10113.29 7429.81 9292.92 7807.69 8458.47 13223.24 13896.17 10753.95 10495.32 7420.82 7697.19 7368.88 6671.76 121302.23 127144.64 126481.04 111077.51 144473.94 136585.19 125803.57 127809.17 122944.22 125919.85 127456.46 149454.29 117849.46
Microginin T2
11669.97 10357.81 14269.97 9604.56 13799.05 21888.79 21906.95 13274.90 17473.36 9268.50 11474.40 10879.13 8573.59 181103.46 116295.56 169657.16 162556.65 165882.35 172400.22 136325.85 251855.04 169291.04 159985.35 148859.31 166214.52 145906.09
MM 22382
15617.93 43140.29 11488.46 12796.04 14170.34 15571.97 15515.47 16003.11 15737.93 10439.59 11380.87 12595.18 12296.44 3937074.96 6179822.42 8689888.06 6188413.92 7135585.41 9380964.68 5979963.31 8947881.43 7422606.72 8102944.48 3952550.88 4101477.67 6600723.05
Monamidocin
10480.82 8769.91 8486.00 8327.36 9524.72 11834.00 12316.39 12176.70 11323.37 8254.51 8432.90 8712.04 8092.94 713296.51 586014.58 824146.72 666659.78 1120579.53 895990.56 847413.40 665378.64 794761.93 1009439.96 695938.92 733515.34 734659.00
Monascusone A
9099.21 7445.38 8132.16 7141.12 8133.42 11619.35 11516.21 10022.50 9358.02 7016.30 6739.32 7114.47 6502.87 614673.27 477705.99 554382.23 536738.71 759460.22 706998.36 500379.11 512749.24 579157.47 713287.50 567498.37 634087.77 538665.46
Mono-(2-ethyl-5-carboxypentyl) phthalate
107795.13 158998.78 264312.86 106122.21 208070.33 368000.81 279872.00 188778.02 363415.50 125626.31 229792.92 212993.29 117924.84 988921.41 787427.24 1052480.37 903717.68 903987.53 965187.21 711803.91 899085.67 935646.82 973073.40 739162.08 1007596.49 705069.12
Mono-(2-ethyl-5-hydroxyhexyl) phthalate
9658.27 7802.62 8671.19 7706.53 8558.87 13013.79 12380.37 10821.31 10126.09 7242.26 7129.15 7184.19 6617.82 268205.16 359934.47 368188.14 338958.21 443097.45 417027.92 330196.89 414440.04 316043.80 448396.34 368314.99 434109.39 320143.08
Mono-benzyl phthalate
10603.55 10531.02 10504.81 8220.47 9937.42 22276.92 16227.97 11914.72 14188.70 8328.11 10286.28 10034.70 7344.40 318072.04 537334.74 473211.17 463359.20 692397.81 381018.77 495661.64 396029.95 478894.05 736228.48 515059.76 407036.26 384446.47
Monoethyl phthalate
15143.71 53695.62 84471.58 42982.51 70496.88 83905.24 128308.32 12882.02 35129.97 24242.57 294114.65 20465.84 25113.61 345202.52 335433.58 423435.23 420854.88 507506.68 589662.06 347096.05 354508.53 301438.25 403491.23 407328.37 337013.64 351946.05
Mycinamicin XVIII
8948.67 7232.40 7636.00 6981.42 7975.39 11203.05 11007.31 10023.74 9034.95 6693.83 6647.41 7090.13 6158.91 1001849.73 872940.03 945089.94 913869.10 1009950.53 1042769.79 1390234.75 903699.97 1319636.76 1149201.72 1235597.63 1102579.73 982987.04
N1-Methyl-2-pyridone-5-carboxamide
18776.08 59828.39 68479.94 49929.44 77208.85 18518.87 25716.58 18961.20 25832.92 29984.88 28741.02 16388.60 37205.72 904232.29 1423864.60 1454003.39 1130543.49 1520674.31 1439113.49 1586397.43 1119733.31 1388914.50 1177866.49 1264871.77 1303040.28 999700.33
N-(2,3-Dihydroxybenzoyl)-L-serine
26301.57 20087.33 37255.25 16502.79 11310.68 24897.25 23452.70 25316.93 24872.78 14583.99 18087.09 20192.93 17188.50 1320466.43 739402.23 613935.10 726017.15 611104.03 965096.06 1302486.92 703162.68 1099951.34 761885.20 718219.60 806656.70 791008.85
N2-Acetyl-L-aminoadipate
15241.91 10835.47 29516.49 18884.13 14226.24 17886.99 19845.81 18649.77 16988.06 12540.46 11768.22 11586.84 11009.75 399723.84 427156.51 772340.50 581826.19 834953.35 824722.87 514860.11 458989.90 442662.59 418166.16 334183.35 501480.51 405268.14
N-[2-Hydroxy-4-(sulfooxy)phenyl]acetamide
77457.63 51945.68 55453.81 48600.41 33309.75 75713.31 75147.61 74557.87 74228.54 49408.08 53266.14 62241.48 50619.81 4186307.46 2235241.12 2607625.78 6576330.35 3972233.07 6250267.17 5786584.70 6518403.36 7586482.71 6675419.32 3888111.85 2917204.06 5918248.31
N-(2-Hydroxyphenyl)acetamide glucuronide
21250.86 14251.54 16993.52 13333.75 9125.18 20521.99 20617.09 19759.11 19230.72 13555.33 14613.81 17076.24 13887.78 326823.74 272633.92 304090.84 352134.92 313442.65 392063.22 275105.91 308708.47 279456.53 299101.47 215721.82 299843.15 285200.21
N2,N2-Dimethylguanosine
10437.51 35061.30 68619.13 8611.55 10300.64 9835.38 10713.90 10850.38 10305.19 6993.53 7168.25 9572.84 8034.48 2016375.51 3053660.78 2911780.75 1780742.71 2888950.53 3209558.94 3253572.31 2382999.48 2808681.05 2240683.53 2172686.57 2889851.49 2099343.63
N-(3-{3-[(2,1,3-Benzoxadiazol-4-ylsulfonyl)amino]propoxy}phe...
10269.21 19661.49 66173.01 7728.47 9878.68 11160.93 11554.08 11372.30 10080.96 7631.61 7724.32 7887.24 7260.77 11761760.72 7515266.53 10207715.79 9186082.80 10668565.16 16163709.63 11578685.02 9248046.95 10209989.44 10647633.79 10771673.00 11019827.27 9567785.02
N-[(3alpha,7alpha,12alpha,20R)-3,7,12-Trihydroxy-24-oxochola...
10072.87 7779.78 8178.42 7517.94 8710.42 12613.31 11784.16 10572.70 9893.82 7357.26 7270.48 7419.25 6756.73 527396.66 503078.95 523402.41 468983.60 643696.53 662874.75 551211.42 545960.47 574985.65 537496.61 597623.40 667033.18 502355.71
N-[3-Carboxy-2-(carboxymethyl)-2-hydroxypropanoyl]glutamic a...
46325.13 69765.06 261864.24 47350.74 32363.07 35382.91 22627.53 24426.17 23997.64 14070.86 15978.76 34881.54 16583.74 4997902.73 4377595.40 5020765.39 4919313.68 5573159.02 7072579.74 4929294.91 5136816.30 4059177.09 4596657.12 2836608.85 4916113.07 4325022.66
N-(3-Oxohexanoyl)homoserine lactone
11532.42 9395.41 9736.97 8996.07 10240.59 13536.59 12143.83 12933.65 12541.73 8646.65 9550.76 9960.44 8847.41 219724.17 239967.44 285863.20 233141.45 272471.26 352045.41 250611.63 235503.50 211998.63 231919.17 199515.15 254716.32 211744.94
N-3-oxohexanoyl-L-homoserine lactone
9664.57 7409.44 8847.73 7688.27 8408.95 12978.22 12785.13 10649.07 10003.61 7155.77 6789.61 7171.18 6651.31 200023.62 188552.00 216793.71 195855.08 254936.16 265697.23 191740.80 200141.75 205515.59 272468.02 230910.08 249974.94 211830.17
N4-Acetylcytidine
10599.21 10090.08 14048.42 8888.49 9701.82 11383.89 12248.28 11595.35 10983.89 8207.13 7190.70 8102.07 8271.83 643906.92 930091.45 804704.09 636503.97 817241.47 992365.29 958939.46 716328.15 792330.72 693062.81 680622.92 819766.81 621970.10
N-[(4-Methoxy-1-benzofuran-5-yl)carbonyl]glycine
12309.89 7994.10 9137.27 9904.98 10832.76 12086.60 12322.43 12481.07 12297.93 8146.56 8958.41 9808.03 9691.93 293604.68 348193.91 385958.82 274289.01 367415.98 383717.68 520760.23 307127.45 456944.05 439660.12 295999.42 304145.62 228288.59
N6-threonylcarbamoyladenosine
10903.45 23926.18 70027.42 8921.55 9977.26 10441.83 10797.94 11497.35 10943.36 7475.35 8144.78 10111.52 8557.75 1506100.54 2229349.30 2381641.67 1287398.88 2153890.29 2493512.66 2306315.46 1683078.38 1949691.67 1637987.77 1553817.78 1894592.05 1567623.03
N-Acetyl-4-aminosalicylic acid
17038.94 44025.37 54138.24 169725.49 118780.25 36914.09 27049.88 28195.49 45039.82 48882.93 14498.96 37752.24 61733.36 599135.33 836086.39 1029961.37 941517.59 1172752.04 1314781.45 1279766.43 1003229.54 851370.41 1032056.40 1157669.57 822357.11 870573.22
N-Acetyl-5-aminosalicylic acid
38422.51 53397.43 73980.12 77054.53 67778.63 30012.54 18020.16 13340.02 21080.24 27301.25 9044.90 16785.70 36302.55 9427459.94 1889569.77 2240977.57 1655854.33 2638913.22 3238284.42 1835579.58 1925952.02 1540633.17 6615353.25 1321451.08 1823903.81 1491181.03
N-ACETYLALANINE
54669.93 68590.66 138700.80 67673.95 66954.99 44823.16 47008.57 33245.39 39324.85 32797.55 29726.29 39868.98 30442.81 1551749.55 1400367.28 1584859.91 1644833.77 1555326.66 1965286.27 1893046.25 1721519.59 1513559.58 1529531.04 1446111.91 1479914.95 1415648.58
N-Acetylaminooctanoic acid
9234.50 7655.04 13509.79 7377.08 9885.41 10256.68 10543.55 10377.43 9749.06 7178.11 7703.70 7664.83 6952.30 391478.75 447005.31 447341.73 424041.72 479071.29 581637.03 555414.99 501009.61 455354.43 448772.40 471157.02 499805.01 466819.67
N-ACETYLASPARAGINE
89611.77 76219.51 316881.94 64143.46 37657.19 65989.44 79343.56 64878.52 66172.02 47619.01 56871.58 50473.01 35816.65 3023022.42 2990074.36 3230004.34 3613835.83 3663143.50 3683222.52 4054614.56 3740290.60 3118657.38 3338431.29 2998534.69 3247249.04 3015517.95
N-ACETYLASPARTATE
92803.59 92595.70 690302.02 95718.72 60364.73 134558.11 29421.47 20288.09 66123.47 50587.08 119847.49 38823.32 12297.01 4632624.19 4362741.79 4683191.29 4667862.79 5270237.32 6161228.30 5277623.52 5960168.69 4548943.44 4643229.18 4303026.84 4392800.92 4315769.06
N-Acetyl-D-allo-isoleucine
22772.53 13465.18 50396.65 15220.50 32083.97 12116.01 17591.94 13511.54 13089.96 8885.60 12395.22 12677.76 10660.14 696985.10 924324.25 907507.34 757250.76 827182.69 1105482.82 1078231.97 802489.16 778397.42 632969.84 699023.38 826020.96 692843.19
N-Acetyl-D-allo-isoleucine_
11404.33 8607.23 11881.90 20153.80 11186.24 10744.23 11368.57 11166.46 10956.57 7585.94 8117.20 8435.21 7693.95 407377.92 316676.53 430512.23 374051.26 386481.61 487745.94 418414.01 358197.31 343016.49 398409.19 319380.88 354281.84 318684.41
N-Acetyl-D-galactosamine 4-sulfate
157866.27 233312.62 480595.45 119034.36 55842.71 134779.83 132444.51 127568.07 115997.75 83078.48 90835.89 95458.61 83388.62 3053173.23 2453723.10 2099241.01 2138365.81 2124339.95 2539500.85 4196954.63 2514313.90 3366251.71 2442329.73 2800738.03 2439080.17 2404969.91
N-acetyl-DL-cysteine
59864.21 19965.53 71269.56 21571.29 13140.39 26654.39 24246.20 24055.92 23633.90 15826.97 17186.20 20082.07 16332.37 659696.83 492853.04 524204.28 584383.83 499695.36 663300.83 682575.41 563407.34 519215.93 563631.71 510870.05 542691.81 540159.48
N-acetyldopamine
11532.42 9395.41 9736.97 8996.07 10240.59 13536.59 12143.83 12933.65 12541.73 8646.65 9550.76 9960.44 8847.41 219724.17 239967.44 285863.20 233141.45 272471.26 352045.41 250611.63 235503.50 211998.63 231919.17 199515.15 254716.32 211744.94
N-Acetylglutamine
51325.75 49223.80 277149.47 47593.57 37156.76 31290.41 35905.28 26053.70 28419.81 19980.91 32500.37 26724.90 15588.80 1994499.47 2176251.78 2427835.08 2347176.24 2609425.44 2719586.65 2446562.49 2519251.13 2037325.28 2340092.58 2076845.49 2207252.15 2058248.94
N-ACETYLLEUCINE
11921.78 13014.21 28137.42 14852.96 16418.20 12498.21 11503.35 12415.55 11991.75 8355.80 9457.03 9558.29 8318.98 647322.44 592247.60 793761.74 725272.83 778281.94 981385.06 865539.67 685801.78 667221.12 719640.04 641869.27 679598.10 632722.47
N-ACETYLNEURAMINATE
145864.60 220114.20 525771.54 106160.47 65944.91 158775.54 156024.44 152073.30 136649.57 97869.47 107007.98 149857.83 99489.80 3191996.55 3514585.85 3436413.06 3192930.89 3420033.84 3918301.77 3444592.79 3712117.01 3140581.40 3252504.45 2433618.93 3406171.09 3310075.71
N-ACETYLPHENYLALANINE
13907.77 11307.52 33350.50 12954.90 21752.71 15403.55 15526.22 15478.25 14933.22 10799.66 11614.76 11700.13 10694.72 1085517.78 1127493.84 1436978.52 1340019.41 1513435.37 1817844.90 1271029.23 1343437.72 1075931.75 1424432.80 1052135.10 1218957.23 1144089.52
N-Acetyl-S-allylcysteine
10917.22 7421.16 8012.58 7915.76 8639.66 11291.04 10397.58 11094.35 10783.24 7395.67 8286.66 8327.94 7752.22 144905.32 296022.78 290633.84 232925.12 318435.77 371283.01 524041.13 316008.58 196767.82 252502.69 190394.41 245560.21 166251.03
N-Acetyltaurine
128653.22 80221.65 299269.68 55906.86 40681.49 56680.79 61429.77 52714.02 56837.62 39654.58 48849.12 43353.15 29336.58 1491845.52 1228159.59 1125544.48 1155516.93 1153732.44 1346000.96 2238663.42 1451107.49 1672060.46 1388326.83 1182097.50 1355918.21 1255196.46
N-ACETYLTRYPTOPHAN
21119.64 19335.50 49970.75 41973.39 88777.15 13384.65 12058.61 11986.64 12521.79 12686.96 8855.70 15060.27 12974.96 1876083.38 1747273.05 2074286.55 1687915.75 2126898.25 2338430.72 2118540.63 2174877.98 1823477.50 2072993.16 1849830.21 2198188.16 1977509.29
N-Acetylvanilalanine
10306.02 7579.86 15298.19 8623.35 9405.68 9892.13 10170.64 10838.69 10674.84 7085.44 7603.33 8535.89 8239.05 718235.61 1075014.76 1226604.12 811175.67 1004879.58 1244458.18 1368555.07 897370.60 866330.64 810709.76 867535.55 927684.03 824636.87
NADH
9050.98 7252.74 7536.15 6928.64 7830.23 11624.61 11125.44 9743.96 9076.30 6845.33 6704.82 6990.17 6227.11 148619.84 92295.17 151316.63 175841.42 210985.40 179064.49 88631.39 92623.53 111945.25 128510.43 171928.18 205698.67 211601.32
N-alpha-Acetylarginine
16118.63 12936.07 15165.37 11596.89 9533.77 15224.81 19636.24 14540.56 16306.13 13732.82 21122.26 13421.72 8755.45 332639.06 779737.53 581827.25 426696.31 692123.56 784326.40 878404.16 684598.14 518518.50 666139.80 447425.04 656674.03 514636.61
N-ALPHA-ACETYLLYSINE
14821.39 15608.35 74032.05 10836.55 8396.04 16103.77 17839.21 12124.58 12626.46 9744.69 17513.27 9803.17 7162.88 1718160.73 1617534.00 1681767.17 1614803.75 1826674.84 1921466.16 1945852.99 1716959.68 1605347.69 1663684.68 1481478.68 1734690.28 1551914.08
Naproxen O-glucuronide
128579.53 196279.91 614588.61 107773.96 85627.48 61838.22 16830.55 15416.45 14312.80 10605.08 10571.98 10701.01 9876.54 22701325.13 24299269.47 26479212.63 29183341.04 28987297.14 30236009.54 26546455.66 29362772.01 24459613.96 26642768.26 25229540.03 27911010.67 39358607.47
Naringenin
10102.01 9480.31 9676.39 7947.55 9892.08 16619.94 14783.73 11018.48 11532.34 7787.35 9085.87 9126.82 6875.71 397927.88 443432.72 554142.53 536310.71 969116.61 412570.89 719592.73 867760.36 654281.33 990854.37 1061436.07 630183.25 465341.40
Naringenin 4^-O-glucuronide
9932.55 8016.93 8296.36 7667.71 8655.53 10681.96 11129.31 10774.11 10320.51 7579.61 8082.38 8243.50 7467.52 519044.28 475916.37 552688.56 526711.03 820074.78 540651.24 521852.79 567208.42 452373.25 635599.78 667519.42 633816.10 586971.81
Naringenin 4^-O-glucuronide_
11034.22 9250.13 9207.14 8931.71 10018.63 12376.95 12723.13 12610.27 12055.06 8661.98 9296.22 9249.32 8503.29 536012.83 526425.16 698033.85 556934.38 853133.06 574855.07 614055.15 561380.95 521446.25 706865.43 771401.55 616596.68 599979.50
Naringenin 5-O-glucuronide
9932.55 8016.93 8296.36 7667.71 8655.53 10681.96 11129.31 10774.11 10320.51 7579.61 8082.38 8243.50 7467.52 519044.28 475916.37 552688.56 526711.03 820074.78 540651.24 521852.79 567208.42 452373.25 635599.78 667519.42 633816.10 586971.81
Naringenin 5-O-glucuronide_
11034.22 9250.13 9207.14 8931.71 10018.63 12376.95 12723.13 12610.27 12055.06 8661.98 9296.22 9249.32 8503.29 536012.83 526425.16 698033.85 556934.38 853133.06 574855.07 614055.15 561380.95 521446.25 706865.43 771401.55 616596.68 599979.50
Naringenin 7-O-glucuronide
9932.55 8016.93 8296.36 7667.71 8655.53 10681.96 11129.31 10774.11 10320.51 7579.61 8082.38 8243.50 7467.52 519044.28 475916.37 552688.56 526711.03 820074.78 540651.24 521852.79 567208.42 452373.25 635599.78 667519.42 633816.10 586971.81
Naringenin 7-O-glucuronide_
11034.22 9250.13 9207.14 8931.71 10018.63 12376.95 12723.13 12610.27 12055.06 8661.98 9296.22 9249.32 8503.29 536012.83 526425.16 698033.85 556934.38 853133.06 574855.07 614055.15 561380.95 521446.25 706865.43 771401.55 616596.68 599979.50
N-Benzoyl-D-arginine
9353.42 7798.60 10692.39 7267.75 8143.87 10317.60 10618.53 10339.95 9448.61 7358.57 7109.48 7369.21 6738.11 1231619.15 999795.18 1384036.83 1322694.61 1233224.45 1543551.03 1536892.82 1220992.97 1204050.39 1246315.14 1218134.56 1211319.00 1060397.95
N-Butyryl-DL-homoserine lactone
10116.44 28820.25 36810.88 8036.47 65312.99 13472.10 11145.87 11221.74 202309.38 17617.92 8761.14 9526.23 7817.21 1279743.11 1356825.75 1496691.36 1278177.56 1692134.35 1613151.79 1616338.74 1457933.07 1707952.78 1530202.13 1142363.06 1425493.61 1271104.03
N-carbamoyl-2-hydroxy-3-methoxybenzamide
23480.90 15747.08 23288.05 14732.98 10082.76 22675.55 22780.64 22601.86 22502.02 14977.82 16147.37 18868.20 15345.15 280411.27 281897.97 290185.88 282005.71 279973.39 328653.69 283557.34 301838.39 236855.81 258837.74 239555.59 272446.07 255944.63
N-demethyl-7-O-demethylcelesticetin
9756.27 7885.90 8205.06 8047.27 9033.85 11576.11 12432.35 10939.00 10914.57 7444.24 11391.81 8589.79 7730.68 125103.64 217346.09 420702.41 263957.03 289649.19 325322.59 157477.25 217178.42 186052.26 293130.02 167465.88 241716.51 230160.37
N-Deschlorobenzoyl indomethacin
9333.13 8039.39 13802.90 7307.19 8409.77 11436.59 11266.19 10331.82 9802.43 7191.88 7279.12 7563.77 6784.32 715980.94 839334.04 961487.64 892188.54 1157828.99 1040658.03 851871.23 703243.53 768045.02 1114077.12 904084.30 1161929.14 828853.56
Neo-debromoaplysiatoxin A
10938.09 10502.40 12595.72 9108.45 10700.72 15843.67 18976.64 14218.59 13996.71 11565.21 8431.41 8395.49 7474.02 92547.47 89799.78 84795.37 85773.11 94349.90 101162.93 78117.22 96393.47 109001.09 87640.11 101702.85 90164.46 94219.25
Neomangicol B
23964.07 20495.68 20983.40 19223.67 22065.22 31686.26 30204.16 27740.26 25342.42 18882.74 18831.44 35846.08 17640.56 1538569.29 1300576.48 1010810.91 873634.26 3055715.26 998810.72 1846014.99 1160049.06 870195.54 1718616.27 1891948.56 1412884.94 854481.65
Neomenthol-glucuronide
616206.48 385695.03 2454055.71 465837.13 344657.59 258469.38 184297.90 118353.07 288067.99 103817.48 204004.10 261732.00 100623.88 99447080.26 104381648.14 102318277.43 96111870.34 107423779.03 124518926.07 104129546.78 102785648.42 128796097.85 132892874.42 106338111.21 109759492.78 108170707.31
Neorustmicin B
14092.03 10405.79 13846.09 10682.02 12305.22 17746.86 21492.99 20379.95 17868.76 18066.55 9620.96 9601.80 8793.00 834538.38 929749.34 966668.88 825937.90 1123508.27 1084173.06 1046299.70 822586.61 1007049.20 1037129.57 1148386.24 1135889.84 965469.56
Netropsin
17158.31 12993.58 21659.54 12878.06 13901.20 21106.43 20901.52 18625.94 17488.98 12548.38 12393.81 12474.86 11283.50 1143057.06 1102782.19 1163362.06 1000236.34 1300348.04 1487090.04 1152929.19 982376.82 1094064.04 1256422.23 1177805.67 1283717.92 1121788.40
N-Feruloylglycine
15020.63 58419.12 102691.34 15495.11 14815.16 17794.35 14431.92 15264.35 14836.29 10175.46 11401.33 11456.20 10582.22 5040860.67 6977135.23 8246901.68 6082071.73 7521067.64 7592049.93 7195173.23 5619527.21 5807272.98 6454690.81 5831605.34 5696282.36 6329927.88
N-Formylphenylalanine
12613.83 17709.97 29254.23 11333.44 28150.39 12539.46 12119.45 12818.49 12459.02 8545.01 11320.60 10310.05 8886.59 826266.15 2828581.39 1165655.43 825690.09 2428877.46 1398649.25 2709194.17 963384.67 885180.78 982861.39 1065433.23 914059.60 857090.55
n-heptanoic acid
9703.65 8123.58 7888.69 7854.67 8801.20 10884.47 11188.90 11012.61 10345.78 7617.47 8175.23 8133.98 7377.83 144342.38 113854.76 143193.44 139109.22 167248.37 175732.71 148020.47 125026.78 120096.13 148656.34 117327.93 134881.03 119367.20
Nicotianamine
27571.51 17926.90 19898.93 22604.17 24737.99 26017.54 28820.22 28837.60 27459.32 18735.90 19332.04 21566.99 21487.90 583079.02 827652.58 902696.20 623430.09 786759.56 1087213.26 789317.50 630246.92 611991.94 580711.46 499572.86 776358.81 558031.86
Nicotinuric acid
87742.37 132331.66 380938.64 136219.62 173118.57 71993.92 33528.84 37379.32 39814.06 111264.07 69261.84 179486.11 33710.92 6855302.62 10164940.96 9660964.33 8564320.72 8967223.99 11363065.90 8575556.58 11098187.64 9098810.93 9365100.56 8154974.60 9366521.76 9102787.59
Nigrospin A
9120.16 7968.71 7282.90 7431.10 8497.26 10736.24 10967.72 10909.67 10056.12 7511.77 7645.21 7644.46 7081.55 311551.64 303370.13 351156.77 349072.18 353336.77 467855.55 320897.10 345510.93 335303.59 356701.99 278460.63 404095.67 340833.12
Nikkomycin WX
27782.71 27261.78 55883.44 22277.57 28471.53 52160.27 44690.89 31401.98 33811.55 21602.43 28257.38 27503.79 20473.91 4002568.24 4090405.31 4400065.80 3746316.63 4245778.99 4918410.29 4015212.96 3899037.01 3942865.62 4361505.04 4064539.94 4462479.47 3821155.26
Nikkomycin WZ
27782.71 27261.78 55883.44 22277.57 28471.53 52160.27 44690.89 31401.98 33811.55 21602.43 28257.38 27503.79 20473.91 4002568.24 4090405.31 4400065.80 3746316.63 4245778.99 4918410.29 4015212.96 3899037.01 3942865.62 4361505.04 4064539.94 4462479.47 3821155.26
N-Isovalerylglycine
65693.27 142567.53 134012.79 138316.33 168412.93 83988.95 164438.18 71187.25 82497.20 68928.17 108209.57 101045.95 142883.72 1180212.45 1360999.53 1277533.96 1202324.65 1341389.43 1759168.51 1583417.70 1154316.63 1163723.86 1054419.75 1158473.31 1224967.37 1049860.22
nitecapone
9148.81 7441.95 7601.96 7257.16 8167.45 9922.41 10552.80 10261.97 9602.62 7199.70 7559.52 7481.40 7174.30 161157.11 142559.19 184711.53 133902.77 117014.57 149540.07 307249.35 212785.42 237772.45 166395.37 137369.18 112726.15 122577.08
Nitrazepam
11681.21 9046.19 9873.01 8120.28 9083.16 16754.44 14675.88 12570.92 12329.70 8238.43 8818.82 9334.12 7289.43 76157.46 93965.17 114519.04 106488.18 101501.47 69287.28 100870.01 99433.26 143808.07 132009.24 97743.61 96340.50 102166.75
N-Malonylanthranilate
10648.06 17875.40 56518.21 13841.78 11550.77 12613.01 10366.50 10649.26 10609.85 7307.01 8128.02 8959.75 8003.61 1227503.94 1615822.38 1637193.87 1530894.46 1785915.04 2008075.41 1524963.64 1358632.47 1266359.68 1221626.48 1152956.62 2202468.91 1074381.37
N-METHYLASPARTATE
136849.22 107677.44 359248.57 102122.04 63282.23 152735.58 150089.14 138890.38 128765.34 181763.42 102937.30 103361.37 85567.04 3003857.31 2808065.17 2797678.92 3204975.33 3287553.70 3438569.35 3954074.23 3683458.08 3321925.37 3093019.40 2949584.73 2920569.36 2926204.21
N-METHYLGLUTAMATE
128177.31 64903.17 59124.32 96977.25 62043.29 105782.17 96045.51 80719.81 79298.50 98260.02 70388.06 69187.88 48929.89 862954.44 630643.66 621669.46 661128.15 724792.82 969615.73 965234.12 876690.08 696686.31 711406.68 526245.40 745268.35 661410.76
N-Methylnicotinamide
12394.43 8051.84 11728.44 10074.33 10973.19 11666.83 12600.48 12952.36 12170.83 8404.44 8454.53 9629.30 9630.55 344302.23 503213.52 485693.09 363176.07 460251.21 485698.31 587060.03 352250.53 485313.82 378075.79 388661.89 462260.11 366829.09
NNAL-N-glucuronide
26475.78 30975.30 32866.01 21360.24 23678.59 30352.01 30661.88 30600.60 27713.73 21027.86 20876.72 21596.31 19745.26 2727704.26 2423778.52 2864488.24 2629203.17 3263972.80 3509366.46 2531778.33 2462762.84 2555609.39 2699861.78 2446490.12 2859593.58 2538838.44
NNAL-N-glucuronide_
16044.97 14712.36 16078.35 13301.72 14949.12 19074.76 19295.36 19193.24 17691.59 13215.36 13450.13 13729.14 12811.64 985992.76 938453.29 1098524.91 1024437.77 1121610.56 1305083.36 954900.69 1010157.58 1012217.13 1003203.18 944863.40 1102038.56 999245.21
Nocardicin C
12582.74 33570.02 88397.87 11218.70 15010.69 10879.61 11196.94 11078.40 9837.19 7759.39 7471.77 14018.03 7105.14 7146258.14 5620597.64 6888772.20 6085594.40 6957033.63 8422833.50 6468704.76 6086279.16 5848839.34 6654625.55 5523037.75 6652675.05 6394911.83
Nocardicin C_
10661.43 34359.72 23294.83 8737.64 15472.80 12935.79 13100.70 12383.46 11751.45 8541.05 8659.77 14533.98 7930.25 2519983.70 2410022.97 2867261.29 2402348.60 2861712.34 3456738.92 2394720.17 2278234.36 2408045.08 2528023.59 2418577.03 2719908.96 2470588.47
Nonactic acid
43807.87 89944.54 94546.64 82525.91 161081.51 51057.75 91889.70 90396.69 82303.28 90424.26 76686.20 77449.59 86925.42 1012932.94 975956.73 1346098.40 1359226.77 1516256.34 1579634.18 1263350.79 1190636.23 1068233.77 1203989.09 1001308.06 1146914.54 1022277.45
Nonane-4,6-dione
12667.90 12465.37 11884.21 10123.10 13502.33 18661.60 18915.14 14344.49 14609.65 10257.22 12141.67 12019.40 9451.47 804588.13 846051.26 938529.89 795261.22 989264.74 999446.72 1031846.47 792011.37 971856.96 933347.50 874756.84 943129.34 799805.73
NORLEUCINE
19353.42 27230.15 45302.97 13148.92 28727.92 29631.97 24087.95 22266.46 30979.36 29669.49 15721.86 33269.77 18061.85 1140371.61 1081304.31 1284963.73 945905.35 1325056.10 2003713.43 1916767.23 1094796.67 1382135.64 1148255.63 1049124.03 1094464.47 885183.62
Noviflumuron
8634.35 6702.24 7039.66 7155.40 7918.01 9326.16 9781.12 9823.29 9401.91 6558.03 7569.84 7566.88 6873.90 414146.13 548685.39 367726.11 435277.90 467883.59 403738.79 699979.83 568106.58 681931.50 395663.78 670848.71 635660.38 314582.20
NP-021038
20309.93 51757.42 167761.78 23293.79 26599.56 17085.92 16252.69 15080.18 13955.02 10191.90 10739.37 11082.21 9756.25 6076449.64 3188431.09 4406548.10 5387884.33 4990963.77 8337663.97 5531795.03 4661609.68 4067122.21 4486281.88 5968419.21 5469153.05 4692825.35
NP25301
11949.84 24377.07 10154.62 8784.69 9882.44 11632.34 12392.82 12346.63 11892.45 8193.98 8783.52 10032.32 8477.52 417040.59 635559.00 703118.97 669337.91 730989.89 749848.16 633125.23 665525.53 583563.51 645487.18 531913.91 701298.90 619139.00
N-Phenylacetylglutamic acid
103454.44 16178.51 485818.78 88155.81 76718.20 11281.14 10778.53 11320.73 10743.15 7676.76 8184.18 8841.00 8257.71 18611352.48 16663619.91 19358782.79 14545551.06 14873380.26 30512522.69 15246595.52 12511005.76 12135181.89 12632300.10 9727743.07 12442893.16 12815827.99
NW-G03
12603.49 9704.50 12212.36 8561.76 10914.19 21321.48 20632.45 13608.58 14185.91 11962.55 8943.07 9380.48 7404.99 71043.75 78050.12 65470.16 67690.06 83884.12 80448.68 54767.39 88518.90 81521.77 61813.31 73076.70 78960.93 72770.69
o-Cresol
84609.88 114388.28 295577.62 106382.77 111627.43 61548.84 28610.61 22433.05 34482.49 19798.13 25414.00 55815.21 34927.12 14112772.48 14329407.43 12451595.35 11792678.53 12468086.53 14798498.64 19184684.65 13219362.04 17315216.75 15382281.42 17149948.22 13760748.49 12238846.38
Octanoylglucuronide
11018.23 34769.50 9978.43 8337.20 10261.06 35526.45 16255.69 11952.35 12669.51 8196.13 9936.13 9560.40 7611.15 2766459.43 3773749.70 4942060.08 4202805.68 5051214.90 3248762.01 4790339.28 4241439.27 4004220.02 5356200.38 4379161.94 5004457.83 4300403.82
octenedioic acid
645072.78 219526.09 133764.32 132621.67 126157.55 314080.25 185174.38 167868.01 890864.96 179218.38 111310.44 225015.00 130942.38 2988377.60 2532135.24 3737490.05 3144444.91 3960735.04 4662900.13 2816260.17 3163799.76 2598624.55 3270271.24 2353069.54 2832360.29 2804789.47
Oleoyl-L-alpha-lysophosphatidic acid
68058.58 51262.00 60635.28 18514.60 30267.65 115957.25 127363.56 109370.16 116877.97 111444.05 102581.07 62848.31 70150.85 648806.91 1027546.74 1067135.33 1001451.22 786282.21 714743.28 997842.18 842975.15 1031320.25 1023733.34 1059093.42 718159.86 997628.53
O-methoxycatechol-O-sulphate
123164.18 120219.86 302511.75 74183.07 43128.80 32986.38 14483.16 13881.73 14031.66 9793.04 17149.86 17630.75 10732.52 24978045.52 27515506.49 25677562.92 22420383.47 27080636.86 36488197.77 33863692.62 32582442.85 28466790.06 28628212.48 32717699.55 24858002.42 21092342.53
Opantimycin A
11183.02 8728.18 10050.51 9051.42 9972.79 14395.06 15215.84 12310.93 12128.47 8484.40 8091.28 8398.40 7748.50 131081.86 151059.00 177857.21 170520.97 183944.64 121834.16 100452.55 150011.89 172419.51 213572.19 167409.84 191775.12 203253.30
OPHTHALMATE
23014.53 15434.32 16476.67 14440.36 9882.50 22225.17 22328.17 21398.98 20826.74 14680.33 15826.66 18493.45 14769.85 472613.78 437327.13 468708.62 478312.18 384509.62 599699.45 530518.98 416195.35 373466.88 424609.44 275821.08 471296.45 359686.68
O-Propanoylcarnitine
9795.00 8502.89 9359.03 7947.78 8875.69 11010.83 11305.68 11378.08 10693.42 7947.09 8071.52 8214.98 7205.64 584936.50 552656.38 826159.68 669818.34 918513.30 927655.36 707105.01 767927.74 684094.62 796918.12 534115.37 710910.63 649998.39
Ormetoprim
11086.86 9308.70 9012.40 8579.83 9674.13 11992.98 12489.75 12000.90 12204.69 8746.76 9233.20 9218.71 8154.92 316071.28 217468.32 293871.38 314636.29 419006.13 424030.71 251495.38 235503.14 242045.72 321039.85 218203.37 266830.17 299889.64
Orsellide A
10828.69 29756.85 26691.00 8548.70 9657.53 11763.01 12378.27 12254.81 11463.04 8529.43 8986.12 9224.20 8557.05 2149286.00 2211560.34 2754142.33 2543261.41 2780886.60 3078493.56 2187835.74 2254732.60 1998585.72 2799802.43 1982191.95 2358783.28 2267822.05
O-SUCCINYL-HOMOSERINE
52728.08 26578.66 76052.37 23643.00 18022.77 33178.58 23257.69 23075.17 22973.24 27959.51 16485.52 19263.33 15666.50 623557.68 569124.24 662375.34 651248.06 678027.13 843429.91 670778.25 660730.60 495779.25 583684.09 505179.87 590221.45 586744.75
O-thaxtomin A
9886.56 8509.78 8043.73 7867.13 8873.78 11254.56 11641.43 11402.27 10354.43 7992.97 7678.45 8180.30 7379.72 217028.66 199255.78 237010.35 206064.60 236501.50 258528.22 206662.12 183168.34 190216.44 222112.39 202905.12 219534.12 207595.56
Oxalacetic acid
33858.16 30360.77 139861.87 25901.93 24693.40 36996.43 48409.47 34042.75 37585.92 28039.85 43123.42 26877.55 19457.48 2141552.21 1352034.82 1773053.77 1660463.21 1766697.91 2259755.74 2451254.80 1710588.86 1750764.39 1728859.39 1240785.37 1645765.84 1611712.95
Oxaloglutarate
107857.29 68768.65 316294.42 78498.70 59747.24 117404.09 115369.83 112448.21 101043.38 72368.05 79125.37 83152.14 73566.17 482474.45 508609.13 525513.47 507132.13 532834.14 521774.36 533705.06 508269.96 432229.96 492397.72 512153.66 522596.89 471271.55
Oxirapentyn H
32294.56 21592.75 30137.27 21505.97 22059.66 39244.46 48733.07 33735.32 35218.96 21328.23 21996.19 21926.99 17682.80 1845981.48 2043664.03 2208432.52 1907459.81 2544309.68 2382897.92 1929981.73 1939251.16 1970851.72 2373721.41 2206451.63 2476924.56 2024497.24
Oxirapentyn I
32294.56 21592.75 30137.27 21505.97 22059.66 39244.46 48733.07 33735.32 35218.96 21328.23 21996.19 21926.99 17682.80 1845981.48 2043664.03 2208432.52 1907459.81 2544309.68 2382897.92 1929981.73 1939251.16 1970851.72 2373721.41 2206451.63 2476924.56 2024497.24
OXOGLUTARATE
46196.12 117542.55 137780.91 42955.30 32172.20 94603.83 64443.03 47331.14 45731.57 38609.29 43855.66 38838.36 28808.91 4569285.57 5208779.10 6060526.94 5784867.04 5612186.85 7978677.60 5152158.36 7859180.54 5069484.92 5517846.03 3476669.76 5419577.11 5603590.67
OXOPROLINE
1329643.31 334152.83 838101.08 351846.04 553563.80 718321.34 469541.71 156336.49 633905.74 681630.93 646201.91 781450.17 150383.30 12915855.27 11610025.48 13051954.86 11933943.77 13186825.03 15950869.79 14680064.00 13339964.33 11926877.80 11325565.04 11451646.00 11683447.32 11218005.51
Oxypurinol
92007.16 58108.99 121236.68 61093.85 35464.87 42418.54 16216.70 22718.96 36611.92 14618.16 14954.98 30081.17 15424.65 2102041.36 2263963.25 1856374.00 1850277.32 2019539.79 2046754.79 2918369.70 2069055.22 2615640.67 2176703.80 2283401.66 2181572.68 1921456.70
Pactamycin
11599.45 10069.31 9672.70 9411.93 10709.91 13039.26 13600.78 13474.17 12663.39 9454.10 9558.47 9728.36 8533.08 523462.83 429268.89 540885.05 464550.51 533708.48 680412.93 490909.70 456716.00 459952.16 451042.27 432086.10 466204.13 495397.13
paederoside
9768.99 8596.07 10386.40 7801.30 9060.56 11972.81 11713.27 11054.83 10044.67 7392.29 7987.05 8043.70 7139.98 3645791.87 5335732.58 2843981.58 3829110.32 3523517.40 2840006.69 2183080.75 2232001.03 3288896.86 3395628.43 5631740.12 6962308.67 4362870.15
PALGLY
11060.14 8750.23 10362.62 9016.68 10214.08 15011.67 14745.60 12647.50 11772.79 8479.74 8184.51 8685.83 7731.23 104018.55 154752.76 192948.79 165621.95 267238.09 190176.41 146731.92 187132.92 125565.57 169297.14 125498.90 174726.17 141772.29
PALMITOLEATE
68396.73 57365.98 100819.57 80960.24 263753.38 206831.17 697173.12 226989.25 320963.72 545335.77 268005.53 141149.32 257559.53 716361.39 784651.79 1298970.53 880744.86 776888.34 1265664.00 799381.56 831054.12 1125413.63 1377219.15 1014497.27 1335476.87 1312194.47
Panosialin A
34279.99 26798.14 28649.88 25818.02 91214.55 43312.42 41232.30 41280.12 34174.67 25283.16 25313.51 145579.15 23396.35 11809850.46 6139165.47 7022959.19 7023556.33 10242612.66 9167278.09 8342788.63 8283644.61 7324646.23 17049306.11 9527371.47 9630523.48 6455627.19
Panosialin A_
28139.71 25925.23 26461.46 21733.70 142651.12 47065.01 40428.19 103981.09 31536.81 21295.59 24866.58 117782.54 19253.64 14312150.51 9467516.78 11736070.12 12320307.77 14327800.27 16478497.45 11500769.75 14931189.95 11764579.53 13008421.21 14071182.19 14221629.03 11510900.43
Panosialin B
34279.99 26798.14 28649.88 25818.02 91214.55 43312.42 41232.30 41280.12 34174.67 25283.16 25313.51 145579.15 23396.35 11809850.46 6139165.47 7022959.19 7023556.33 10242612.66 9167278.09 8342788.63 8283644.61 7324646.23 17049306.11 9527371.47 9630523.48 6455627.19
Panosialin B_
28139.71 25925.23 26461.46 21733.70 142651.12 47065.01 40428.19 103981.09 31536.81 21295.59 24866.58 117782.54 19253.64 14312150.51 9467516.78 11736070.12 12320307.77 14327800.27 16478497.45 11500769.75 14931189.95 11764579.53 13008421.21 14071182.19 14221629.03 11510900.43
Panosialin D
34279.99 26798.14 28649.88 25818.02 91214.55 43312.42 41232.30 41280.12 34174.67 25283.16 25313.51 145579.15 23396.35 11809850.46 6139165.47 7022959.19 7023556.33 10242612.66 9167278.09 8342788.63 8283644.61 7324646.23 17049306.11 9527371.47 9630523.48 6455627.19
Panosialin D_
28139.71 25925.23 26461.46 21733.70 142651.12 47065.01 40428.19 103981.09 31536.81 21295.59 24866.58 117782.54 19253.64 14312150.51 9467516.78 11736070.12 12320307.77 14327800.27 16478497.45 11500769.75 14931189.95 11764579.53 13008421.21 14071182.19 14221629.03 11510900.43
Panosialin wA
11102.52 9713.48 12110.30 8690.62 11976.20 19034.15 19712.22 12606.83 14568.98 10591.37 9512.92 8825.26 7374.82 373367.82 330652.78 427047.28 398488.63 466855.73 506496.44 433628.73 659922.17 502865.80 491001.39 925740.32 501230.09 389711.37
Panosialin wA_
14084.50 13089.80 18847.74 11795.92 18562.60 28285.97 26372.92 16481.92 25731.00 11766.21 17527.31 15399.77 10344.12 103176.86 80203.92 106184.68 91397.25 127168.17 157776.28 93349.75 198175.92 255161.59 146404.43 272895.18 96206.60 91738.33
Panosialin wB
11102.52 9713.48 12110.30 8690.62 11976.20 19034.15 19712.22 12606.83 14568.98 10591.37 9512.92 8825.26 7374.82 373367.82 330652.78 427047.28 398488.63 466855.73 506496.44 433628.73 659922.17 502865.80 491001.39 925740.32 501230.09 389711.37
Panosialin wB_
14084.50 13089.80 18847.74 11795.92 18562.60 28285.97 26372.92 16481.92 25731.00 11766.21 17527.31 15399.77 10344.12 103176.86 80203.92 106184.68 91397.25 127168.17 157776.28 93349.75 198175.92 255161.59 146404.43 272895.18 96206.60 91738.33
Panosialin wD
11102.52 9713.48 12110.30 8690.62 11976.20 19034.15 19712.22 12606.83 14568.98 10591.37 9512.92 8825.26 7374.82 373367.82 330652.78 427047.28 398488.63 466855.73 506496.44 433628.73 659922.17 502865.80 491001.39 925740.32 501230.09 389711.37
Panosialin wD_
14084.50 13089.80 18847.74 11795.92 18562.60 28285.97 26372.92 16481.92 25731.00 11766.21 17527.31 15399.77 10344.12 103176.86 80203.92 106184.68 91397.25 127168.17 157776.28 93349.75 198175.92 255161.59 146404.43 272895.18 96206.60 91738.33
PANTOTHENATE
12763.43 14820.22 101071.77 10100.22 20448.81 12812.40 13924.20 13104.35 12502.45 9110.77 8146.66 9328.81 9478.71 3503148.40 5049056.37 5750806.02 3788728.01 5275457.67 6930880.31 5248236.60 4211349.12 4286669.96 3663864.25 3343924.18 4711538.67 3233049.90
Paracetamol sulfate
22227.97 1179299.87 168274.60 17063.49 17296.41 177131.78 25396.01 24571.11 22007.68 17480.54 15631.85 16149.14 15463.02 31310434.82 49253387.34 52504805.77 40116652.12 58087236.28 52390541.21 56224253.90 53286865.71 56054461.16 41659422.82 46822214.09 38164106.61 46321096.15
para-hydroxyatorvastatin
10061.84 8488.40 8745.74 8106.38 9205.51 13307.48 12614.41 11458.83 10490.39 7763.35 7940.98 8312.02 7317.59 199373.14 249548.62 209208.85 190511.88 222314.89 238651.17 195704.17 212952.02 210634.53 214722.72 210382.53 301780.02 212797.71
para-hydroxyatorvastatin_
10061.84 8488.40 8745.74 8106.38 9205.51 13307.48 12614.41 11458.83 10490.39 7763.35 7940.98 8312.02 7317.59 199373.14 249548.62 209208.85 190511.88 222314.89 238651.17 195704.17 212952.02 210634.53 214722.72 210382.53 301780.02 212797.71
Paraphaeosphaeride A
9344.79 7763.55 7607.21 7245.24 8286.09 11075.04 11041.13 10366.87 9672.19 6933.25 7246.59 7443.22 6662.56 615140.02 595678.76 752410.16 654873.22 729878.22 746579.01 956606.44 795873.62 944194.41 807235.52 780468.24 708774.97 621617.97
PARAXANTHINE
13454.59 17851.33 73133.54 18618.05 48235.42 13210.54 16955.92 29816.51 13441.52 13544.05 15878.72 22674.77 25536.30 2941732.87 3144163.70 3654750.04 3082789.85 3913517.85 2764750.17 3840362.12 3167324.74 3228845.26 2697841.21 3843124.82 3036862.37 2381633.34
p-Coumaric acid sulfate
13655.09 10127.20 14332.30 11173.02 12495.15 13310.96 13486.92 14261.07 13705.06 9361.85 10200.23 11514.26 10657.51 4034337.26 3892965.95 4674486.65 4125381.31 4351012.76 6274355.51 5972365.40 4567834.97 4186989.95 4736692.07 3898594.63 4404011.49 3898292.62
p-Cresol
11554.77 39351.10 55110.07 80012.86 80206.50 15293.20 39455.06 19780.89 30434.80 29766.33 11155.05 25319.72 49982.29 576229.60 456907.85 621036.36 565344.46 553190.56 750118.60 632592.14 587099.00 932124.12 560070.49 555669.59 426234.72 540188.96
p-Cresol glucuronide
119811.77 119126.81 539123.14 99801.86 79691.64 61840.55 11140.69 11485.51 11139.94 7715.63 8357.90 51508.07 8139.88 30297621.59 33249426.64 33949041.25 28855650.83 32225804.91 42321177.14 33928914.05 32697703.41 31726947.17 36896449.53 25502293.25 29624321.06 31707725.88
p-Cresol sulfate
3112039.05 3654844.49 11519355.98 2273870.11 1747798.27 1340389.78 21272.71 15999.50 75771.71 16034.28 92037.76 1327647.95 14197.01 513303812.64 609212854.44 574731951.51 520250755.87 601798182.71 673637471.23 700840405.46 606202609.64 627581160.10 635461600.00 636327854.45 575341061.70 495436470.76
pentahomomethionine
8754.60 8636.28 8926.69 7622.31 8592.86 11178.29 11788.65 10323.77 10853.35 7335.22 8031.92 7620.87 6593.11 244281.77 292640.38 386916.89 310410.66 462205.95 403722.69 299522.03 361400.38 267804.70 325572.44 251227.23 326185.92 272523.84
Pentahydroxyisoflavone
7842.42 6364.99 6368.18 6220.88 6939.59 8505.55 8800.13 8796.63 8180.68 6010.61 6480.07 6413.11 5987.10 137380.99 127970.42 232135.69 148339.11 143052.94 168865.44 215946.47 182053.94 166955.95 175208.27 110056.49 126040.65 166676.82
Pentonic acid
370132.14 906724.30 8147909.28 219387.41 9017391.73 8180561.32 5397136.12 308355.27 12710847.75 309054.47 9874878.29 7788224.86 342468.82 788706.82 10153358.87 20647994.22 604418.14 19130150.66 15500577.52 2772761.23 1517257.87 7867442.93 288993.65 15573106.83 9733757.96 598389.32
Perillic acid
14975.25 13251.52 20211.79 11958.90 13968.09 18652.91 18298.97 17062.05 15756.10 11355.16 12243.65 12389.97 11062.57 825957.17 927473.90 971171.76 979800.28 1060274.72 997873.76 1077942.92 901850.55 981608.08 841176.37 937826.73 901091.02 800500.46
Pestalachloride C
10082.94 8685.26 8672.48 7848.27 9085.40 12355.40 12171.30 11309.76 10626.75 7769.67 7961.76 8171.43 7329.36 1229327.53 1214517.11 1569987.90 1247134.46 1370256.81 1226731.96 2909028.08 8908926.39 1838590.68 1845512.13 1627141.77 1405046.36 1070463.37
Pestalone
15328.86 14122.54 14414.65 11795.62 14735.95 25638.25 22022.90 16331.01 17179.40 11600.59 13545.85 13595.96 10377.37 720086.25 675134.55 699447.64 621241.68 795023.92 721923.92 1288900.10 4660689.14 1016901.98 1050607.13 907899.71 747047.31 595944.29
Pestalotin 4′-O-methyl-beta-mannopyranoside
16927.18 13528.89 23592.30 13773.08 15090.41 22685.70 21878.62 18762.99 18252.90 12910.28 12432.99 12889.16 11633.54 2262965.94 1895896.57 2208994.93 2110410.04 2721825.21 3349189.95 1871081.44 1845175.46 1759905.40 2144611.73 2143549.93 2327905.69 2162142.47
Pestalotiopamide C
14635.97 14393.25 65311.61 11637.18 15031.95 27538.76 23595.20 16115.95 17542.41 11405.31 14918.89 14521.02 10809.49 3009759.33 1614744.27 2584717.53 2071827.03 2432428.18 4470147.44 1920939.81 1740723.33 1750021.86 1965279.61 1707101.73 2073161.59 1771006.60
Pestalotiopamide E
11087.51 9032.94 14728.08 8729.12 9653.65 12835.05 11393.17 12436.21 12057.88 8313.07 9294.42 9434.43 8506.08 413269.20 295955.15 493658.41 349615.13 414912.83 730029.53 368478.72 275040.33 274467.56 262113.68 232229.08 290772.72 275914.50
Petrosifungin A
11153.68 10068.45 14748.44 9089.00 10134.56 23476.21 17312.74 13243.38 12412.89 8818.12 9515.36 11208.78 7762.69 526862.58 409925.77 403775.91 419186.19 496340.10 651247.28 458959.61 566152.52 404610.58 413080.60 443715.54 532414.08 461353.21
Petrosifungin B
10830.39 8316.26 9283.16 8242.33 8878.90 13508.72 13194.21 11921.14 11148.24 8031.32 7932.40 7984.27 7221.77 137191.63 103624.96 100644.04 96446.19 131042.27 155272.47 123398.15 140575.96 137429.56 101188.29 109395.37 120684.84 144440.85
Phenol
38901.10 195123.75 78313.83 32275.58 72846.48 19345.50 44919.62 22614.93 52764.58 37605.20 39530.72 25355.60 58584.84 2546358.41 1975314.21 2209401.71 1925764.53 2084856.11 2563877.25 3210313.35 2355768.21 4130775.80 2621954.61 2771433.97 2006718.45 2206102.15
Phenol glucuronide
15614.73 16238.79 31452.31 12464.27 13838.96 15149.04 16659.89 15887.83 15421.24 10899.77 10315.67 11613.19 11927.05 936487.22 1626352.52 1560306.83 1062007.39 1547330.26 1760521.30 1366470.59 1367615.93 1263666.08 1244103.46 1107360.59 1307033.53 1117114.56
Phenol sulphate
625990.71 706950.80 2278786.11 460783.97 309784.09 226735.45 28524.24 29110.70 131588.56 20138.48 20185.50 58734.30 18217.84 91324099.32 89319553.85 84226446.39 84428320.48 96386423.44 113327015.86 115231365.87 113885464.55 112102768.74 104334870.73 113135586.27 81926129.48 77181611.06
Phenylacetaldehyde
9757.63 7892.00 8359.58 7703.91 8999.32 12408.87 10458.73 10757.37 10593.36 7284.89 8398.60 9132.03 7493.73 320505.61 280143.82 261710.26 252057.06 244964.71 344872.72 426843.36 249093.08 381071.57 332217.87 360501.91 270819.44 253899.63
Phenylacetic acid
149813.95 183712.66 154844.22 132298.25 163392.78 206262.58 212779.53 139239.62 162972.43 132357.17 236871.69 132203.14 125309.85 432241.01 528422.69 452124.18 440078.25 494829.32 499503.83 592017.00 445793.71 551243.56 497113.07 575739.50 454769.91 493177.49
Phenylacetyl 6-deoxy-alpha-L-talopyranoside
9374.43 7752.33 7751.54 7454.78 8299.58 11143.27 10962.87 10186.94 9699.66 7147.55 7283.54 7320.02 6769.02 576517.70 550281.30 623099.11 548849.17 688697.81 721076.60 594936.25 571966.24 592125.75 717752.75 605087.15 599695.83 576931.65
Phenylacetylglutamine
2064460.56 2523898.72 10192455.02 1807054.45 1365083.09 1119488.57 11893.79 12574.59 263920.38 8419.07 52279.21 634170.66 9359.19 503431937.09 527123205.47 513093515.60 489989422.83 495218549.74 617428282.47 575257895.93 536640141.39 480466668.40 557027888.11 448587290.63 499492521.33 499553428.07
Phenylacetylglycine
10349.94 35195.30 45972.75 8558.57 37272.43 11679.30 12707.68 10835.43 14089.44 8002.65 11434.93 8400.02 13029.10 3101288.18 3841043.34 3979182.52 4364294.94 4468718.83 6656868.17 5567598.26 3857060.67 3903363.17 3664500.61 3099603.65 3883277.79 4069931.75
PHENYLALANINE
31749.43 33673.87 55180.53 14845.22 16439.98 22569.07 25182.84 24915.91 21539.54 17224.05 16075.17 16261.53 15833.90 2458336.66 3005355.47 3169562.32 2195331.03 3302088.59 4131798.25 4314299.88 2490892.02 3088927.19 2425071.29 2803721.98 2937716.22 2125732.87
Phomalichenone B
9423.80 9331.13 9172.83 7725.16 10009.24 14820.36 14917.16 10682.66 10974.46 7550.40 9680.78 9057.39 6957.28 368808.56 430389.71 544770.39 461463.92 654385.88 492157.43 618802.65 482404.35 569156.89 538504.49 626287.04 505844.08 428674.38
Phomaligol A
10849.21 9262.16 39754.15 8661.40 9738.27 14037.66 13380.01 12399.99 11493.47 8563.83 8375.63 8540.71 7824.21 2811878.20 2502532.53 2917030.37 2552506.90 3071816.32 3385335.81 2761951.92 2724474.01 2738600.12 3151810.24 2939790.21 2841729.74 2444782.98
Phomolide D
16502.14 19588.52 45963.45 12874.64 22845.94 34674.98 28521.23 19034.33 23374.64 17903.31 16841.92 17999.37 12929.08 1526812.15 1224166.30 1684129.24 1664300.87 1896779.31 2154078.43 1605862.30 1400138.54 1350380.17 1487977.61 1343673.04 1488059.30 1544265.61
Phosphate
1183734.76 3213869.91 9711325.34 2311017.42 1339613.02 939976.94 293497.28 213245.78 435703.06 212189.73 266894.27 592676.90 179598.35 47834003.63 52320628.95 52882446.19 51955273.17 54127734.45 55415569.71 51776057.19 51975130.89 49646501.04 48602108.69 42718003.15 53018880.69 50134017.44
Phthalic Acid, Bis-Hexyl Ester
11530.95 8761.23 10925.56 8629.58 9119.84 17381.84 17443.39 13107.07 13294.76 11877.54 7902.80 8787.73 7168.21 300186.56 331507.41 289905.71 292170.48 392209.07 298387.32 372516.77 475339.41 455753.95 438238.02 404670.60 355420.02 239762.16
P-HYDROXYPHENYLACETATE
225395.10 317790.36 361735.13 250100.22 490302.62 245461.05 351414.03 254386.06 275883.75 224435.82 229498.92 222983.59 282711.58 3825303.71 4356726.73 5029812.43 4190684.16 5227933.50 5779737.99 4718923.74 5090270.01 4431781.70 4865529.66 4466386.66 4588687.36 3872746.07
p-Hydroxyphenylacetothiohydroximate
11625.41 54478.04 12473.83 9354.22 10230.41 11414.53 11637.25 11787.07 11614.11 7693.58 8460.29 9262.66 9153.02 3874294.25 4685905.37 5445792.88 3866442.09 4158407.50 5740411.26 5892473.18 6175377.04 7284538.15 5162391.38 4276067.02 2985425.22 5095525.81
Piericidin B1 N-oxide
13740.10 11150.10 15149.83 10887.27 14362.55 23781.27 23682.11 15207.14 18542.71 10701.19 11874.99 11549.25 9250.22 223792.06 213691.67 189189.35 178758.27 229660.78 228230.12 223432.54 188034.41 184378.90 211720.17 257727.22 263381.90 189715.44
Pimilprost
11983.11 8457.85 11354.24 8307.52 9939.21 16293.77 17702.58 17407.71 15835.68 14608.72 8625.36 8017.59 6936.67 107126.99 118600.90 110017.48 90024.83 171279.69 147379.80 115206.57 228045.13 118182.29 149221.16 264945.14 116417.07 71770.23
Pithomycolide
11647.40 8001.09 10153.97 8357.23 8750.23 14711.70 17228.38 12823.14 12129.46 12436.08 8277.75 52743.59 7298.59 717185.59 781721.84 681164.12 854330.44 791513.32 868245.43 736394.45 1231160.82 878591.22 615272.10 916867.05 691695.05 802438.63
PL1B
90945.57 121518.74 358965.76 65582.91 69236.33 92909.08 100061.04 88770.95 78602.37 62698.46 67083.81 65000.77 52105.18 3406286.43 4013820.69 4428563.28 4138093.85 4064579.31 4220406.46 4618001.26 4363128.01 3564214.94 3776810.44 3895663.45 3942998.52 3623625.38
PL2B
9255.84 7724.40 7514.28 7499.33 8212.29 10347.50 10685.64 10370.71 9976.87 7254.43 7738.63 7572.35 7057.67 166034.88 188990.92 222096.56 222905.28 159189.09 206189.11 288239.23 262029.65 254760.48 212625.98 118311.18 144298.10 135791.51
Pochonicine
11307.44 13938.76 11199.14 9164.93 10095.02 12129.53 12470.38 12524.15 12136.94 8361.12 9651.12 9647.35 8763.84 784748.43 963869.15 1055558.54 997827.05 1276190.55 1432292.93 1851345.35 813082.48 1035242.07 966766.80 741828.14 916386.98 942062.42
Pravastatin
11901.70 9204.60 15405.27 9336.38 10256.69 15894.30 16357.52 12776.50 12662.30 8928.44 8299.49 8818.29 8164.33 205615.02 264299.42 257341.74 234292.39 290941.00 272207.49 280043.18 268201.23 286961.95 276155.28 269476.97 273097.78 242319.75
Pregnanediol 3-O-glucuronide
136328.10 91985.33 209426.47 48358.14 123175.34 32423.02 18495.55 66898.04 150762.75 84716.18 121357.67 599747.70 19180.98 119922056.97 105339916.65 126202187.97 123328589.53 120733651.65 124484303.17 118828933.33 153266927.47 133995967.11 131427011.72 133789935.70 135805786.80 126202457.05
Premithramycin A3^
10392.53 8945.29 8455.38 8269.75 9327.92 11830.53 12237.20 11985.81 10884.34 8402.03 8071.41 8685.60 7757.39 433298.10 455010.59 591092.83 623354.71 493675.95 581266.94 865783.50 550104.20 635840.16 623192.62 438363.46 400631.11 449766.44
Probenecid
8797.27 7509.30 7562.74 7193.73 8132.35 11118.61 10920.74 9889.89 9209.99 6666.83 7142.44 7136.88 6479.38 114735.40 108619.23 165366.62 116923.54 126060.64 133093.58 133434.48 97036.36 178430.88 122397.17 117745.34 111189.84 108834.58
Prohexadione
8647.43 11210.33 34998.26 7203.97 8168.71 10423.11 10543.65 10451.15 9385.46 7044.98 7327.00 7214.05 6895.99 1781332.55 1617963.92 2372651.11 2047274.75 2529512.19 2846613.78 1753842.95 1900708.44 1729075.90 2107182.94 1541201.66 1894309.56 1795783.24
Prolinimine B
28166.46 30139.67 29377.59 21915.05 28431.84 58174.75 47850.50 30899.07 39215.99 21680.51 28255.95 30197.82 19836.79 1360513.70 1095218.65 1240430.81 1267593.78 1380955.80 1507220.10 1287986.11 1164236.22 1058104.53 1398888.41 1160612.83 1284091.45 1191317.63
Prolylhydroxyproline
61223.05 84894.34 242297.97 52157.31 38414.00 71439.14 77424.65 61508.08 61059.85 49979.71 61568.29 78351.88 34252.83 4175533.63 4288583.87 4461644.70 4082078.50 4467799.57 4673964.03 5576840.19 5005176.11 4241276.37 4435115.66 3096318.03 4541031.53 4092503.47
promacyl
9037.44 7608.84 8134.60 7204.70 8330.89 12278.16 11707.15 10257.29 9368.29 7079.92 7164.58 7549.61 6642.96 372182.76 460215.01 528792.64 546285.14 506677.47 516330.97 518214.71 427864.04 530711.45 589357.56 562573.88 576606.30 463780.23
Propentofylline
9918.61 18886.41 25815.02 8102.75 8927.55 13045.26 13592.44 11020.64 10857.29 7595.16 7243.24 7518.17 6936.39 2140526.91 2063110.13 2373507.15 2180862.89 2762642.61 2691357.35 2015784.13 1859284.67 2099106.38 2226203.11 2217605.66 2464657.07 2271376.69
Propofol
10959.70 32747.08 38258.61 43588.97 39508.76 13712.42 27558.13 12194.01 11759.21 11193.92 8186.43 8625.23 20925.78 5736760.48 5841254.93 7101874.22 6633927.28 7895411.08 10837699.82 6612673.11 6129407.73 5895342.02 5916722.12 8757969.54 5805721.89 7183381.18
Propylparaben
90859.28 77675.72 57242.22 47750.54 125704.50 121366.39 90176.83 32124.93 63986.07 50919.41 111469.76 60022.20 53866.49 383834.72 302475.53 387376.56 315406.95 911693.24 437811.91 315200.73 568206.09 332884.72 555851.06 438984.07 286757.25 741388.79
(+)-Prosopinine
11060.14 8750.23 10362.62 9016.68 10214.08 15011.67 14745.60 12647.50 11772.79 8479.74 8184.51 8685.83 7731.23 104018.55 154752.76 192948.79 165621.95 267238.09 190176.41 146731.92 187132.92 125565.57 169297.14 125498.90 174726.17 141772.29
Prostaglandin D3
10910.77 8484.04 10368.27 8657.20 9496.92 14716.92 15386.51 12218.99 11607.74 8130.04 7823.51 8170.07 7530.96 267245.54 282329.79 324165.94 269008.75 328443.52 310174.83 368537.58 326354.12 390714.68 435773.91 344680.21 306835.27 230412.92
Prostaglandin E3
10910.77 8484.04 10368.27 8657.20 9496.92 14716.92 15386.51 12218.99 11607.74 8130.04 7823.51 8170.07 7530.96 267245.54 282329.79 324165.94 269008.75 328443.52 310174.83 368537.58 326354.12 390714.68 435773.91 344680.21 306835.27 230412.92
prostaglandin H2 2-glyceryl ester
10539.81 9627.78 9004.23 8011.99 9955.68 17506.74 14010.45 11446.12 11390.08 8049.44 9425.04 9197.78 7343.62 153692.82 118204.16 159955.76 154667.95 161317.22 141366.18 140557.74 179132.17 113073.85 124359.00 160703.80 134826.53 119749.01
Pseudonocardide D
14199.91 25216.78 54391.83 13220.24 30083.15 34963.90 33147.28 33258.27 47597.16 18710.39 50643.12 26107.32 9988.64 574231.57 506299.18 560920.03 498503.13 671679.51 674872.39 583848.80 518536.73 556192.58 625553.66 686050.67 593313.63 530965.44
Pseudouridine
915382.78 641654.06 2117135.93 784895.66 447789.65 387098.07 16834.23 11877.94 321819.19 16568.08 45218.64 378530.46 7344.34 25810476.18 30357547.52 29333738.74 27786075.55 32034677.27 32791078.01 32522160.87 30938054.31 26689852.94 30039849.78 24580127.95 31093226.73 26915589.88
Pukeleimide A
24590.92 12581.45 17162.16 14215.44 10575.04 19514.99 20789.55 23670.32 19601.09 13120.53 15484.31 17616.11 16070.57 256651.43 315273.81 299265.17 218136.22 242855.06 197689.96 296239.98 269541.03 250184.05 262592.23 225703.77 289387.39 260388.42
Pukeleimide B
24590.92 12581.45 17162.16 14215.44 10575.04 19514.99 20789.55 23670.32 19601.09 13120.53 15484.31 17616.11 16070.57 256651.43 315273.81 299265.17 218136.22 242855.06 197689.96 296239.98 269541.03 250184.05 262592.23 225703.77 289387.39 260388.42
Pulcherriminic acid
36617.24 47341.22 187834.53 34669.07 32491.41 14199.35 17134.59 11651.29 19654.37 7924.36 8518.55 8984.48 7989.23 10904894.20 10056750.70 12745410.87 9845515.68 13828246.93 14048422.46 11962820.90 11145764.08 10461391.04 11697459.49 9029140.36 10245255.92 10584473.15
Pyridaben
20944.06 17814.55 17598.11 16950.76 18950.57 22967.95 23039.69 23731.40 23706.08 16442.42 17935.07 18230.67 16433.16 1413868.70 1153308.94 1368277.20 1211979.15 1424604.07 2049176.91 1203349.99 1249077.82 1052766.09 1243431.94 931775.99 1255326.75 1224524.22
Pyrocatechol sulfate
722553.91 1092848.01 2024391.14 1148453.53 552982.55 381926.98 732109.81 771377.67 658874.55 561491.34 548286.85 398420.66 703582.13 96747868.65 95877151.74 114574442.02 104913869.52 123979232.49 133112110.24 120781257.48 109738925.88 104364915.18 97981235.41 116930456.05 94155000.71 76247942.93
Pyrogallol-1-O-sulphate
164038.96 272355.73 763670.54 150476.28 125562.38 65446.24 16929.10 15672.87 14614.11 10677.29 10198.89 10097.18 9476.29 42232889.63 43841696.37 54884000.50 57795915.66 64782945.55 54968777.86 59337442.93 47278696.21 40593896.92 40142457.90 49859178.44 43036694.14 32712842.34
Pyrogallol-1-O-sulphate_
19185.91 35751.12 75453.45 13776.62 14104.54 19145.82 21049.37 20299.75 19414.17 14717.18 14274.89 12977.67 12148.13 2486276.28 3259763.73 3444826.89 3892357.61 5318105.96 3814896.53 5778008.48 3254019.80 2242056.91 2373609.41 2829522.64 3438993.57 2556952.43
Pyrogallol-2-O-glucuronide
17664.44 12330.50 12506.03 10960.11 11908.64 19870.73 22365.07 20977.52 19336.82 14747.73 13744.56 13836.41 13188.07 466427.32 705984.88 805693.67 670358.22 874684.04 800161.28 552669.45 500709.97 417674.68 390319.26 395420.90 542892.01 507101.06
Pyrogallol-2-O-sulphate
164038.96 272355.73 763670.54 150476.28 125562.38 65446.24 16929.10 15672.87 14614.11 10677.29 10198.89 10097.18 9476.29 42232889.63 43841696.37 54884000.50 57795915.66 64782945.55 54968777.86 59337442.93 47278696.21 40593896.92 40142457.90 49859178.44 43036694.14 32712842.34
Pyrogallol-2-O-sulphate_
19185.91 35751.12 75453.45 13776.62 14104.54 19145.82 21049.37 20299.75 19414.17 14717.18 14274.89 12977.67 12148.13 2486276.28 3259763.73 3444826.89 3892357.61 5318105.96 3814896.53 5778008.48 3254019.80 2242056.91 2373609.41 2829522.64 3438993.57 2556952.43
PYROGLUTAMATE
1329643.31 334152.83 838101.08 351846.04 553563.80 718321.34 469541.71 156336.49 633905.74 681630.93 646201.91 781450.17 150383.30 12915855.27 11610025.48 13051954.86 11933943.77 13186825.03 15950869.79 14680064.00 13339964.33 11926877.80 11325565.04 11451646.00 11683447.32 11218005.51
Pyrraline
12124.99 23830.96 37930.17 9714.93 10976.41 11459.12 12824.07 12078.67 11940.56 8168.31 8578.19 9376.43 9339.94 1720793.08 2177136.45 2769101.60 1846397.26 2208162.76 2678767.00 2971711.11 1737519.62 1856386.01 1707936.35 2104475.57 2231664.56 1575276.85
Pyruvic acid
251419.40 327576.08 503516.23 485373.78 477191.72 429401.62 406347.86 437213.59 407739.34 282271.62 535646.10 442693.58 394556.49 9391045.93 7939568.27 9737929.93 9097315.55 9429051.14 11362888.01 11235764.85 8631868.53 8290066.89 9294534.07 7142235.35 8421247.84 8583931.53
Qinimycin C
12477.99 9697.50 10583.86 8704.93 10038.75 17981.79 15732.53 13476.01 13225.52 8831.59 9453.76 10006.17 7814.26 137818.19 136470.44 147045.73 133045.03 168121.84 189964.15 153371.30 115541.42 147632.44 145167.97 155507.19 156856.98 159354.62
Quercetin
7842.42 6364.99 6368.18 6220.88 6939.59 8505.55 8800.13 8796.63 8180.68 6010.61 6480.07 6413.11 5987.10 137380.99 127970.42 232135.69 148339.11 143052.94 168865.44 215946.47 182053.94 166955.95 175208.27 110056.49 126040.65 166676.82
Quercetin 7,3^,4^-trimethyl ether 3-sulfate
9417.27 7903.65 7632.62 7450.88 8472.27 11657.27 11177.92 10409.48 9633.03 7035.38 7383.88 7649.95 6734.65 274157.74 262651.28 210022.55 336381.52 364983.60 328456.00 253388.34 291641.15 346195.67 295434.24 329724.94 361567.06 325898.57
Quinaldine
9131.86 7315.27 7472.56 7133.63 7957.79 9753.51 10091.31 10087.30 9439.17 6892.50 7430.84 7354.05 6953.92 261002.52 238004.41 255703.76 198295.56 231995.79 253128.62 337184.80 264836.84 282145.13 262629.37 281969.77 273402.85 287939.68
Quinoline-4,8-diol
10033.82 15072.25 11165.92 19505.27 48879.92 10549.42 12569.12 11352.03 10842.54 8414.27 8674.73 8895.43 15485.43 793278.85 1215629.77 614917.87 859014.02 1265359.46 1825161.85 1638574.18 1814270.61 1295405.26 1141521.44 1097483.64 1494139.27 861090.37
Quinomeran
9369.26 6609.32 6939.98 7055.18 8150.30 9192.75 9884.54 10047.56 9399.32 6654.19 7079.11 7530.13 6979.13 228355.50 302271.30 263531.50 230927.85 265883.38 243122.11 238629.62 245787.87 237516.80 238095.50 207367.14 215082.29 204740.89
(R)-2,3-Dihydroxy-isovalerate
248960.96 231672.27 570094.49 203903.89 213289.67 173373.77 108581.19 76756.89 29473.79 59383.68 32377.12 84023.37 103165.68 12434077.14 8947037.53 13020141.87 14407503.01 12659290.52 15423692.64 13491118.41 11774662.07 9975102.60 10048176.06 9631039.30 11975660.74 10157071.63
(R)-2-Hydroxy-2H-1,4-benzoxazin-3(4H)-one
126652.29 273387.70 230970.73 244191.40 301709.08 162899.87 234122.91 202253.91 228727.61 231219.42 224983.64 202983.86 228976.90 947064.85 1144029.12 1180425.33 1173933.22 1303337.84 1218179.77 1502609.26 1239257.42 1379583.54 1319333.56 1227530.16 1132851.38 992391.91
(R)-3-((R)-3-Hydroxybutanoyloxy)butanoate
14829.45 9334.23 15326.47 11881.83 13424.68 14015.06 15684.45 14638.55 14742.58 10217.54 10633.09 11467.82 11423.20 637468.76 625986.05 822661.46 670392.14 753871.99 1265157.83 686868.72 716650.96 501634.08 627557.05 506588.72 625447.28 540121.69
Ravidomycin
10888.60 8601.78 11869.90 7986.54 14651.30 20136.44 18629.87 11931.94 15688.17 9734.15 9995.79 9032.84 6908.32 367480.51 244847.21 411462.68 360051.02 386372.00 365454.77 264266.26 481525.33 411090.15 343731.33 439127.94 320504.36 293139.30
Rehmaionoside C
11746.71 10343.12 10132.45 9644.72 10845.88 13126.49 13773.45 13693.64 12824.16 9492.31 9706.77 9920.63 8816.44 893912.77 726470.86 722704.87 666607.88 707960.56 898708.68 828475.61 755732.53 668348.52 832012.07 697163.46 847350.20 710551.91
(rel)-4beta,8-dihydroxy-3alpha-O-[alpha-glucopyranosyl]hydro...
15985.39 14145.38 26755.89 12765.57 14910.29 20274.38 19533.30 18212.94 17178.26 12252.52 13356.46 13225.71 11808.78 674695.81 588575.19 460450.52 426793.25 399189.37 596457.50 755767.54 514984.93 641230.80 508434.97 655747.47 693371.06 641564.59
Resorcinol
72741.86 159895.51 153884.86 158890.65 176485.36 61472.69 80897.00 25297.76 74420.86 96426.86 121390.39 100304.45 127815.78 4733133.95 4119522.49 4315333.36 3950299.74 4566075.62 5227055.83 5970879.95 4376366.59 5083701.04 4393787.63 5710618.47 3882693.60 3375207.40
Resveratrol 3-O-glucuronide
9630.70 16187.06 8237.28 7540.17 8821.75 11773.01 11625.39 10661.23 10136.32 7421.18 7511.20 7804.92 6930.13 1610090.51 2246200.62 2582986.66 3006870.51 1483023.68 1523713.91 2133737.52 1719025.65 3493877.48 1553474.53 2231566.74 1915483.23 3076292.99
Resveratrol 3-sulfate
9344.98 8008.80 12016.88 7337.92 8180.10 11369.89 21505.61 10091.44 9868.39 7234.64 10911.73 7419.47 6777.32 249202.18 204334.47 232818.72 209440.54 255810.10 331667.39 388571.31 321226.77 419287.38 294622.93 317329.09 282828.47 183387.29
Resveratrol 4^-O-glucuronide
9873.73 8436.93 8619.55 7939.89 9063.27 12988.88 12275.02 10992.46 10243.73 7841.76 7712.41 8207.17 7197.03 426618.29 449457.74 418948.91 386488.40 427281.39 492766.93 430581.96 301112.02 541098.36 404073.23 481928.53 507366.22 358992.56
Resveratrol 4^-sulfate
9705.30 8630.94 8171.41 7813.23 9203.03 12579.89 21972.48 11174.58 10667.59 7716.70 8224.57 8289.43 7233.74 479233.58 448221.06 542040.34 551633.10 549968.24 476222.22 773975.41 542917.65 813981.45 574675.93 638535.80 539997.77 514526.26
RIBOFLAVIN
11607.24 8969.74 10109.60 9217.46 11567.90 16912.05 14143.68 12658.60 12838.15 8598.26 11222.63 10595.85 8937.47 515921.17 545110.24 613018.59 439504.70 616292.84 621446.10 782757.93 483486.95 636963.28 573261.39 495005.52 631805.76 505754.50
Ribonic acid
370132.14 906724.30 8147909.28 219387.41 9017391.73 8180561.32 5397136.12 308355.27 12710847.75 309054.47 9874878.29 7788224.86 342468.82 788706.82 10153358.87 20647994.22 604418.14 19130150.66 15500577.52 2772761.23 1517257.87 7867442.93 288993.65 15573106.83 9733757.96 598389.32
Rimboxa
79329.11 70209.86 87154.41 65713.40 41677.30 95007.83 92271.34 83825.99 80377.95 64114.78 68599.19 66469.10 49654.41 2613540.31 2808842.29 2953006.02 2728033.41 3021181.08 2896798.55 3380271.34 3332080.63 2942979.60 2862667.49 2373891.54 3042587.68 2558771.84
Rimosamide D
11591.18 9305.25 9868.39 9091.75 10173.48 14402.58 14162.08 12896.61 12127.47 8765.61 8634.29 9122.21 8008.62 421787.83 326178.09 373817.20 287670.73 342040.68 470476.66 332361.24 394225.82 404565.66 415564.07 350862.19 373293.88 331048.45
(R)-Lipoic acid
155589.22 276595.31 694547.94 202264.66 176601.67 200493.36 183717.91 109275.04 120243.28 121928.32 91490.61 133741.64 67483.30 6351828.15 5158307.99 7370584.00 6969949.35 7227185.18 10597062.91 7743560.51 7284735.58 5382052.43 6100453.29 4482406.86 5953117.42 5906788.47
Rosamicin
10786.66 9366.47 11540.00 8356.40 10658.49 19780.36 19692.28 12191.11 13776.58 11374.76 9027.05 8475.08 7032.30 203662.52 224528.93 226044.08 193131.00 275642.47 269638.31 288850.79 294452.50 225162.62 233408.07 280824.48 226449.93 189206.67
Roseopurpurin B
13850.79 18139.21 32768.76 11210.69 12351.85 18048.97 18845.67 15247.78 15021.78 10508.40 10093.94 10491.21 9596.95 3241318.41 3174321.64 3655645.32 3642192.44 4811860.47 5482344.90 3022116.11 2241299.34 2584810.69 3954166.53 3076292.22 3338912.01 4609997.39
Roxarsone
12949.97 8189.94 9406.39 10685.17 11487.15 12173.51 13623.55 13133.19 12827.92 8677.54 9068.70 10007.26 10035.25 53583.31 101967.17 210390.94 185734.81 267604.77 168751.93 141081.15 172999.32 99884.38 146973.45 94063.86 164833.78 86410.17
(R,R,R,R)-3-hydroxybutyrate tetramer
13511.05 20890.52 81062.27 10852.49 17441.09 14254.24 14258.56 14780.54 14609.61 10150.32 10707.78 10974.28 9925.26 5231327.50 4284716.97 5135726.90 5049042.53 4907005.91 6952799.26 4738526.92 4222673.33 3899489.36 4625776.55 3947535.16 4841699.52 4371957.58
Rubratoxin acid B
11778.19 9462.59 9808.48 9058.05 10526.61 15269.51 14559.38 12679.97 11811.14 8927.64 8910.10 9329.02 8103.44 328745.98 266811.46 312475.92 239271.38 368937.78 317519.70 312297.13 267113.41 262187.72 306606.12 402661.77 331619.66 280851.31
(S)-3,4-Dihydroxybutyric acid
696885.77 779346.45 1765515.78 651106.99 863621.80 273996.18 552530.39 302805.19 588485.92 417605.30 315341.13 530485.46 475943.71 55580827.51 56600181.05 68320700.39 63685271.14 69716712.97 77930154.87 72203331.42 70682306.26 59925151.03 59896230.45 58840001.98 61623275.08 51994909.11
S(8)-aminomethyldihydrolipoamide
9036.92 7338.10 8023.86 7210.89 8012.29 11285.76 11264.03 9968.51 9135.41 6856.39 6807.65 7297.44 6466.71 187948.90 167825.69 198443.16 188889.97 187900.92 162482.80 237196.59 225691.14 301288.08 242151.03 147442.07 161619.52 162369.32
SACCHARATE
39475.31 26473.47 38172.28 24768.59 16975.89 37367.60 38298.04 37997.48 37829.64 24999.45 27146.42 31720.59 25797.75 886061.30 412704.48 795492.60 666341.65 624077.22 891030.99 798202.45 891071.77 919033.33 722979.32 459200.57 725023.68 852922.86
Saccharin
23336.86 15433.07 34250.51 18014.73 20654.14 40768.51 28930.44 28685.15 25329.43 20085.24 16566.91 18559.66 18549.85 3405907.25 6244373.52 7190028.21 3518291.30 9321200.10 5382348.74 7366427.11 12661898.32 5942499.36 4579554.51 5587089.74 4164660.68 3150766.73
Saccharopyrone
13427.24 11079.60 36478.81 10728.82 12036.88 16855.81 16706.18 14539.31 13670.76 10358.47 9818.80 10320.72 9433.50 1918369.21 1921602.29 1989345.19 1818254.94 2225246.22 2394217.87 1988449.92 1767398.68 1957719.32 2137676.76 2153926.46 2287777.71 1964359.20
Safracin A
14430.63 12462.24 11865.58 11117.76 13268.61 19629.35 17421.44 16018.82 15432.89 11055.33 11822.28 12056.41 10479.51 547452.76 380307.01 495182.34 414546.81 369650.76 561974.21 447011.10 586657.69 426634.25 408920.39 563308.27 380647.81 423870.82
Safracin B
19245.28 16167.75 15311.67 14953.87 17211.99 21747.75 22288.16 21714.86 19666.44 15246.20 14749.21 15698.38 14264.58 640913.00 585203.49 684301.72 621526.66 679565.64 673383.43 576952.32 656066.68 608534.61 673924.57 641290.70 652381.00 682387.46
SALICYLATE
345359.26 351936.18 321377.31 344196.38 418919.52 305928.35 364255.85 283623.23 294665.32 280345.75 309904.05 309371.74 339688.70 11328436.96 8713017.04 10100240.88 10540261.96 12337736.98 13435871.33 14361595.49 10927798.86 11676315.75 14854204.97 11127525.11 9820406.04 8504574.68
Salicyluric acid
72587.59 399114.28 303561.39 114509.90 160320.77 76284.16 17793.17 12381.25 39197.05 44871.72 29654.98 52417.39 43336.99 100474248.85 80355861.15 100501662.08 97683181.22 114232730.60 123310024.29 100173105.95 97590140.80 86985242.69 120066158.10 82368532.20 84960828.58 77188454.24
salicyluric beta-D-glucuronide
12533.50 8519.85 9400.57 9087.68 9918.75 13522.18 11985.01 12736.86 12309.11 8376.24 9347.86 9860.92 8916.42 265692.40 413400.45 456241.44 330781.92 268943.74 412318.54 335179.86 413277.83 326678.72 273731.18 367640.84 441758.35 313137.74
Salinipostin J
11364.83 8482.12 10473.73 8117.52 8941.98 18074.70 17712.12 12533.86 12775.34 11141.10 7809.33 8460.42 6888.16 52692.19 65557.03 61297.67 60056.12 92286.67 73983.51 42965.49 51160.02 53902.37 73366.63 89008.46 102472.55 87195.83
Sargassopenilline G
18925.99 15223.91 38830.93 15394.56 17097.99 25018.71 23817.20 20924.66 19777.29 14721.38 14097.96 14859.80 13799.98 1930050.36 2068055.72 2346039.47 2083354.96 2678888.28 2612159.60 2001023.74 2010315.51 2027526.13 2433944.87 2098220.76 2554176.89 2151423.12
Sartoryglabramide B
10575.31 8187.63 9807.74 8522.47 9321.35 14386.40 14177.05 12805.25 11089.04 8012.07 7526.30 7949.28 7372.99 426614.13 508003.74 390585.50 385203.04 486807.15 513281.49 431031.41 675719.73 587535.65 377284.07 522517.07 684937.01 413269.46
Saturnispol A
11352.87 8273.82 10388.69 8397.32 9300.96 13938.09 16473.77 15130.04 13200.49 13732.61 7547.81 7268.43 6788.38 108664.41 133581.64 132966.21 121436.01 174281.78 176276.85 112819.04 105749.78 155258.40 139467.18 198350.53 164696.94 129455.83
Sclerosporide
9360.24 7940.48 8112.36 7472.69 8529.97 12398.32 11552.73 10345.64 9640.96 7380.34 7258.60 7495.36 6738.58 633932.36 716333.28 729914.67 659727.97 675258.76 744405.23 740164.04 791691.37 780956.52 788096.50 734432.53 750640.88 673527.09
Sclerotiotide F
12827.72 24848.11 15392.72 10484.85 13750.13 18386.03 21730.34 16080.32 16238.99 12909.13 9945.78 9868.46 8675.32 1582363.40 1508054.59 1583311.80 1426884.56 1879129.25 2372553.98 1895362.75 1339515.64 1374897.97 2484689.15 2135592.51 1851475.63 1584510.93
Scopolin
10817.41 9357.93 8944.41 8620.63 9577.27 11694.35 11472.17 12126.14 11985.90 8373.51 8784.79 9003.44 8142.80 325868.62 380897.62 494915.36 412337.75 400115.55 291273.02 325610.77 291254.08 400243.53 549079.25 333176.01 389103.27 299464.19
Scutellarein 6,7,4^-trimethyl ether 5-glucoside
9186.18 7425.10 7725.61 7577.04 8505.98 10448.33 10926.23 10299.79 10276.80 6963.34 10193.92 8087.86 7278.95 142025.38 158574.19 153072.08 132281.70 148086.37 162471.66 190291.56 135688.19 168433.22 164372.55 127093.34 139402.93 130224.11
SEBACATE
147037.61 251648.66 132502.33 124569.86 209066.05 321345.57 177502.96 149555.83 159828.90 143857.63 178914.93 129362.99 123246.94 3455320.83 3076588.16 3755165.03 3645506.43 4167139.55 4419973.94 3656538.92 3622445.13 3533893.17 3872121.41 3817173.81 3892292.46 3158020.95
Secobarbital
9039.86 7537.46 11428.22 7287.99 8251.19 10256.64 10389.71 10087.67 9535.62 7241.11 7370.13 7652.88 7151.08 2226486.16 1918047.44 2766746.31 2241619.10 2536899.92 3106151.55 2494698.99 1964205.86 2083646.75 2549486.00 2232825.81 2136923.56 1934544.30
Secologanate
11670.45 14792.22 43973.98 9311.79 11906.62 12992.16 13057.44 13180.07 12643.69 9144.33 9736.15 9807.71 9074.98 2420077.16 2509076.04 3558536.08 2453092.26 2853662.12 3512705.32 2539660.69 2234546.81 2467570.19 2961354.25 1982887.95 3748141.74 2533419.43
Senecioic acid
63975.09 109606.25 145022.69 94955.02 119707.55 81823.46 111327.52 75466.86 80473.89 45541.14 54598.00 73638.85 41360.89 1323499.63 828028.25 942895.78 1123634.55 920788.00 1324650.24 1242814.22 1133759.36 973828.31 1073922.14 979731.86 838455.33 964733.92
Setipiprant
121147.46 83938.33 80542.46 75846.14 62017.81 207504.77 110313.61 100216.89 96094.64 158759.41 154831.79 128617.85 59363.58 884045.69 1435121.29 1680050.14 1516338.88 2223450.03 2563688.04 992998.98 1691223.14 715103.25 1648977.60 678805.42 1717287.99 1169651.67
(S)-Lipoic acid
155589.22 276595.31 694547.94 202264.66 176601.67 200493.36 183717.91 109275.04 120243.28 121928.32 91490.61 133741.64 67483.30 6351828.15 5158307.99 7370584.00 6969949.35 7227185.18 10597062.91 7743560.51 7284735.58 5382052.43 6100453.29 4482406.86 5953117.42 5906788.47
SN-198-B
9417.26 8734.97 12910.90 7758.77 9081.31 22750.15 14972.21 10678.23 11287.01 7227.48 8664.63 10068.63 6801.53 83807.40 97792.69 80861.88 81055.16 94813.01 92712.04 93530.04 116358.52 123094.44 105531.04 87597.51 110732.32 78004.75
sn-3-O-(Geranylgeranyl)glycerol1-phosphate
10541.26 8021.04 10014.80 7982.97 8588.60 13017.84 16111.96 15334.60 12870.26 13990.53 6960.44 6837.02 6421.30 56996.37 58636.37 60900.46 56386.12 77221.78 78686.96 64893.07 47619.31 61693.18 78732.43 99225.43 83811.06 68714.73
Spiculisporic acid E
14157.31 13653.73 12285.06 10393.90 13540.12 27578.33 20732.96 15685.69 17196.61 10731.81 12482.86 13156.82 9496.47 1062805.21 828448.95 965335.04 925831.92 960338.20 1273410.29 1012841.09 783643.64 791824.61 925592.88 806519.59 921625.19 881141.54
Spiroleptosphol B
11755.03 9644.75 12989.30 9299.56 11858.06 19501.93 19863.48 13724.18 15306.59 10270.90 9467.87 9670.83 8115.91 772365.40 926129.28 913021.03 809356.30 1032734.87 1005143.18 992972.95 1045636.69 884763.46 984695.85 1036671.13 1006767.58 812768.30
Splenocin B
13222.83 8865.86 10909.60 8930.58 10094.52 17803.82 20602.03 13795.15 14831.34 8804.73 8870.80 9271.67 7644.75 1078459.89 656566.90 637862.79 802986.34 1140872.29 1569445.23 940223.63 732663.45 676460.29 781268.44 871454.15 698588.13 1570693.00
Splenocin E
13222.83 8865.86 10909.60 8930.58 10094.52 17803.82 20602.03 13795.15 14831.34 8804.73 8870.80 9271.67 7644.75 1078459.89 656566.90 637862.79 802986.34 1140872.29 1569445.23 940223.63 732663.45 676460.29 781268.44 871454.15 698588.13 1570693.00
Spliceostatin G
10153.44 7459.31 9400.60 7838.69 8492.05 13275.75 14085.45 10877.09 10536.99 7450.28 7727.75 7398.14 6698.25 242834.08 233113.93 218163.48 222609.69 262634.00 299521.67 231063.92 223780.00 241430.60 298134.90 281582.27 303390.09 248915.87
Stachyboside B
14281.01 10110.26 12261.47 9904.83 10332.02 18129.36 21000.43 15775.94 16285.14 9876.48 10321.38 10197.93 8187.49 81135.66 86154.63 91115.57 93699.62 85696.49 86866.57 83602.31 111653.72 107055.26 104392.41 88739.71 90414.34 78114.27
[SThydrox]3alpha-hydroxy-5beta-androstan-17-one3-D-glucuroni...
11538.47 8891.22 12756.19 9024.72 10016.30 15305.27 15526.10 12483.18 12086.24 8645.02 8196.40 8600.71 7938.45 166932.53 176917.81 185070.33 168014.00 185149.01 214321.06 190140.52 203766.56 180681.49 209555.79 191743.53 197358.99 188370.34
[SThydrox]3alpha-hydroxy-5beta-androstan-17-one3-D-glucuroni...
16581.29 11086.56 14563.53 11042.00 11240.55 20149.64 25021.46 17321.03 18082.79 10950.74 11293.70 11258.17 9079.04 584934.31 598330.15 625408.37 537581.40 661422.81 698447.96 624108.37 558923.37 615031.38 705785.13 650021.82 628216.54 589801.04
[SThydroxy_ox]7alpha_12alpha-Dihydroxy-3-oxochol-4-en-24-oic...
11220.84 9210.83 12212.65 8661.20 11211.61 18434.29 18921.08 12480.30 15189.03 8782.33 9695.03 9363.71 7592.30 894132.84 913313.67 759206.26 752110.76 979208.53 854061.45 919383.85 930616.60 866900.30 821807.51 968060.49 994860.45 791402.68
Streptoglutarimide A
12991.32 10060.77 10980.33 9031.01 10223.11 18866.51 16321.86 13980.81 13720.94 9162.41 9807.89 10380.99 8106.98 775791.88 624780.68 795419.17 650488.92 867902.30 1095386.42 584610.42 625617.39 642275.00 784932.48 695593.81 841239.38 721303.73
Streptoglutarimide B
12991.32 10060.77 10980.33 9031.01 10223.11 18866.51 16321.86 13980.81 13720.94 9162.41 9807.89 10380.99 8106.98 775791.88 624780.68 795419.17 650488.92 867902.30 1095386.42 584610.42 625617.39 642275.00 784932.48 695593.81 841239.38 721303.73
Streptoglutarimide D
12991.32 10060.77 10980.33 9031.01 10223.11 18866.51 16321.86 13980.81 13720.94 9162.41 9807.89 10380.99 8106.98 775791.88 624780.68 795419.17 650488.92 867902.30 1095386.42 584610.42 625617.39 642275.00 784932.48 695593.81 841239.38 721303.73
Streptoglutarimide G
12991.32 10060.77 10980.33 9031.01 10223.11 18866.51 16321.86 13980.81 13720.94 9162.41 9807.89 10380.99 8106.98 775791.88 624780.68 795419.17 650488.92 867902.30 1095386.42 584610.42 625617.39 642275.00 784932.48 695593.81 841239.38 721303.73
SUBERATE
138339.90 182664.76 284052.12 179219.68 254132.84 752151.62 226050.48 169403.33 194546.56 159037.09 193785.60 166234.68 137918.68 9018321.26 7461388.77 9122839.43 9736412.37 11462293.77 11741974.48 8934995.23 8270930.86 8375661.03 9596147.46 7735057.52 8704553.16 8223603.50
SUCCINATE
248066.46 552502.80 707675.25 665483.48 2447331.26 785373.97 579074.04 602721.90 460733.83 512843.83 480554.74 631763.92 617044.38 4992776.88 6004546.31 7306229.88 5996958.60 8469686.55 10851201.81 11758364.24 8204148.85 6739317.80 6949878.79 7903231.89 6883713.68 5618488.08
Succinyladenosine
10578.90 10999.66 23566.50 8592.46 9251.27 10249.19 11108.52 10638.26 10446.82 7531.53 7220.06 8013.67 8192.19 1163435.50 1245862.79 1407544.31 942322.10 1221172.86 1831667.84 1339037.85 1102186.10 1156880.08 1040202.56 831506.43 1074922.67 976378.19
Sucrose, 6-[4-(1-hydroxy-1-methylethyl)-1-cyclohexene-1-carb...
14525.71 13900.02 79069.78 10346.99 18707.19 15399.42 14683.25 12792.02 11749.82 8879.72 8985.90 13500.71 8331.68 4438489.29 4759526.29 3889715.27 3843303.39 3584413.76 5829288.38 3443467.19 3747587.08 4714841.10 4525264.57 3560327.75 3746971.69 4399217.63
Sulfate
4817933.85 4980659.47 14869434.74 3869227.47 1014357.31 1945078.26 487459.68 346992.92 1210001.45 516993.25 1033008.30 517761.27 241762.62 105915932.81 91522370.43 93574330.97 87553524.17 86668776.50 103323928.66 97802511.16 90847543.28 85517704.45 82442039.20 67126974.34 88782394.06 107931583.72
Sulfolithocholic acid
12250.55 9238.37 11147.07 9211.47 9163.98 14536.97 18634.51 19260.58 14410.40 15398.43 8756.19 7906.93 7449.25 360447.67 339367.63 350643.17 298616.08 491416.63 497272.36 413316.33 356112.62 427439.12 381586.96 459854.00 385037.44 347862.77
Sulfolithocholylglycine
13444.30 9263.69 11720.47 9540.18 10149.49 17076.44 19886.28 14649.55 14000.72 14354.65 8125.04 8561.30 8424.58 1326435.66 1388609.02 1457225.89 1199800.26 2021559.79 1857341.03 1566311.03 1339727.51 1429994.05 1591020.44 1797998.97 1851056.73 1452314.12
Sulfometuronmethyl
9351.09 10279.17 15374.48 7540.48 8577.41 10302.97 10794.13 10893.61 10147.46 7377.19 7968.60 7924.97 7383.29 2051347.07 1630213.26 1942267.31 1628045.24 2004028.28 3092905.34 1808391.66 1792095.13 1752121.28 1978794.11 1725566.10 1968442.02 1759894.37
Suncheonoside A
13990.54 9510.30 10268.21 10144.13 10835.05 14456.71 13442.20 14217.54 13818.84 9477.64 10619.44 10672.34 9856.50 573303.41 506211.64 623724.46 526727.68 570400.31 582775.91 622974.58 711953.51 532693.34 523005.64 688213.25 610927.94 441404.70
Syringin
20923.71 14866.89 14891.41 15134.86 16204.48 20800.35 20103.63 20716.15 20666.92 14174.39 15882.03 15958.47 14741.01 870285.00 949263.65 1017430.90 798417.72 963066.33 1155305.05 1193909.81 787409.84 866900.78 969195.62 728655.02 923366.11 771407.58
TARTRATE
115799.90 91115.15 413938.99 86414.24 26097.44 129242.72 127003.33 117527.10 108959.44 79665.40 87104.11 87462.95 72405.63 2121089.68 1493830.35 2271121.52 1383256.21 1276467.08 4479222.04 4649629.31 1357877.48 823998.18 1372701.06 2808375.86 1238305.89 1104552.57
Taurochenodeoxycholate-3-sulfate
14706.91 11332.73 13429.54 11547.76 12833.61 19860.77 19789.53 16317.25 15405.10 11018.93 10491.89 10982.36 10118.34 223032.00 387816.80 307130.08 209802.69 1308927.15 228470.69 1001080.41 245077.63 185797.25 994448.40 1075414.23 391268.16 224462.19
Taurohyocholate
9851.32 7737.15 8746.00 7829.39 8922.77 12914.24 13387.94 10733.68 10260.82 7330.22 6982.82 7323.68 6760.41 521604.92 681916.37 574716.32 462648.05 1098428.60 551158.08 614800.70 587402.38 542648.15 620410.91 813063.93 1007592.09 526236.21
Taurolithocholic acid 3-sulfate
21482.11 19598.28 28876.50 17661.05 29108.39 44676.37 40845.34 25692.12 40869.37 17748.60 30530.71 23056.80 15487.40 550896.78 583943.11 543864.83 439561.22 939875.14 657660.03 660576.27 539903.26 560867.36 611532.95 725437.65 663202.41 509325.61
Tazobactam
678629.05 1642681.53 3224940.09 329055.58 2829481.60 2188653.87 2824671.00 711238.23 2136667.86 822345.56 2184627.52 2182964.41 587610.61 685571.29 4399138.88 6629314.09 258417.17 7188856.56 7595436.19 1986603.94 678340.91 3007176.65 337927.33 7228573.69 5127157.13 536548.25
Tensyuic acid E
11634.25 14481.76 9701.72 9440.16 10742.04 13021.89 13641.58 13562.54 12701.38 9482.47 9613.84 9699.50 8610.56 635019.43 468009.47 565448.87 596859.41 624676.90 750031.76 605326.13 539770.36 551500.93 554311.32 586479.40 514636.48 435523.29
Testolate
9695.51 23088.08 20826.06 7669.25 9957.82 18242.88 15630.49 10667.99 11620.86 7555.38 9882.92 9619.36 7160.68 1471535.86 1697449.46 1632383.72 1632676.81 1905055.61 1710405.72 1931798.18 1580243.17 1822935.05 1672311.28 1910458.81 1765020.38 1630525.52
Testolate_
13788.56 10678.16 11654.15 9585.22 10850.47 20024.28 17323.47 14838.77 14562.95 9724.68 10409.77 11018.03 8604.48 532913.77 515442.76 537884.64 590670.21 639374.69 645118.41 638885.67 538068.99 590661.93 558088.51 622984.98 633241.45 518162.50
Testosterone glucuronide
72994.42 140698.29 279073.02 95525.17 227419.93 269757.60 221455.61 142215.13 324735.85 124748.91 227446.29 216675.68 120911.43 1601290.04 1644336.51 1780934.82 1574460.41 1824455.26 1871354.35 1804226.16 1610969.89 1826559.11 1998480.36 1763989.65 1759011.61 1750114.42
Testosterone glucuronide_
61417.87 79122.17 118832.39 46733.91 95530.76 210008.47 155525.97 92833.00 179042.94 53907.46 127128.35 114851.52 50719.66 835760.89 948325.74 1060541.21 946887.69 1134639.09 979675.09 901599.39 843684.17 1069856.56 1116556.74 1100972.08 989035.23 1069016.09
Testosterone sulfate
56224.54 36159.21 214600.03 36394.28 34414.93 23782.03 58878.35 11213.52 10493.10 7504.75 7387.54 7444.58 6857.68 9123719.43 9424430.28 9925864.98 8844526.18 10184308.20 11287287.05 11771292.34 9650451.03 11929118.06 14432181.07 13543589.22 10889007.83 8893217.31
Tetradecanedioicacid
14293.16 9725.99 11770.04 10106.26 20106.17 17676.83 20967.34 15195.35 15683.63 9606.84 16284.37 9876.54 7964.84 479924.01 483598.11 517062.35 439262.82 763141.13 654198.61 849010.63 548281.41 519785.95 569581.01 840826.21 535676.59 544684.77
Tetrahydro-2,5-furan-diacetic acid
11963.24 139710.47 71954.56 14815.09 23901.69 11928.04 31768.77 18149.67 18106.67 23276.32 18924.20 24491.01 9411.92 596219.27 978122.89 1109065.68 749839.75 2060715.70 1308833.58 874393.90 871597.34 712564.53 757710.72 631555.60 848067.53 652481.10
Tetrahydroaldosterone-3-glucuronide
55071.45 55980.47 230879.53 48281.28 46734.20 20289.08 12805.40 11543.06 12282.59 7860.51 7462.56 7765.91 7060.71 12820095.42 11837664.86 13109197.66 11256588.57 13702581.59 15961444.48 12561671.90 11727556.65 12403948.96 13393996.54 11964953.32 13888097.45 13022659.55
THEOPHYLLINE
13454.59 17851.33 73133.54 18618.05 48235.42 13210.54 16955.92 29816.51 13441.52 13544.05 15878.72 22674.77 25536.30 2941732.87 3144163.70 3654750.04 3082789.85 3913517.85 2764750.17 3840362.12 3167324.74 3228845.26 2697841.21 3843124.82 3036862.37 2381633.34
Thiamphenicol
13392.75 11110.83 13371.12 10610.95 12052.64 17179.27 16561.55 15001.73 13737.58 10193.86 10157.83 10611.22 9396.54 1106437.12 1336713.86 1422707.20 1769636.93 1701433.05 1661445.51 2217019.70 1740998.03 1426756.95 1643116.13 1912851.00 1377446.62 1233636.03
Thielavin W
6530.41 5298.39 5302.81 5069.43 5778.62 7082.60 7327.89 7193.03 6812.08 5005.05 5395.97 5331.18 4944.19 78924.88 98685.03 133423.84 64893.26 100438.57 86282.70 178089.57 165184.72 114028.38 104606.61 76794.64 88956.96 102837.39
Thiodipropionic acid
15441.91 10974.77 23568.66 9997.92 10854.58 18112.54 20106.21 18542.06 17210.97 12705.01 11898.06 11660.70 11072.36 1661822.83 1785761.41 3623494.59 2821869.89 3879995.14 3231600.49 2671286.91 2126605.37 2065932.50 1855447.21 1559758.27 2270658.14 1697966.19
THREITOL
118140.85 103759.23 89107.99 94186.04 107010.34 147177.78 143701.36 127955.68 124079.78 90720.59 99191.58 99600.22 80706.52 974222.99 1351782.62 1435390.35 1328713.38 1402696.30 1624503.50 1703934.98 1098409.44 1163709.35 1196449.14 1061407.72 1279708.44 1256819.12
Threonic acid
671208.81 563759.94 2861372.01 583705.61 371613.27 311475.93 130390.07 127088.09 114198.44 81789.80 89426.87 230430.20 83143.91 52829559.33 60007376.26 62937494.30 58814847.21 60732576.17 62579668.34 76591893.12 64899151.48 63085413.28 62572739.99 61392011.03 60262341.27 54956104.79
threonylphenylalanine
9122.96 10639.69 28673.81 7287.55 7919.30 9858.97 10253.59 9934.74 9671.14 7176.08 7615.41 7571.58 6789.84 3031289.07 2509652.47 3992831.37 3396288.13 3637940.27 4326255.97 3696712.30 2858875.02 2827752.58 3416529.64 2806394.53 3149422.01 2847892.06
Thymidine 3^,5^-cyclicmonophosphate (cTMP)
8407.09 7445.49 7259.51 6707.48 7915.15 21462.91 10242.91 9587.05 9202.41 6644.81 7094.94 7194.72 6240.20 103809.17 126271.06 82766.60 94150.82 100966.98 116451.44 87483.05 117893.25 124142.09 146427.59 128780.11 100660.87 94849.20
thymol sulfate
11355.88 19967.52 27322.03 8736.83 10916.64 18341.33 16314.94 12159.71 12726.79 8593.91 10034.99 10072.12 7587.85 5338695.15 3756287.81 6344715.81 4097935.13 5940704.77 6130563.56 6939671.64 4975476.43 6419372.59 6493119.35 6225126.26 5828918.48 4362571.88
TMC-2B
15369.62 9155.66 11650.35 9494.93 10094.77 18341.82 22919.13 14823.27 16779.04 10027.68 9934.76 9751.84 8069.21 599496.41 488334.27 548706.72 475307.83 651461.41 722576.99 524269.03 487873.60 477465.18 602266.76 580222.19 683369.40 542604.08
trans-2-Hexenedioic acid
87890.19 181688.62 257313.12 220219.89 251877.01 173912.12 196395.71 197397.83 287159.34 154490.70 123167.31 159321.85 195794.45 1007935.75 947392.27 1521677.96 1383935.26 1692708.60 2139489.58 1358772.92 1149223.38 1155445.95 1024278.57 901684.18 1077115.77 957068.41
Trans-7,9-dihydroxy-3-methyl-8-oxo-dodecan-4-olide
12884.34 12826.17 16116.99 9362.04 12094.05 17994.79 16973.24 13136.10 12838.46 15132.96 12006.76 10710.31 8216.79 676815.00 591393.77 706507.05 646862.88 808619.82 960487.79 644468.26 641319.41 627439.93 804833.41 704429.22 785103.57 649789.11
TRANS-ACONITATE
544291.07 1002704.03 3659733.93 581338.49 445997.18 310001.65 93805.34 68362.39 318277.05 81488.52 94220.65 345822.67 41483.28 73424030.74 63059381.51 88675074.89 85516968.43 98378959.86 112689690.83 93652133.96 99643107.53 67316496.24 78092751.12 67771080.70 72808067.95 65883315.46
trans-isoeugenol-O-glucuronide
9949.80 8295.84 12219.76 7731.15 8663.13 10975.46 11295.58 11176.01 9923.86 7827.76 7537.60 7839.07 7167.73 1110546.49 1228603.43 1491448.52 1162455.96 1647393.48 2265170.19 1450017.00 1421454.86 1272275.66 2759033.98 1218275.01 1705465.16 1583009.90
Traumatic acid
290937.05 123526.75 294329.53 102049.85 131975.28 566574.74 795047.24 664587.90 771587.00 570960.71 398149.75 597198.17 360093.82 2051936.24 1658215.71 1676208.99 1662056.32 2014464.51 2279021.71 1688432.70 1933644.92 2145045.99 2553375.34 2822321.77 2362086.72 1974921.59
Traumatin
17726.98 21165.65 25772.05 11579.89 43425.36 14701.62 19571.15 13497.94 22518.16 16145.18 26051.98 17610.95 17247.11 1099494.02 923195.04 930619.18 966887.74 1088116.67 1236762.68 1242357.89 1195175.09 1086873.50 1045284.77 1266961.76 1175357.44 870118.54
TREHALOSE
579550.24 151367.88 215784.26 66930.84 156411.48 554708.01 175651.79 79513.13 81098.41 157424.84 695670.01 261327.60 103621.49 3359056.67 3457388.49 3136861.24 2893279.93 3556310.32 5466857.81 3469187.92 3363130.95 2666470.56 3568797.88 2420766.15 2906133.42 2982031.83
Triadimefon
22318.81 14967.74 21957.23 14003.83 9583.76 21553.31 21653.20 21483.27 21388.37 14134.36 15348.22 17934.40 14585.70 473179.44 317705.20 353125.82 289539.72 383934.78 442273.12 365882.62 453921.19 364442.67 411681.91 291808.99 325890.39 360815.78
Trichophycin C
10491.78 7894.73 8326.69 8405.12 9539.07 10944.71 11069.77 11412.39 11069.02 7666.51 8304.69 8750.36 8088.06 874736.40 921519.61 1264126.52 909898.31 1300250.33 2163346.02 1254821.14 1334000.90 658879.30 1069142.31 558784.74 808979.67 1205461.26
Trichurusin D
13341.62 10786.25 22427.44 10244.44 10736.49 16055.97 21040.40 23030.56 17193.08 15989.39 11371.71 14462.73 8082.20 4450395.88 4572640.39 5042613.84 3737881.26 6290552.17 5590324.59 4721882.78 3551621.80 4126727.66 5476736.73 6149278.48 5470641.04 4676783.17
Triclosan glucuronide
10643.31 9446.58 13014.57 8759.60 12585.08 19963.12 19979.69 11904.99 15936.14 8453.10 10383.46 9922.04 7819.33 143730.87 223745.14 187644.97 256307.39 203730.12 250868.30 278184.96 139362.72 263907.98 258099.22 220282.95 213180.56 263763.90
TRIETHYLENEGLYCOLDIACETATE
10829.20 24631.13 28489.03 8623.38 23840.91 18957.70 13162.77 11926.27 11249.99 7884.07 9124.94 11951.94 8284.09 313163.32 365833.18 432341.31 463375.11 635707.56 589460.85 452810.45 349844.52 346971.12 436215.00 804769.65 397435.88 343186.90
Trimetaphosphate
10757.73 4198.24 6394.53 4645.19 5104.93 10754.18 9030.11 8694.72 7214.83 6551.77 6154.76 5960.63 7336.75 2331205.85 2689935.34 2741741.64 2573977.18 2454438.54 2721276.05 2281491.46 2484173.08 1889665.61 2313631.39 1683503.36 2489357.16 2637626.95
Tritiozine
10330.75 8881.34 8153.24 8282.17 9414.46 11890.47 12060.84 12001.63 11261.92 8372.07 8520.80 8625.16 7923.02 218691.88 292747.01 374322.44 249742.08 337342.39 418071.99 394305.50 261924.03 256070.45 389300.93 223399.52 313160.32 429843.17
TRYPTOPHAN
67844.37 66906.12 264323.79 31481.48 40414.03 37673.88 15722.89 15057.28 41427.55 10666.18 21764.71 52607.02 11595.14 12577575.05 19331594.09 21435238.04 14511642.65 20230006.87 20597541.61 20836971.65 16515998.12 18361443.96 15405216.73 16652284.80 20594098.52 14120612.07
Tryptophan 2-C-mannoside
18238.97 22740.92 73968.41 11255.77 12203.42 20238.27 22801.36 21673.82 19808.30 14965.53 14079.69 14173.78 13509.63 2458194.52 3249656.05 3687415.22 2634795.21 3763163.72 3995203.82 3982305.97 2612749.06 2931742.03 2405065.65 2465532.73 3124271.55 2443429.59
Tuberonicacidglucoside
12223.30 18637.23 71881.40 10817.49 17277.94 15237.46 15060.45 13896.42 12825.91 9589.70 9742.99 25199.44 8871.02 4958055.19 4287275.69 5066410.85 5103216.08 5201776.04 6039981.13 4516024.59 4166160.01 4235003.73 4789130.68 4488828.14 5020570.79 4486084.46
Turbomycin A
9159.23 8206.74 8100.97 7417.59 8629.47 12258.58 11741.02 10382.43 9864.58 7166.12 7378.49 7373.26 6807.05 168539.04 119601.07 153297.80 149624.35 181751.32 232704.03 127413.85 135305.17 148504.76 172792.78 163516.44 189442.21 176499.45
Turkesterone
115326.15 161565.13 270452.73 107835.10 211428.72 380406.14 284389.33 192383.80 372126.30 132881.48 236904.58 221415.85 119828.23 275548.62 316532.61 290374.07 277613.65 282227.35 340905.67 361932.06 337765.74 359369.43 339422.48 370777.40 348392.55 336279.57
Tyramine-O-sulfate
15183.29 10487.23 35965.42 16579.42 19391.74 15405.92 16937.64 16323.98 15621.86 11641.01 11113.10 12380.09 9595.88 621454.98 904969.03 884279.69 796892.77 939012.62 1286458.89 1141492.30 651873.97 1080691.99 757631.02 993627.89 835384.83 689772.55
TYROSINE
74566.58 21760.16 54624.33 61788.84 38765.96 28457.80 13706.75 13552.51 21647.45 52541.84 21965.91 22416.77 8471.67 1433786.61 1689363.70 1902221.67 1396874.34 1926874.62 2359834.41 2096388.08 1458355.89 1617702.44 1321924.00 1371445.02 1813271.24 1401930.84
Tyrosol
9983.42 8349.19 26540.74 8236.99 11721.66 10059.41 10433.73 10994.81 10277.72 7268.31 7643.62 8240.05 7637.09 1141630.30 1201001.52 1229913.06 1146023.47 1227680.34 1488056.54 1488372.96 1170685.52 1319311.27 1315157.29 1159580.35 1190951.32 1156617.24
Tyrosol 4-sulfate
12433.97 38816.00 49166.94 9477.89 11018.61 10988.59 10726.64 11824.60 11293.90 7904.24 8781.72 8970.45 8086.87 7713491.21 7730503.71 8989031.93 7247698.26 9469710.52 12052647.87 11030047.33 9233057.52 9567154.71 9438653.24 9406988.93 8578333.07 6832752.64
Tyrosol 4-sulfate_
10430.01 8912.90 47014.51 7574.35 8298.19 10096.20 10625.93 10617.71 10887.96 7382.42 7820.04 8088.94 7557.51 4813475.05 5271630.75 5169574.17 4098043.01 5160366.12 7328800.34 7230487.43 5156644.98 5131435.10 6020296.31 4390257.57 4740751.81 4093579.79
Tyrosol glucuronide
12049.77 23516.11 23645.41 9761.35 10978.80 13306.68 14002.68 13775.93 12967.35 9665.06 10165.38 10430.15 9680.00 1512027.88 1533452.56 2007704.20 1620839.61 1974643.03 2506738.72 1664194.31 1557123.35 1537245.90 1645884.10 1490597.81 1677659.23 1793569.68
Tyrosol glucuronide_
13269.10 14168.81 21026.75 10407.47 13065.43 18679.79 15090.68 14297.33 14363.14 9893.66 11929.24 12490.39 9981.01 590357.92 622614.41 629224.92 536609.39 655460.64 820160.68 655499.44 584762.61 583790.47 681621.35 476941.05 569851.55 565186.47
Ubiquinol-2
9695.51 23088.08 20826.06 7669.25 9957.82 18242.88 15630.49 10667.99 11620.86 7555.38 9882.92 9619.36 7160.68 1471535.86 1697449.46 1632383.72 1632676.81 1905055.61 1710405.72 1931798.18 1580243.17 1822935.05 1672311.28 1910458.81 1765020.38 1630525.52
Ubiquinol-2_
13788.56 10678.16 11654.15 9585.22 10850.47 20024.28 17323.47 14838.77 14562.95 9724.68 10409.77 11018.03 8604.48 532913.77 515442.76 537884.64 590670.21 639374.69 645118.41 638885.67 538068.99 590661.93 558088.51 622984.98 633241.45 518162.50
Ubiquinone-1(CoQ1)
9570.54 8279.37 12166.81 9110.97 10403.33 12888.67 12268.27 10848.66 10307.56 7591.61 7709.83 7658.04 7112.73 833086.08 880567.44 994409.92 787154.92 1031454.36 938286.38 967304.34 1026171.84 897635.39 1020379.47 1039533.84 986979.86 799490.33
UDP-2-acetamido-4-dehydro-2,6-dideoxyglucose
10871.37 9485.38 9276.75 8839.00 9977.31 11906.48 12300.58 12434.44 11928.55 8835.74 9016.60 9731.82 8178.29 1688265.31 794408.18 1685318.86 2053895.25 1866755.84 1622294.28 1067069.94 1278879.98 1091282.17 1260657.96 1695611.11 2131748.85 1841318.80
Umbelliferone
11387.72 9434.68 44903.90 15325.17 37088.07 9329.65 9756.85 9350.94 9044.78 6541.16 7034.85 7693.75 7271.77 1439916.42 1372386.27 1448045.92 1366996.22 1807542.07 1680290.46 2782130.28 1283382.75 1613016.06 1855557.57 1814598.20 1492131.31 1682292.19
Umbelliferone glucuronide
12058.11 7410.79 20910.73 9810.18 10556.19 11701.71 12682.82 12156.15 12064.47 8575.71 8378.75 9311.77 9353.19 463893.19 998057.56 947905.75 572590.39 640093.07 896789.38 774139.25 496056.73 570666.87 712644.00 497710.12 688444.66 1419071.96
Undecanedioic acid
98199.24 45165.99 44496.03 29124.21 76419.37 201549.03 63491.61 63535.31 66871.63 87341.16 134644.73 64236.55 41486.48 256896.00 217806.85 260466.51 305667.05 353805.74 344913.67 272925.30 273499.72 279935.16 331802.77 334587.66 328363.96 256360.50
URACIL
103873.67 184782.26 185810.84 211511.92 201901.80 115680.36 141382.21 160102.37 169349.98 152642.41 153379.30 163924.55 193665.26 1649094.18 1889137.81 2015918.45 1942659.58 2502274.35 2307288.17 2567004.13 2265446.71 2266714.03 2255621.11 2218268.53 1855717.00 1819091.73
URATE
7886995.55 1902438.01 9940478.79 3276352.27 1508577.32 2566611.41 21611.66 23329.54 1846636.69 13439.14 368854.40 2676520.77 15839.20 134652663.94 127878950.89 123882951.96 129426486.77 124436975.04 142287234.69 166915963.42 127846393.42 142240467.68 128460713.58 141877933.31 136993479.97 121343946.61
Ureidoisobutyric acid
135647.85 9240.23 16417.21 73148.77 54549.12 53048.63 13702.36 13691.74 14086.28 9661.06 10335.05 32073.77 9745.56 1016747.68 1140803.06 987061.19 726419.81 953687.81 1020992.30 1541492.74 853709.40 1305516.31 949888.17 1080646.91 917975.29 1003959.78
Urobilin
11198.37 9099.99 11988.44 8925.39 12171.29 18090.64 19885.87 12856.23 14175.52 10028.59 9124.36 9242.33 7608.58 213787.93 227262.46 209616.16 212817.13 239693.53 253309.98 205408.43 247614.71 281245.59 233184.36 265848.80 252482.84 234479.89
Urobilinogen
11198.37 9099.99 11988.44 8925.39 12171.29 18090.64 19885.87 12856.23 14175.52 10028.59 9124.36 9242.33 7608.58 213787.93 227262.46 209616.16 212817.13 239693.53 253309.98 205408.43 247614.71 281245.59 233184.36 265848.80 252482.84 234479.89
UROCANATE
185913.69 41918.80 134248.09 103248.05 117876.42 205457.05 97697.45 34821.84 150698.84 41205.05 218429.63 250009.50 23327.29 1150540.93 1302755.62 1402613.55 1350225.80 1508972.29 1400330.81 1537670.93 1299455.97 1257495.42 1228647.28 1356909.16 1266091.19 1091291.99
Urocortisone
11960.28 9515.62 11538.30 9377.10 9443.27 16437.40 18907.87 14332.53 14618.73 9256.87 9522.64 9259.11 7671.33 71181.85 68661.10 59213.45 54331.28 71459.13 71204.79 122276.40 87363.60 99164.47 80854.37 118080.33 68720.05 65593.07
Urolithin A
9188.68 8361.79 8551.51 7345.87 8746.15 12346.62 12416.36 10283.15 9951.15 7318.84 8014.68 7972.82 6720.01 144957.87 246807.77 248398.19 235850.96 309027.37 229628.56 325878.80 931706.35 940838.87 240028.22 196646.81 576521.08 367929.71
Urolithin a 3-sulfate
11254.69 6362.77 7941.98 8693.66 9677.13 11071.83 12278.24 11428.63 11008.81 8033.80 7183.66 8226.07 8284.46 167208.22 180007.13 295388.47 266587.58 344103.48 152088.36 378629.63 148272.87 257253.11 144464.50 208054.66 235133.93 201142.26
Usneaxanthone D
11730.98 9607.57 12608.32 8874.98 11572.05 18999.23 20536.40 12795.84 15754.15 9175.62 9815.32 9779.31 7758.69 45959.88 73834.71 47887.47 61451.25 52893.07 38974.96 49827.30 79439.78 85009.74 84397.45 65735.34 52287.60 66152.80
Ustiloxin D
9719.30 7879.57 17192.85 7791.66 8757.16 12385.54 12276.55 10715.69 10008.13 7489.68 7215.36 7584.19 6932.22 787877.14 740386.76 750694.22 642591.40 729704.82 1073747.86 717659.44 645381.96 814994.56 820687.53 726115.24 763518.48 771663.20
Valerylglycine
75847.41 94981.85 110492.23 91448.46 106055.04 75348.67 94894.71 50242.36 56354.95 42203.05 46675.87 52520.96 69580.56 3430413.10 3715118.01 3928080.23 2822559.38 3668349.34 5069299.87 4595429.61 3359787.87 3565362.70 3280560.08 3476634.22 3643352.47 3024134.59
Valproic acid glucuronide
10700.03 34340.99 10089.22 8623.48 9863.49 34095.97 13860.87 12144.29 11091.74 8382.38 8482.62 8938.48 7865.04 1904500.66 1788721.78 2098128.48 1639197.80 2224389.63 2492235.51 1730520.25 1726466.16 1630919.04 1988616.69 1938753.41 2144299.95 1868467.57
Valyl-4-hydroxyproline
14062.09 8957.05 10180.44 11564.46 12570.38 13207.94 14744.63 14571.00 13863.31 9391.62 9626.26 11033.83 10898.54 328362.55 440838.08 434826.32 339443.51 387992.16 510165.41 447334.26 344695.29 334361.82 335632.18 328333.40 376833.57 299580.00
Vanillactic acid
16946.74 36938.47 121258.61 24335.62 23610.90 14331.66 14611.30 14718.89 14582.25 37652.28 16852.77 11692.43 11492.19 1013481.39 2015979.56 1978042.31 1499186.98 1932412.55 2484299.47 2212165.53 1849720.77 1272982.23 1694872.83 1813716.66 1828675.47 1460798.47
Vanillic acid 4-O-glucuronide
25222.46 16876.74 15236.01 16206.13 17418.31 27077.11 30363.83 29207.58 26160.44 21005.19 18581.52 19196.42 18380.83 970475.70 2061375.19 3519561.66 1192971.74 2553127.67 3193671.26 1446870.12 1509738.85 1168096.52 978060.32 1241880.51 1839132.50 1186097.68
Vanillic acid 4-O-sulfate
13195.94 8321.12 9553.37 10852.14 11876.58 12470.68 13836.44 13673.50 13009.40 8813.14 9057.31 10354.20 10227.24 652813.48 790645.60 791495.50 613161.77 805556.81 1038677.36 982127.28 921146.61 755295.04 774959.64 848154.56 719999.75 556175.29
Vanilloylglycine
11287.94 57477.22 121734.06 15293.40 11214.69 20889.91 11599.98 11747.75 11177.18 7684.14 7764.28 8895.93 8863.31 3234902.46 7816273.34 9218471.38 3995811.27 6540781.48 8810889.11 4528464.53 5460696.63 3468057.36 4489090.29 3649905.32 4662836.10 4647298.67
Vanilpyruvic acid
9482.37 8290.59 7550.18 7796.42 8840.50 11169.92 11410.74 11310.63 10462.32 7624.34 7947.44 7840.19 7463.11 268704.74 255252.89 323902.69 293795.49 343698.03 363257.49 260004.42 276929.02 260438.82 293007.38 227694.71 267447.75 259794.31
Vanylglycol
10779.94 13288.13 25934.92 12465.79 19551.44 14406.88 12694.08 12647.69 12059.82 7969.81 11219.17 12559.94 11686.56 674394.02 604106.88 905504.51 719644.93 866358.70 1222223.64 824552.88 681901.59 609129.89 762897.42 629048.22 738113.37 601107.76
Virescenoside R3
14285.04 13011.77 18037.58 11487.42 17839.85 27665.50 26631.17 16547.41 23954.62 11867.86 17715.31 14653.86 10357.72 121763.21 108928.01 147463.56 126189.14 149616.11 137861.83 127201.03 148941.31 148398.26 147206.98 145691.02 139668.19 158438.13
Virescenoside Z11
12974.62 11093.35 14302.32 10506.22 12976.46 20919.41 21694.84 14578.79 16675.13 11169.34 11268.56 11208.01 8833.21 360062.36 371200.59 374168.66 348842.26 416602.97 419629.37 408232.88 390190.04 365287.41 434337.43 435418.96 447029.68 436942.82
Virescenoside Z6
22992.46 20380.17 28461.65 17352.52 43267.94 53431.01 40998.47 26504.38 40388.56 20478.61 22712.04 20654.91 14660.03 418208.31 480311.38 504988.28 422098.51 504307.56 524086.92 524806.43 471787.64 621670.72 704970.90 598363.79 625331.15 473579.96
Viridobrunnine A
10613.52 7935.17 10195.20 8052.70 8579.67 15082.05 15951.26 12230.87 11442.76 11083.53 7326.97 7742.65 6689.02 127466.18 162659.04 154025.61 159699.68 209499.96 141248.75 83138.25 137954.98 166880.92 171362.09 231139.04 217980.08 229105.83
WS-9659 B
9267.95 7688.83 7945.78 7302.81 8302.18 11619.10 11300.68 10381.38 9357.30 6905.71 7029.35 7343.10 6502.52 589252.83 602663.02 697378.71 696973.73 732250.06 778515.94 702868.28 643551.25 769845.03 858155.63 950687.35 779506.46 673709.33
XANTHINE
44665.10 19631.83 43095.50 72271.30 8859.24 37542.18 13209.56 12750.11 42267.42 9243.74 9304.93 10212.40 7840.73 1065289.40 1219079.77 1305719.15 1000846.33 1354688.43 1538875.45 1807150.22 1358031.73 1637879.05 1270242.60 1138575.20 1333818.20 1031331.13
XANTHOSINE
18530.23 12444.39 12388.91 12728.04 14606.62 20709.73 22634.36 22255.76 19474.68 15453.10 13282.81 14846.53 14262.80 496354.89 672232.13 860078.43 525613.37 849199.57 838016.41 699010.55 535173.98 613343.92 520216.33 499762.34 603800.28 505245.50
XANTHURENATE
13498.71 8094.76 9372.79 10584.61 11751.98 12886.53 14147.51 13733.99 13095.66 9425.30 8667.36 9861.88 10128.40 316931.92 612454.15 606238.88 408643.05 579265.54 627004.67 522754.52 454751.16 462024.68 430746.20 424043.63 493937.26 351179.31
Xialenone C
8984.18 7905.50 9718.09 7174.57 8245.35 11010.96 10772.27 10166.73 9237.72 6798.42 7345.40 7397.50 6566.38 1009316.81 824015.60 1089617.93 1005027.85 1285823.87 1359776.75 979113.37 973737.69 989291.78 1160077.05 852239.26 996390.47 902778.79
Xylaric acid A
18759.57 14206.17 22498.42 14079.87 16754.74 23715.62 22852.11 20364.17 19043.87 18616.95 19922.56 13639.05 13158.01 1470626.15 1229899.25 1573932.09 1361786.92 1889286.38 1831205.17 1329319.59 1337001.33 1340493.62 1676866.09 1581731.33 1677798.24 1507565.91
Xylaric acid B
21897.71 24570.76 92457.02 10801.43 12492.70 15672.65 15487.73 13843.64 12844.85 9382.53 9062.00 9563.80 8499.38 5062723.10 4553594.49 5413279.82 4799886.71 5652758.59 6342472.15 4708466.65 3933150.02 5075310.88 5957408.15 5132379.02 5607175.13 5132515.96
Xylariolide B
15397.49 13086.11 14667.79 11469.68 13688.61 20250.70 18150.45 16525.87 15921.39 11405.27 12196.50 12665.45 10811.23 852538.63 611048.15 919332.99 796828.25 997048.61 1228586.73 874181.61 793159.35 753748.16 924314.62 754548.74 853192.87 726276.15
Xylariolide C
15397.49 13086.11 14667.79 11469.68 13688.61 20250.70 18150.45 16525.87 15921.39 11405.27 12196.50 12665.45 10811.23 852538.63 611048.15 919332.99 796828.25 997048.61 1228586.73 874181.61 793159.35 753748.16 924314.62 754548.74 853192.87 726276.15
Xylonic acid
370132.14 906724.30 8147909.28 219387.41 9017391.73 8180561.32 5397136.12 308355.27 12710847.75 309054.47 9874878.29 7788224.86 342468.82 788706.82 10153358.87 20647994.22 604418.14 19130150.66 15500577.52 2772761.23 1517257.87 7867442.93 288993.65 15573106.83 9733757.96 598389.32
(Z)-4-Heptenal
17184.37 8568.18 15873.56 7584.48 19529.18 85932.36 15243.99 10117.84 11949.73 9107.22 25177.89 13568.05 6778.39 1047220.21 937892.38 1134881.27 1204612.37 1414711.34 1394890.82 1043323.58 995018.03 971225.09 1175932.13 931194.93 1073752.98 1009051.56
Zizybeoside II
11076.67 8528.87 10732.92 7530.05 9705.35 18591.84 18078.96 11397.43 12544.60 10551.74 8210.23 8260.09 6403.43 245699.93 193514.52 484773.67 404717.06 436166.78 667656.51 166359.61 80246.97 160408.88 389763.03 603368.92 426281.47 401660.84
γ-L-glutamyl-L-leucine
13455.95 8403.13 12524.12 10741.54 12053.61 12342.96 12762.48 13764.63 13328.00 9052.04 9377.19 10793.70 10241.66 531111.93 615298.85 714505.41 484640.08 633805.20 962866.09 667681.56 501215.34 497528.67 488223.43 437023.28 632934.87 457131.61

Factors:

F1Sample source:Matrix | Batch:1
F2Sample source:Matrix | Batch:10
F3Sample source:Matrix | Batch:11
F4Sample source:Matrix | Batch:12
F5Sample source:Matrix | Batch:13
F6Sample source:Matrix | Batch:2
F7Sample source:Matrix | Batch:3
F8Sample source:Matrix | Batch:4
F9Sample source:Matrix | Batch:5
F10Sample source:Matrix | Batch:6
F11Sample source:Matrix | Batch:7
F12Sample source:Matrix | Batch:8
F13Sample source:Matrix | Batch:9
F14Sample source:Urine | Batch:1
F15Sample source:Urine | Batch:10
F16Sample source:Urine | Batch:11
F17Sample source:Urine | Batch:12
F18Sample source:Urine | Batch:13
F19Sample source:Urine | Batch:2
F20Sample source:Urine | Batch:3
F21Sample source:Urine | Batch:4
F22Sample source:Urine | Batch:5
F23Sample source:Urine | Batch:6
F24Sample source:Urine | Batch:7
F25Sample source:Urine | Batch:8
F26Sample source:Urine | Batch:9
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