Data for ST003032   

(Analysis AN004971): Average values per metabolite and experimental factor (Units:Peak Area)

Metabolite structureAll dataF1F2F3F4F5F6F7F8F9F10F11F12F13F14F15F16F17F18F19F20F21F22F23F24
11-ketoetiocholanolone glucuronide
15568789.23 15465515.31 15612092.46 15246632.62 15202607.23 15004084.00 19564314.28 15092306.15 14976088.54 15362810.62 15503379.15 15097125.85 15001652.23 15139643.23 15182226.77 15556171.62 15817053.54 14809949.77 15264496.77 15174629.00 14380616.46 14893895.46 19254149.18 14895593.08
11-ketoetiocholanolone sulfate
212695.67 228646.78 234028.44 232364.94 213089.22 193014.11 198897.28 232836.89 211965.44 196057.78 234716.71 215439.89 187147.10 204170.78 216147.12 220363.56 199503.10 214962.89 220710.11 216967.24 189619.00 203947.20 204992.07 208092.70
1,2,3-benzenetriol sulfate (1)
15258747.15 15179087.77 15431461.46 15230292.27 14469984.69 15301778.62 20709036.46 14750091.08 14163075.77 14356314.23 14985483.54 14592102.46 13792057.62 14553132.54 14302761.96 15057471.69 14992675.15 15533298.54 15036396.00 14644715.38 14778504.38 14508282.92 20580404.72 15429389.23
1,2,3-benzenetriol sulfate (2)
180246501.54 168510014.46 176621200.00 169469609.54 170826539.08 173801708.00 199075927.18 173332543.38 167719654.77 160280872.00 158809388.00 169557078.62 160519498.46 165288544.92 158250289.23 159509019.38 181193087.69 170568030.77 180665892.62 169734082.15 167517915.38 170488208.92 191701417.33 162363225.54
12-dehydrocholate
235431.88 184076.50 217480.57 217955.73 207099.38 215013.38 193621.79 207150.00 186542.40 218506.29 199158.56 209413.19 198741.12 198596.38 193315.72 191746.43 240636.83 175090.11 211077.12 193126.93 159594.89 212749.25 189364.71 213258.62
1,3,7-trimethylurate
24854998.31 34107209.46 28351213.77 29549143.96 30244595.69 31767950.77 36224430.59 32918656.69 28977103.85 25700321.62 32476987.23 34987809.46 30179097.31 29702409.15 33257590.00 33788669.62 26216660.00 28345864.08 27116840.38 27194007.15 30822863.69 26950135.85 36917795.18 28660431.46
1,3-dimethylurate
14285285.91 13834304.67 15697701.00 15240918.96 15371560.73 15059931.25 15723567.55 15717598.64 14763365.36 16608399.18 15167860.17 15770472.76 13993671.64 14004825.00 15274313.50 16551723.36 15345395.10 15493419.67 14283262.91 14215557.87 14390667.27 14058846.75 15332781.61 14864987.50
1,5-anhydroglucitol (1,5-AG)
7147431.15 6411287.67 7680319.85 7499095.38 7166430.23 6657874.00 8239534.38 6112565.31 6315904.77 6644167.08 6162458.85 5486824.50 5272304.54 5529467.77 5513529.54 6613851.62 6169593.15 6442542.62 6164826.54 6183830.23 6577790.23 6853810.77 7211587.26 6649528.54
16a-hydroxy DHEA 3-sulfate
6224634.31 5984097.77 6311986.23 5963364.81 5900917.46 5747835.54 7335850.79 6028863.85 5787442.23 5992222.92 5637563.46 5686268.92 5691851.15 5821836.38 5707790.35 5911438.77 5969790.08 5601567.15 6030629.46 5773722.42 5417048.31 5865528.46 7286209.69 5785437.62
1,6-anhydroglucose
9160746.73 11297985.11 8148509.25 9180320.17 9188616.10 9024985.58 11318336.09 8587881.64 10383031.00 10819361.00 9822349.33 10164697.95 10600490.55 10660303.91 10495388.95 10680328.82 12376681.10 13271816.42 11873587.64 11295495.12 11051403.83 11177388.17 12268221.47 12541073.23
17alpha-hydroxypregnanolone glucuronide
5825268.46 6392402.55 6270729.45 5921051.71 7011166.91 6577889.67 10494762.90 6078990.83 6088686.18 6563076.18 7002361.30 5957899.13 5530960.75 6577891.67 6017148.04 5843097.10 6813428.92 6483887.18 6321068.42 6044754.32 6421267.75 5723043.25 10939459.57 6787329.64
1,7-dimethylurate
88649818.77 88382858.38 90104530.38 87740519.23 85952680.46 86604912.31 112144727.13 87444858.62 87263556.62 86614472.38 87720824.15 88392224.62 84406736.85 87899131.08 85478073.77 88006543.92 87084787.08 88461194.62 87773677.15 86865111.81 84473390.46 85577922.00 110907675.87 88492694.15
1-methyl-beta-carboline-3-carboxylic acid
422093.71 363290.38 381275.62 425728.00 366831.38 371307.62 490684.71 379883.38 365556.12 336710.00 355086.43 387019.67 339188.62 330135.00 364033.00 336025.78 384361.86 330430.78 375758.86 411508.27 364374.57 403635.71 512014.86 324708.38
1-methylguanine
293386.50 261518.83 276315.00 288710.09 269929.55 279654.73 261374.86 298086.00 260556.73 229947.42 261711.45 279992.82 236422.45 242992.36 226469.73 244831.36 223867.00 220015.91 216868.27 255035.75 211022.75 217470.83 240051.74 243626.55
1-methylhistidine
10898976.15 10668748.85 10951004.92 10296522.00 10390590.15 10250821.54 12221993.08 10349090.00 10998687.46 10660849.15 10525713.00 10815993.12 10582075.85 10848404.00 10341448.38 10315846.15 10672151.54 10977011.54 10707333.31 10512043.88 10441814.62 10361008.46 12212080.13 10805937.38
1-methylxanthine
86253571.54 81485083.38 80233828.15 83389224.62 80182296.92 83336983.23 96301419.49 82926281.38 85816045.69 76925605.23 79567079.69 87213841.00 81670266.77 80010058.31 80040675.77 83101822.46 84079866.77 83039809.08 87059349.69 82282891.15 77700162.31 79997036.31 94985818.31 81109463.23
21-hydroxypregnenolone disulfate
4620458.23 4491079.46 4803490.46 4642939.62 4502375.54 4336769.62 5436022.62 4607391.92 4066867.46 4366232.15 4103368.62 3983082.96 4043524.00 4216695.15 4049490.04 4260264.85 4490655.31 4656511.85 4696645.23 4428650.50 4316179.00 4580954.46 5547464.18 4556848.15
2,3-dihydroxy-2-methylbutyrate
19970439.77 18830223.85 18926848.31 21969467.73 20987610.38 20974389.69 24364894.90 21125936.85 22677768.00 19788685.15 23040499.69 20791021.50 21133941.00 21526968.54 20058539.15 18458259.46 19336246.46 18930840.23 21984841.00 21344616.19 21640997.92 21728932.77 25051949.46 23087945.38
2,4,6-trihydroxybenzoate
1823264.69 1778166.77 1810841.77 1722250.08 1760102.77 1832991.15 1866270.26 1796310.92 1591490.77 1663595.62 1780123.58 1633099.64 1560711.00 1656459.46 1616393.96 1605312.31 1830803.33 1844062.92 1834255.25 1777616.96 1786443.58 1788281.75 1825633.13 1878777.75
2,4-dihydroxyhydrocinnamate
589239.40 445652.89 448230.30 528232.38 686389.22 482310.89 468580.19 607811.60 619620.00 445064.60 585492.33 713275.33 469231.56 677852.80 562676.72 599545.11 610927.50 460158.55 570889.55 607244.78 601455.80 437576.10 556412.97 450079.78
2,8-quinolinediol
244154.60 201532.17 229045.60 264398.27 192333.17 236222.80 168448.25 232724.00 268707.40 242085.80 201411.50 298423.45 241101.40 245995.20 218681.80 195246.83 215905.57 220529.67 252975.20 317395.64 197306.83 224271.33 166944.12 238043.40
2,8-quinolinediol sulfate
2471445.50 2427148.42 2510374.50 2478654.04 2418515.08 2401681.17 2570386.30 2465655.17 2404303.17 2454693.58 2428487.42 2479228.46 2443561.75 2506497.92 2478206.46 2420967.83 2550187.42 2463269.17 2460398.67 2489312.96 2373609.00 2516451.92 2591347.51 2452895.08
2-acetamidophenol sulfate
9326464.38 10130702.15 10419023.15 10583740.46 9478850.85 9086969.00 60897328.69 10902001.31 10601912.54 11046540.00 10493828.62 9965019.23 9720209.42 9900947.00 9649403.85 10509127.46 9839591.31 10445568.42 8724393.38 10834696.85 11189382.92 10605991.77 63328283.62 10668105.08
2-acetolactate
1103011.86 1036383.88 1001978.25 923824.62 826294.56 1040884.14 856251.55 960641.75 1155739.29 875960.67 1284203.00 1013694.12 1023115.25 943558.38 1006245.75 957704.25 877511.75 868088.33 1011172.86 959489.31 952925.43 994035.75 823833.55 968361.62
2-aminophenol sulfate
18378558.54 14747538.92 15918144.08 15541918.31 15932776.00 17173247.08 60865576.03 15491823.15 16242089.08 15980581.38 16911404.08 17880623.42 17724039.31 18002331.77 16720330.58 16214026.15 17388703.85 16558980.46 17949530.23 16068023.19 14046604.92 16578895.38 56981547.13 15042854.69
2-butenoylglycine
4607755.23 4711448.62 4741065.85 4677208.00 4576760.62 4623467.69 5798881.36 4556380.23 4655069.69 4789824.38 4558728.08 4692096.04 4605155.69 4706678.92 4582556.15 4706735.23 4702885.69 4834328.00 4624872.38 4659565.54 4686058.92 4646843.77 5864776.18 4720053.23
2^-deoxyguanosine
111078.18 127424.20 129648.56 127083.79 122987.30 119196.10 121124.74 110897.40 118841.33 126858.22 117552.89 113867.90 130328.00 127870.44 109233.86 106099.18 123989.00 116663.50 109138.00 118488.74 115863.40 120292.80 130006.90 124161.67
2-ethylphenylsulfate
183845.78 216288.50 166254.11 204903.00 181834.67 208897.38 182650.36 188116.78 172009.33 220897.75 233261.75 208656.47 189730.89 207820.56 189743.53 202571.50 168384.10 212798.38 193878.38 176972.21 180788.89 196981.22 168067.42 203605.88
2-hydroxy-3-methylvalerate
507952.83 526775.30 478599.75 505978.71 424238.17 451991.25 463366.43 478679.33 491828.67 402772.40 372264.55 390446.63 428231.70 437380.09 396044.50 418651.45 403811.12 365184.43 431875.50 371606.78 424159.00 380003.00 339917.19 399385.00
2-hydroxyacetaminophen sulfate*
16967788.31 18559473.46 18217569.85 17442502.42 17574059.46 17010303.69 64135685.67 17158386.23 17784333.38 17671596.77 18782427.31 18222679.46 17531462.69 17350244.77 18237397.92 18737160.54 18240053.15 17615033.77 17488085.31 18069151.35 18069548.38 17778059.31 75097426.21 18933050.92
2-hydroxyhippurate (salicylurate)
923602782.23 1013924745.62 975768489.00 952022022.46 931249907.62 966241274.62 1225691796.90 939779742.85 971696471.00 921620428.92 992028442.69 1024176934.04 982093717.46 979731345.62 949139101.04 1011918043.23 1005802482.54 992221514.54 989779005.92 977138708.96 1005059050.23 953747969.69 1262766800.82 996987697.69
2-hydroxyibuprofen
37891403.00 41483002.00 41357363.00 38782476.00 37944273.50 35599656.00 13343035.06 34804131.50 39512910.50 40001187.50 35029404.50 29241269.60 33986027.00 31846712.50 37615262.00 32408201.00 31507390.50 32863635.00 33506578.50 34553719.00 33582676.00 35864868.50 11900622.12 36980185.50
2-methoxyacetaminophen glucuronide*
19982089.50 22301994.50 20567250.00 19911234.85 20010309.60 20084320.70 66908917.52 17698959.82 21387327.00 17666605.91 20863883.40 20089767.10 21175140.20 20598686.90 19188977.43 21230740.20 19878231.91 18990027.27 20489146.00 19489284.00 20924564.60 20441892.00 68636270.06 20862519.40
2-methoxyacetaminophen sulfate*
24598345.11 27599101.00 28841609.75 23803707.26 31713252.86 25236416.00 42684151.00 25055164.00 29113120.25 25237255.67 25736436.33 30407324.06 29370037.50 32184948.00 27539815.12 27785170.33 29995941.50 26185275.00 29332496.00 27036902.28 22614393.70 26869764.67 41575708.16 22138071.70
2-methoxyresorcinol sulfate
40637301.46 39241197.62 40388924.92 38245180.23 39425973.92 39919641.85 47222387.46 38640828.00 38375729.85 37612773.92 38768871.85 39474073.35 38368099.15 39647933.38 38082870.92 38984965.77 39778104.77 40141346.38 40659834.00 39366675.88 38474873.38 38649250.31 47119472.36 38743245.00
2-methylbutyrylglycine
7483318.85 7258204.08 7342117.46 7127467.42 7179302.00 7364266.69 8077162.97 7295907.38 7323613.54 7374641.77 7134303.31 7464275.42 7345659.85 7474172.31 7150960.08 7079674.00 7561176.46 7351233.00 7568211.31 7336497.50 6970332.00 7347948.38 8080907.31 7186765.92
2-methylcitrate/homocitrate
26767637.46 26410257.08 27130603.00 26432514.38 26446475.08 26373048.62 28556354.05 26647119.08 26077491.00 25223658.69 25787061.15 26126503.81 25461219.23 25768786.69 25415067.46 24995126.46 26069227.23 25540393.46 25964719.54 25794201.27 24929706.00 25586803.85 27620371.59 25434099.46
2^-O-methyluridine
535462.38 537181.08 559925.23 541605.77 543264.62 536227.92 557835.56 555666.92 539507.77 496052.85 494127.85 535579.73 531077.54 535534.38 492701.27 502938.38 496374.31 527941.31 531564.23 496892.38 520808.85 495373.69 572426.82 509546.85
2-oxindole-3-acetate
8595943.62 8563224.31 8668283.85 8601297.88 8525120.15 8703727.62 11246974.49 8700264.85 8545073.38 8773665.38 8473990.23 8454606.54 8138909.00 8627675.15 8415718.46 8577901.38 8593330.77 8493707.69 8570430.85 8722430.08 8085080.62 8700003.62 11290544.54 8480220.77
2-oxoarginine*
5132745.15 5097946.31 5339621.31 4739387.38 5024236.85 5009785.00 5403831.31 4906971.54 4114199.23 4115539.15 4214887.38 4005978.31 4111612.77 4229066.77 4096635.00 4026955.46 3997579.69 4062677.92 4065820.77 3809013.85 3882104.31 3931458.46 4654903.41 3979539.69
3-(3-hydroxyphenyl)propionate
6664897.77 6675939.08 7005077.08 6566366.35 6819531.54 6586712.85 9985071.87 7018615.38 6814685.00 6740293.17 6683730.15 6988333.12 6494263.08 7214078.83 6838960.27 6475984.31 6627760.31 6781093.15 6544110.00 7048341.92 6401314.77 6776303.62 10093875.82 7024014.08
3-(3-hydroxyphenyl)propionate sulfate
7998422.62 8300668.69 8557542.00 7975753.65 8030344.00 7678899.46 8841080.85 8142480.85 7969161.31 8127886.62 8302247.54 7962193.81 8060554.85 8157214.54 8252468.42 8267490.54 8162339.00 8350028.08 7607910.54 8355955.42 8114317.38 8607495.38 9007604.33 8855212.85
3,4-dihydroxyphenylacetate
4063391.31 4026306.23 4092985.46 3695681.35 3617936.77 3733462.23 4756678.59 3719945.69 3781086.62 3503344.62 3694690.85 3602121.23 3535094.00 3651741.92 3792385.81 3500785.38 4084809.46 4043322.23 4095849.15 3604533.50 3869069.77 3934452.54 4773852.28 3892870.92
3,4-dihydroxyphenylacetate sulfate
7202214.38 7543870.54 7612460.08 7234740.42 7002666.23 6990736.85 7684264.95 7280250.15 6771662.85 7017276.77 7306594.77 6768689.73 6726752.92 6345084.46 6757822.69 6970753.62 7329593.62 7363860.15 7048228.77 7660320.50 7330789.62 7503522.77 7945966.51 7818696.69
3-(4-hydroxyphenyl)lactate
10371347.85 10108794.00 10702681.15 10566522.54 10900720.83 10152845.31 9626687.54 10219693.42 10100532.54 10162279.69 10259964.69 10352237.19 10081538.23 10461688.69 9743923.08 10208906.38 10349843.17 10212507.92 10082685.46 10089873.96 9924310.62 9800220.31 9642300.54 10337657.92
3,4-methyleneheptanoylcarnitine
671142.50 745625.67 680312.36 622634.57 681434.40 655048.30 956700.40 828511.89 761291.11 636940.20 647677.50 826145.68 781020.50 667182.10 681885.70 621765.60 709284.30 667713.09 698775.90 713370.95 678633.10 722553.11 1009841.15 693754.10
3,4-methylene heptanoylglycine
1019650.85 967982.46 1014545.08 1019204.08 957979.69 1040987.75 1457317.86 1067387.64 958662.46 1040172.33 942079.69 1025683.68 1003720.00 981571.46 957781.16 992175.38 989370.31 1043007.50 945185.69 950687.38 946464.69 944555.15 1479785.42 1015506.92
3,5-dihydroxybenzoic acid
3017426.42 3132389.50 2939891.00 3013491.46 2967327.58 2789751.58 3072811.68 2880831.58 2981251.50 2756052.33 2964584.08 2938759.83 2925405.92 2754051.58 2852230.21 2961646.83 3018006.50 2945765.08 3133200.58 2946983.56 2921325.92 3051698.82 3073199.78 3159694.25
3,7-dimethylurate
7508586.77 7037857.38 7252011.46 6999814.62 7140104.77 6941203.77 7725058.36 7207647.23 7101676.38 7077898.46 7080630.77 7134376.77 7112620.92 7232280.00 6838582.27 7068397.69 7204818.23 7072460.46 7194650.23 7064285.23 6709610.08 6737663.15 7646794.69 6872388.15
3-acetylphenol
445025.60 387395.17 382297.33 424636.80 374078.17 352250.86 616102.79 446289.50 511371.17 404064.14 677599.33 472009.08 461450.80 428085.50 427327.08 458546.43 673576.00 680220.38 645615.25 679523.53 661527.00 616671.00 719607.64 751311.86
3-acetylphenol sulfate
3785477.69 3701835.92 3883775.77 3750624.69 3651204.92 3701800.15 4140216.74 3821146.15 3794751.15 3651857.92 3797456.77 3777824.73 3691264.15 3712065.85 3751710.92 3749738.92 3809927.46 3775174.15 3818326.23 3832585.92 3666271.77 3751485.38 4165214.13 3864845.08
3alpha,21-dihydroxy-5beta-pregnane-11,20-dione 21-glucuronid...
1262286.77 1261264.23 1307144.38 1257305.19 1233777.15 1188318.23 1423206.67 1236427.08 1218169.85 1233886.62 1225799.54 1203025.73 1201863.62 1245125.77 1218457.00 1252532.77 1216396.54 1213757.38 1235743.54 1207185.15 1173730.08 1196553.00 1433850.90 1250011.00
3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF)
2118329.15 2223746.31 2251292.54 2084548.92 2060582.85 2068686.54 2409099.54 2194165.54 2174349.85 2070828.08 2153057.69 2192174.19 2030966.15 2139025.85 2210863.00 2134823.38 2091067.00 2015368.69 2015673.54 2118168.38 1923571.46 2091731.46 2418668.44 2185802.62
3-hydroxycinnamate
1951729.20 1933111.82 1942759.75 1971416.50 1860415.92 2061737.90 2596202.19 1886235.33 1839339.55 1863060.08 1832020.00 2050886.95 1723305.00 1892948.73 1918127.35 1877313.75 1927367.73 1916225.91 1538871.85 1847381.12 1968969.45 1975920.18 2751389.23 2050619.91
3-hydroxycinnamate sulfate
1864967.17 1872904.75 1923372.92 1795748.38 1851368.67 1773181.75 2034782.24 1811804.08 1895199.08 1935896.08 1925040.17 1927169.54 1908980.58 1890699.42 1928445.12 1846307.33 1927788.75 2005160.67 1939061.42 1919133.50 1929569.17 2036229.75 2085184.62 2027810.50
3-hydroxycotinine glucuronide
1070671.00 865727.00 503945.00 989258.00 580930.50 968334.00 718238.86 1074348.50 986274.00 1025996.00 1081057.50 1033655.00 901081.00 892139.00 664489.00 1076316.00 981098.00 936064.00 931571.00 957881.50 577833.00 947991.00 817096.40 1077558.00
3-hydroxyhexanoate
3105266.08 3124070.69 3107300.00 3094989.73 3035173.15 3012903.08 3141369.62 3065333.08 2990103.54 2936467.31 2979397.08 3030397.65 2954661.23 3090080.85 2950795.00 3070818.77 2723102.54 2585938.31 2689736.38 2685449.77 2558445.85 2884001.17 2880987.76 2666857.77
3-hydroxyhippurate
217682911.38 212024689.85 220698207.38 213937729.69 210226546.46 212941727.38 232826759.03 216515335.38 210712672.62 214353304.62 216184837.23 219773917.08 210675543.69 215037399.38 212661695.31 218928233.54 214772312.62 217698656.62 218280298.77 212904976.62 207418759.69 215303643.38 233464693.54 216102306.15
3-hydroxyindolin-2-one
825832.18 883235.25 873471.85 670388.67 871866.92 819030.92 1045590.68 671208.23 736359.18 891901.82 861614.58 779331.37 740317.67 832805.82 852413.09 802009.55 1088028.92 1251516.00 1265537.83 969928.73 1147518.83 1199168.58 1267613.27 1041011.42
3-hydroxyindolin-2-one sulfate
4721208.15 5234660.85 5578768.92 5150599.35 5177720.23 5070740.62 5467504.26 5235810.23 4914027.62 5265197.31 5399935.08 4682126.88 4779878.23 5022228.92 5149278.62 5170272.31 5247617.00 5175050.23 4922583.15 5081788.15 5228888.77 5258292.15 5664414.90 5437462.08
3-hydroxyphenylacetate sulfate
2121523.50 2074188.15 2071459.85 1964551.77 2024434.23 1889304.92 2092216.51 1935950.92 2075532.54 2308171.50 2093657.00 1994763.73 2206635.33 2054953.92 2061145.35 2159721.00 2085489.23 2072990.31 2076486.85 2117883.96 1935569.46 2150149.23 2100654.08 2094235.92
3-hydroxypyridine sulfate
141097838.00 138837128.92 142033163.08 135404028.62 136005443.77 133259305.85 176318407.56 140036338.92 139007951.77 132459272.46 143147983.85 140137165.46 135252054.92 138440854.00 137933158.46 132975376.15 137159418.31 139233700.31 140803609.85 138811787.27 134618903.77 140316112.00 173717424.69 142812951.85
3-indoxyl sulfate
778902852.92 775703947.08 803031012.92 779685081.85 758071635.69 778601470.77 829491274.26 799463036.31 771395744.00 792733495.38 805625676.31 791294575.38 756324027.08 806437656.62 773399183.38 788517616.00 795075636.92 782823607.38 764240797.54 781713195.08 780229453.54 782073560.62 846180119.79 806198515.69
3-methoxycatechol sulfate (1)
59792336.62 60502650.08 60523547.31 62443709.92 59272282.77 61060988.38 71878450.31 60784302.92 60520976.54 58204950.00 59954847.38 62052153.46 61603436.00 60192466.00 58434717.54 63647888.77 60709636.00 63397000.15 61431804.85 60834409.81 57918051.62 59386184.08 72249130.79 58829210.15
3-methoxycatechol sulfate (2)
11112628.62 10673379.31 11592951.15 11025256.04 11038822.00 10407295.92 14555882.87 11317515.54 10395353.46 11346290.85 11589158.85 10735191.42 9801703.85 11393160.54 10889857.65 10904346.62 11515651.23 10799791.23 10419679.62 11224647.73 11283898.69 11638138.23 14966137.79 12028079.38
3-methoxytyramine sulfate
1464086.54 1273895.62 1307205.31 1302476.23 1375316.38 1348796.85 1495655.08 1420203.54 1356876.46 1302999.54 1302127.77 1381611.77 1402334.31 1346549.92 1303272.65 1242595.92 1419654.69 1341200.85 1461677.38 1385651.54 1317309.38 1305660.77 1499598.90 1285018.38
3-methyl-2-oxovalerate
10434482.92 10052734.92 10607284.31 10631485.35 9878449.00 10625420.46 11059048.49 10167664.08 10449822.23 10795549.69 11073050.69 10965802.08 10694797.08 10905114.46 10669657.88 11043253.77 9228088.38 9227037.38 9531069.00 9300706.96 8844051.46 9215533.15 10203089.08 9448228.23
3-methyl catechol sulfate (1)
25205408.85 24835105.31 26019082.62 24946991.69 24952033.46 24446699.54 27537637.56 25367699.85 25435977.08 24343530.08 25598456.31 25413271.65 24535540.46 24938758.00 24922012.04 24644835.15 24828005.46 24718609.92 24874291.23 24942068.42 24164489.62 24953569.85 27719258.54 26025065.31
3-methyl catechol sulfate (2)
3156423.38 3097939.08 3064521.85 3008419.50 2988566.77 2984719.54 3540282.67 3135799.46 3022627.00 2842864.15 3026301.92 3140786.42 2991651.31 3076795.54 3054771.54 2850072.08 3031392.46 2983000.00 3078093.31 2994598.58 2883823.00 3061601.54 3521123.23 3143270.15
3-methylhistidine
97912319.23 92635471.62 98589764.38 94218106.04 95597758.46 92297558.31 153698740.74 93743012.85 95705933.69 93874165.62 93620353.31 96600600.69 98653478.00 97729428.00 91810987.50 92900870.62 96302047.77 96295962.38 96801788.69 92270125.27 93104386.23 90037368.31 155569464.23 93871972.77
3-methylurate*
1504811.92 1528873.00 1608701.67 1545267.62 1550238.75 1535776.00 1678287.62 1500781.50 1565940.75 1447848.42 1546946.33 1533210.29 1584867.92 1538278.25 1498128.29 1539790.58 1422254.00 1587091.17 1498387.67 1537231.88 1489790.17 1529644.75 1662213.35 1563557.17
3-methylxanthine
62701531.46 63539025.00 62964637.23 63505040.81 60517923.15 63376651.15 69320715.10 63904337.69 61953025.31 59999400.38 60486986.00 60671331.15 61050263.77 60443309.92 57696409.54 60676365.92 59935635.31 61282015.38 60606600.15 61541029.96 59441179.77 60066909.00 67087849.97 59243271.00
3-(N-acetyl-L-cystein-S-yl) acetaminophen
7719598.33 7171231.30 7297687.70 7053045.15 7475179.33 7721951.78 34382619.44 6488030.73 7224541.80 6497773.09 7237880.50 6786753.86 6241191.45 6904335.20 7072298.05 7162301.00 6501380.00 6512364.55 6564149.00 6571041.91 6509594.91 6975705.10 36315557.48 7720909.22
4-acetamidobenzoate
1519424.83 1429193.27 1520253.90 1519585.38 1323627.89 1502427.00 1442114.69 1455268.73 1497893.78 1331791.90 1256491.27 1386528.47 1172422.09 1175597.00 1272679.10 1574242.00 1368903.10 1550290.44 1258766.45 1386829.33 1253541.10 1345376.89 1309956.41 1370897.60
4-acetamidophenol
34989127.50 32473673.67 36279819.50 33336986.50 49569846.25 36935434.40 240837332.82 30161863.29 46924416.00 44519609.00 33565351.86 35785322.45 37174395.00 37458170.50 37235322.91 26377433.38 73491803.33 38147632.20 45640467.75 50890701.50 42992986.40 70834865.00 221783988.46 29606927.25
4-acetamidophenylglucuronide
22353182.54 25143641.25 25327330.25 23446051.48 26115983.09 21994051.46 172487546.42 21694881.77 23089468.54 24272309.50 27267368.55 25801667.09 23898549.75 21426547.77 26387610.57 26188043.91 26246205.91 22469900.77 22660144.85 26992183.36 25386725.27 22412958.31 182609289.00 23633426.15
4-acetaminophen sulfate
46260799.77 50668218.50 50903480.67 49124523.92 44529185.85 45598624.54 159781177.72 48853572.00 48011125.77 50239799.50 50601872.83 50140141.50 44223545.15 49371982.00 48538973.08 50625034.42 45917852.62 45787268.15 47172534.77 47862808.00 47626263.92 47130257.85 165058388.53 52243766.75
4-acetylphenol sulfate
3359350.00 3362030.77 3474317.54 3333963.96 3332628.31 3303351.08 3491081.44 3384807.54 3420944.08 3326907.46 3351858.69 3353226.50 3257453.23 3347912.69 3359585.23 3308227.15 3447783.23 3330456.38 3341272.31 3326241.54 3232973.85 3342611.08 3540541.23 3363275.46
4-allylphenol sulfate
730427.62 736074.08 757883.92 745533.00 728575.69 749991.00 818665.41 745267.38 709783.23 730932.54 714332.00 729897.92 716648.77 753701.00 705843.54 730755.15 753082.08 727810.69 707563.77 715118.23 711967.00 727344.00 836292.97 717272.38
4-aminophenol sulfate (2)
27655558.00 30478073.33 27600529.33 27613291.83 29332104.33 25447952.00 12565383.11 25069341.00 30278051.33 31135221.00 32719406.00 28346417.67 30898219.33 29345447.00 31180923.33 31215462.00 24174828.67 22596870.67 37360522.00 28317407.80 25604564.67 21825326.00 11455551.50 25389495.67
4-ethylphenol glucuronide
949474.38 1001539.77 993443.92 987753.81 927709.08 1002430.77 987340.62 1023820.38 1015189.08 983514.08 1001086.85 992623.46 999740.38 1001506.54 1018906.96 1014930.85 960961.15 1015223.62 943582.15 938324.04 964003.15 966423.31 1024551.13 1041954.69
4-ethylphenylsulfate
6367180.83 5834656.38 6014837.31 5928622.42 5768845.08 5898933.69 6193800.56 5868103.69 5923972.62 5852924.92 5820560.15 6203732.28 5859199.69 5899895.77 5835525.46 5827030.31 6045473.77 6004244.00 5946134.46 5887035.92 5843074.54 5990975.08 6187155.62 5940354.38
4-hydroxybenzoate
4037317.92 4018829.38 4057863.38 4021430.23 4053931.62 3919145.23 4513644.26 4236969.54 4688325.85 4394853.54 4244612.62 4394607.69 4408653.62 4352675.54 4045572.08 4187823.92 3954522.62 4039568.62 3775519.62 3983255.27 3830795.54 3640427.00 4473842.21 3984499.23
4-hydroxycinnamate sulfate
840476.17 770853.85 900314.91 780959.71 795428.58 774507.67 867989.76 731367.08 902613.00 902454.25 815528.31 907494.32 809479.92 804324.17 822476.42 837704.25 1003900.45 747084.31 890860.55 941195.78 765122.00 994900.00 915245.89 903675.00
4-hydroxycoumarin
3195294.42 3360213.09 2756206.18 2873951.82 2560387.18 2827672.18 2876558.40 3304047.00 4094827.33 3700490.45 3848861.18 3677861.08 3538719.69 3362258.00 3870260.00 3926762.60 3422714.27 2757220.92 3133010.58 3135244.79 2808805.83 2955505.00 2883100.28 2719324.18
4-hydroxyhippurate
160339785.85 167970485.54 169934692.62 168428568.46 164822456.62 163194904.00 195454367.69 161498978.15 169306159.38 171383771.69 166961877.23 174686194.00 160865172.00 163202648.92 166518249.23 171052234.77 164214916.92 172051397.54 161154067.23 165691661.08 171314821.85 164371568.31 199006766.21 171676640.00
4-hydroxymandelate
10603647.62 11512966.92 11628733.69 11384002.00 11321903.62 11313731.00 12066876.85 10868440.08 11653637.54 11895715.00 11503811.77 11162244.19 11165243.69 11011795.31 11562380.96 11100013.62 12849437.00 12437415.00 12183964.08 12685755.62 11562403.38 12394437.00 12622925.18 13089424.08
4-hydroxyphenylacetate
37400227.85 37476884.38 37372059.08 36414998.31 36632320.38 36662678.69 40414895.31 37192323.77 37547280.92 37349155.46 37380912.00 37896271.92 36204765.15 38173269.08 36005958.23 36626236.85 37518168.00 37287993.54 37548358.46 36873278.46 36118681.62 36968082.92 39810264.87 37455581.77
4-hydroxyphenylacetylglutamine
11853012.31 11717277.69 12033395.31 11743882.92 11732421.38 11555402.15 12627673.54 11801745.31 11604084.62 11637131.15 11701088.38 11822479.31 11331938.15 11615713.62 11414151.42 11839883.23 11852816.38 11768008.08 11715743.85 11723908.62 11622982.85 11701771.15 12668386.26 11902742.15
4-hydroxyphenylpyruvate
8251065.08 8542164.77 9125473.00 7347381.58 8117519.08 8328996.31 8888256.03 8000390.85 5772429.38 6033890.85 6056919.15 5548854.36 5237659.38 6111746.69 5957413.12 6502646.58 5440141.69 5646932.85 5644802.77 5084603.33 5180950.62 5443597.31 6717721.74 6025406.83
4^-hydroxypropiophenone sulfate
531872.54 558679.77 567029.85 549897.19 524001.00 545824.77 651120.62 531153.38 551887.77 518047.85 542868.46 540950.04 532622.92 541080.23 547267.23 544846.31 511314.85 540303.38 519518.31 523961.08 519470.38 551139.46 659761.33 554200.08
4-methyl-2-oxopentanoate
3374016.33 2597835.85 2742599.08 2926404.62 2588562.54 2707700.09 2870453.53 2537712.08 2767006.00 2847996.83 2875257.77 2694898.54 2728821.00 2898380.00 2884428.77 2827460.54 2478746.58 2667700.09 2592353.64 2549559.22 2528597.64 2620001.50 2712027.43 2599178.62
4-methylcatechol sulfate
201091415.69 198593499.08 204874040.31 203421762.62 199332966.46 201853833.85 229284154.26 201790819.69 197374867.08 198075358.77 201529575.38 201401874.46 198228224.31 205107278.46 197349687.23 199352334.77 209018505.85 200045955.08 201690473.54 201513806.46 193506198.15 203400409.85 231656660.00 199943814.46
4-octenedioate
9859638.00 10096971.62 10516732.31 9841111.12 9303894.23 10088276.08 12697192.54 10438246.46 10000293.54 10312587.38 10272119.31 10061032.38 10151645.85 10168644.00 10548073.92 11154104.54 10743135.62 10710317.00 10375026.23 10673937.23 10459390.31 10678755.77 13489637.77 10982072.46
4-vinylguaiacol sulfate
12278833.62 9271262.62 11174707.38 10194020.73 10915292.08 10432709.23 11540477.10 10152950.15 10379916.85 10072855.38 10230828.08 10613089.85 10064903.77 11364859.54 10112397.50 9139956.38 10718058.23 10471091.23 11503329.46 10120467.81 9771951.00 10786010.31 11103276.87 11078007.69
4-vinylphenol sulfate
26153250.69 32538519.92 31554370.77 28838659.62 27277792.23 24427898.46 34048769.31 31359463.46 29961794.69 34454045.38 32486167.00 27601803.92 26353684.23 31668516.85 29649774.31 34300971.46 25876030.00 28049885.62 23169790.77 28826418.04 30564494.54 29388496.00 36541619.28 35813441.62
5,6-dihydrothymine
1156859.77 1081301.46 1230823.77 1071338.08 1053823.77 1096453.31 1179618.33 1126935.15 1218485.77 1102236.15 1183369.67 1138834.69 1031380.92 1144987.15 1094121.54 1109563.15 1176053.62 1101527.46 1085676.38 1085386.77 1069967.69 1138083.00 1195042.08 1042100.92
5,6-dihydrouridine
66685046.62 66461002.77 68518664.31 67352644.77 66817219.69 65585787.54 71858681.23 65380136.92 69179379.38 69240807.69 68479938.62 69086291.92 69024408.00 69284898.15 68172733.15 68472901.23 67790998.92 70574324.00 68440121.23 68668900.46 68697967.54 67467126.46 73239914.26 69527371.23
5alpha-androstan-3beta,17alpha-diol disulfate
411916.11 443826.75 483588.62 440778.62 449651.12 382236.38 379473.62 367684.56 459171.29 506163.43 403061.62 378361.38 427550.62 442161.88 411477.12 390944.67 411614.38 448395.75 460130.25 408450.62 379306.78 392652.78 377332.00 420428.78
5alpha-androstan-3beta,17beta-diol disulfate
687770.60 705970.60 714881.00 713038.40 770860.67 693776.78 665216.03 715672.80 710004.44 728630.80 715529.67 637588.68 709545.67 817957.11 712680.47 702078.20 724274.11 787068.89 787267.33 720834.83 634342.60 791424.89 663555.44 709181.70
5alpha-pregnan-3(alpha or beta),20beta-diol disulfate
349418.50 297400.29 287030.43 321121.17 329132.50 294510.14 346528.27 350371.33 455162.50 451413.50 517429.67 419499.22 424379.75 401449.00 439127.75 530916.67 405062.40 333853.00 379806.67 366122.36 320621.50 379793.40 345912.00 386247.60
5alpha-pregnan-3beta,20alpha-diol disulfate
2744749.27 2750145.36 2824285.45 2820774.05 2779898.00 2757316.27 3291063.37 2829688.64 2603311.55 2777631.27 2571321.64 2625767.50 2681928.55 3083038.30 2526892.48 2646564.18 2813409.08 2955665.27 2878671.82 2714034.45 2684742.27 2896602.09 3219180.89 2794790.73
5alpha-pregnan-3beta,20beta-diol monosulfate (1)
92146.50 121167.00 146164.00 145844.00 139959.00 145055.00 145111.76 165422.00 141225.00 142714.00 153864.00 130837.33 160305.00 156670.00 140316.50 146426.00 135837.50 149615.00 146339.00 135916.50 137474.00 137036.00 141617.33 165064.00
5-bromotryptophan
276733.38 271600.31 306662.33 293902.36 275773.77 272282.15 302839.72 268803.69 268732.62 272535.23 280706.62 276784.40 273109.31 272219.77 266386.20 285504.77 286734.69 281659.31 265260.54 276005.04 269701.69 285733.85 312223.03 283258.00
5-hydroxyhexanoate
12218936.62 11973675.85 11931067.77 11742074.15 11527769.77 11716786.46 16180158.95 12356617.46 11896027.00 11532441.77 12321217.46 12010091.31 11980152.46 12115239.69 11538555.35 11397920.08 11422403.23 11385761.15 11654856.31 11207139.58 10593987.77 11470213.08 15859180.28 11625090.92
5-hydroxyindoleacetate
9081960.85 8672699.31 8743939.15 8634854.58 8535353.00 8726363.69 10158619.92 8675335.38 8656523.77 8586616.77 8652545.54 8786854.23 8785215.69 8906774.77 8435382.77 8672652.85 8904431.15 9093959.62 9034630.92 8699966.62 8212878.38 8553953.69 10127153.92 8558459.54
5-hydroxyindole sulfate
973156.50 888745.08 992203.92 976125.54 937522.33 986132.92 1208105.41 939870.62 886476.08 995915.00 959163.58 979790.76 992071.92 1013956.67 974838.50 961213.00 1018886.08 986857.50 1001402.42 955629.68 936638.67 975623.92 1226322.19 872653.23
5-hydroxymethyl-2-furoic acid
10539176.38 10830280.15 11142661.69 10135165.04 10594473.77 9698598.31 12294833.15 10493112.85 11130953.31 9989248.92 10625924.54 10516849.31 10211626.46 10066207.00 10312978.31 9973379.62 10475727.00 10350177.46 9891929.92 10032157.77 10097653.92 10025052.69 12163617.41 10902461.54
5-methyltetrahydrofolate (5MeTHF)
861930.00 551070.50 663182.50 572313.50 946466.67 731061.00 486455.62 672773.67 628486.25 915832.25 831819.33 676234.67 883470.67 854855.50 774658.38 794961.75 733642.00 1092056.00 827460.67 777861.75 769214.00 1047829.00 541594.86 814997.00
5-oxoproline
254159041.23 254933916.92 254223534.77 259654220.92 243179671.38 253700123.69 257077151.38 260699953.85 220958241.85 226649800.00 229997508.00 222449972.92 217836552.00 222428251.69 223307688.62 230747609.23 236957304.62 238926870.77 232935584.00 240141429.85 236590422.15 234476148.92 252142959.18 249346163.69
6-hydroxyindole sulfate
19672328.23 19147106.62 20024112.77 19541987.42 19204260.69 19750629.31 20676679.69 19741631.54 19553743.00 19693442.38 19371246.62 19916453.00 19576873.23 19761810.15 19459164.42 19569167.15 19394122.69 19593028.15 19589948.69 19339137.27 19246684.62 19171293.54 20833053.26 19387854.85
6-oxopiperidine-2-carboxylate
12821385.85 11379241.46 13032539.31 11447600.88 12317804.31 11431990.15 12149498.11 11833112.92 11145663.77 12354969.15 12111470.15 11738221.73 12203920.54 13117617.85 11263812.85 11752069.46 11561538.46 11799765.15 11562248.23 11018141.62 11575931.85 10973019.54 11267669.64 11738229.31
7-hydroxyindole sulfate
213412.85 207642.67 224541.08 205073.64 210076.08 233296.83 222252.84 227018.55 216866.50 222228.00 205962.00 211648.00 209366.75 211075.54 202166.04 201299.38 250240.20 242296.55 210744.38 218964.26 201901.08 226263.58 228688.59 223517.64
7-ketodeoxycholate
126799.50 140082.00 126729.33 120681.31 125667.50 123150.83 113673.79 128920.43 126904.12 128322.86 119371.50 113877.53 113300.12 116928.86 120258.75 118722.29 119693.89 116542.62 120577.12 125895.07 114184.38 120447.00 109256.31 122714.86
abscisate
814318.00 799553.56 897245.88 856372.94 764551.22 748330.11 1387553.17 787576.56 769179.89 841422.25 781234.56 749347.39 757900.89 812978.50 859839.69 918935.71 821198.88 782335.62 780480.22 786676.06 776827.33 800358.00 1412837.67 945671.43
acesulfame
299686216.20 286723909.50 301177798.80 290665317.15 286635260.60 284171650.30 275570588.94 295697790.40 294916516.20 290459901.10 297505654.00 294254754.20 281215508.10 298080902.30 289882641.65 295014025.20 298125953.70 298114635.80 300509431.50 290102815.00 285882960.40 289554739.60 274627588.06 272063406.55
acetylsalicylate
14749987.00 14881193.00 7841054.00 8679370.67 14625059.00 13683223.00 9672925.71 13872194.00 13430164.00 14670360.00 14998714.00 13354612.50 7063403.00 16064717.00 14335619.00 15021413.00 16316078.00 14752201.00 15218235.00 7177685.50 16050271.00 15277392.00 8908356.74 5340850.67
acisoga
3427336.85 3013499.54 3160400.38 3231175.27 3262532.54 3272474.77 3628795.90 3313251.77 3202979.77 3055100.38 3295998.08 3267127.19 3203742.00 3396079.08 3152006.27 3195653.92 3336476.15 3234689.69 3372169.15 3194579.81 3054333.46 3230299.77 3540790.67 3217600.54
adenosine 3^,5^-cyclic monophosphate (cAMP)
4304860.31 4431487.00 4628674.62 4567341.46 4468945.46 4391305.92 4653177.31 4451555.85 4295498.77 4481830.77 4566426.92 4425413.85 4249942.00 4367622.38 4399333.92 4669023.54 4387268.69 4418060.38 4130836.92 4395245.69 4367614.08 4399804.15 4852976.13 4722492.23
alpha-CEHC
564953.00 582441.83 589205.20 522193.00 453707.60 436498.83 471961.07 566736.60 448715.75 459009.25 361577.00 341150.50 303793.00 494766.00 371874.62 359226.50 372757.40 255141.50 485048.00 344076.42 301580.50 309915.33 292203.08 402740.25
alpha-CEHC glucuronide*
2427253.08 2492338.62 2503879.08 2497878.65 2494789.00 2419455.31 2692126.36 2517592.62 2449432.46 2497169.77 2442038.46 2479335.69 2401962.54 2474818.38 2465393.42 2532649.15 2644558.62 2538883.92 2447202.23 2536725.23 2396691.85 2540200.62 2700868.13 2495735.08
alpha-CEHC sulfate
3185571.69 2177151.00 2440080.92 2351599.85 3110080.46 2729190.00 3329498.56 2479157.00 2936580.08 2587842.92 1936290.46 2793765.04 2814128.46 2722741.69 2449860.88 2166030.31 3177726.92 2435264.92 3451586.92 2648595.77 2063402.08 2696205.77 2912070.21 1763946.38
alpha-hydroxyisocaproate
397580.89 376537.44 389907.55 407294.00 345915.80 461434.00 341017.83 345747.00 445808.00 320737.00 367184.43 383496.21 390207.00 400047.22 416638.33 375318.44 309381.44 302374.00 428018.50 319765.69 348822.43 442418.71 334174.76 389171.50
androstenediol (3alpha, 17alpha) monosulfate (2)
158933.50 149004.33 153315.67 168347.42 153218.50 154326.00 115861.28 149321.83 142152.00 164706.00 153765.33 150042.00 146087.00 162525.50 132108.92 143046.50 158327.50 139497.00 156754.33 153701.92 120636.86 150151.17 115214.36 153621.50
androstenediol (3beta,17beta) disulfate (1)
6811731.92 6747100.69 6679313.46 6823223.77 7024796.92 6524853.62 8309300.05 7129468.38 7026069.31 6813923.08 6311184.31 6209922.27 6105949.77 6709856.69 6429796.77 6446535.00 6803688.38 6877474.31 6872365.92 6662093.27 6372380.69 6843125.23 8329997.46 6468040.85
androstenediol (3beta,17beta) disulfate (2)
13660099.69 13968776.62 12375468.92 13162249.04 12964233.38 12586241.85 18435798.90 13312020.38 12120194.38 12910072.15 11445707.54 11893311.15 12292570.69 11583608.46 11495435.54 12985340.46 13511015.85 13184434.69 12671248.69 12800129.54 11745223.62 13128609.23 18622712.00 13354934.31
androstenediol (3beta,17beta) monosulfate (1)
2424294.09 2093001.15 2275206.85 2407648.46 2075554.85 2401468.67 5723420.74 2437358.17 2166240.23 2348038.92 2358854.25 2328839.92 2147094.85 2198518.85 2169806.60 2123937.23 2440826.33 2206941.15 2217652.85 2205364.12 2359561.58 2105503.23 6476763.87 2292047.85
andro steroid monosulfate C19H28O6S (1)*
2596100.77 2632238.54 2640673.46 2613002.69 2602881.69 2511284.62 2820057.18 2600559.08 2363139.92 2519423.62 2361692.62 2357527.35 2330658.85 2542564.08 2437223.19 2474254.15 2534135.62 2488147.31 2487596.31 2434779.50 2303727.69 2445845.92 2827910.62 2442905.00
androsterone glucuronide
39029931.62 38090117.15 38808944.15 37349016.77 36958411.77 35739602.15 44396824.44 36540117.92 36081734.46 36945715.31 34507879.46 35215904.65 35142137.69 36920250.00 34644580.50 35246286.54 36687221.92 35721116.15 38793933.31 36074591.65 34582516.77 37264907.54 44455728.51 36232123.23
androsterone sulfate
9943740.38 9830319.77 10560520.69 10168816.69 9765184.85 9598427.00 12494458.31 10214988.46 9906907.62 9501820.69 9289272.15 9281122.15 9077915.15 9148331.85 9162288.69 9027158.15 9657574.85 9525178.15 9933068.15 9380898.77 8888953.54 9444346.08 12503013.85 9913723.08
anserine
2299306.64 2235750.27 2249548.64 2036903.83 2185942.18 2110872.64 3782033.49 2159256.36 2209615.27 1962662.64 2245625.00 2135424.74 2436465.70 2024622.83 2339633.40 2009526.36 2172070.00 2244620.82 2045027.33 1985488.04 2193638.10 2243552.50 3482898.75 2479069.90
azelate (C9-DC)
20170040.15 20846310.23 20609403.38 19618760.58 20293515.00 19329641.38 22347760.92 19459355.85 19997079.69 20336232.00 20490690.15 19908314.88 20226392.85 20014427.92 19596662.62 19284009.00 20462506.23 20115116.54 19874432.62 20613012.73 19235489.54 19947923.62 22017659.51 20721088.00
benzoate
2832377.00 1451111.42 1558841.91 2866353.81 3175342.54 2063443.62 1723694.12 1815328.75 2714455.67 2724248.08 2223238.77 3416611.04 2044264.58 4124851.27 2213586.88 2402116.25 1924893.43 1317179.20 1399542.43 2030290.69 3097206.40 1008442.75 1551463.44 2018224.82
beta-citrylglutamate
23563681.46 23097970.38 22856852.46 22612329.27 22255943.77 21927905.54 23903206.90 23031395.46 21991461.23 21912308.85 21769330.00 22117303.35 21807583.08 22027590.54 21202316.38 21781498.15 22397058.15 22263378.46 22505861.69 22079526.58 21723851.54 21594675.77 23944197.72 22405057.15
beta-hydroxyisovalerate
47083136.38 47756745.85 46186626.85 47506863.58 44918243.00 44327886.15 44882223.87 46670150.85 43012161.77 43895086.62 45737319.77 43901170.81 43416053.31 45177112.15 42695933.19 45171772.31 34949896.46 38489127.08 36187374.46 37792916.88 34473224.15 37655099.92 38899745.67 40513796.08
biopterin
721871.08 559051.85 607720.50 552830.96 644892.92 568752.00 606571.90 618975.83 721138.17 599127.00 506631.54 683508.73 671454.23 672705.15 541379.58 509512.38 760275.54 649227.00 754237.08 688353.81 626647.23 661849.77 601046.34 542875.38
carboxyibuprofen
18298713.67 19120087.33 20710870.00 18899677.67 18469607.00 18416004.00 13509609.05 18459027.33 17894891.67 16542479.67 15773126.00 16265853.83 17056105.33 17236337.33 16899541.17 15164222.33 15477181.33 17097687.00 17359452.00 15498515.67 16147054.33 16588152.00 13660562.05 16036980.67
catechol glucuronide
11775721.92 11705182.62 11712359.54 11372138.92 11230534.54 11568480.54 12824269.95 11805270.00 11569469.85 11168900.23 11932417.62 11950346.77 11441807.62 12023541.31 11337704.50 11719046.31 11885962.77 11750007.08 11699792.46 11508343.54 11883862.23 11641323.62 12922492.90 11437124.92
catechol sulfate
312502035.69 309095230.15 312921517.54 305925214.77 302192692.92 307610380.31 326287063.59 308739167.38 308856435.69 303479867.08 311773438.15 314403519.08 306968696.62 307763242.46 307637916.92 311553830.15 314913549.54 314197993.23 312773241.85 309172409.54 302920324.31 310726463.38 326086474.26 312195865.85
chlorogenate
3191600.30 2831514.64 3005887.70 2743797.68 2893599.20 2649322.09 3248961.68 2920120.27 3026240.73 3208451.60 3162157.55 2916067.45 2941504.64 3319781.90 3204950.81 2975339.91 3194648.55 3196985.00 3180367.09 3025934.68 3399033.90 3450647.30 3540919.17 3212946.64
cholate
98483.22 115771.86 103512.50 112372.06 113675.14 106085.12 88724.10 105993.88 99846.50 102398.75 101091.71 117697.57 95406.00 117503.86 103105.86 108171.43 101659.00 93107.00 90045.57 100874.14 90416.86 97131.86 87358.15 94657.00
cinnamoylglycine
117836443.23 110686033.54 107659017.00 103699733.23 107213368.00 107963060.00 140317316.28 111529897.08 113327965.08 106340075.08 100773464.23 115725587.35 112197510.62 111188844.31 108364628.62 103097535.00 116401541.38 112496001.85 117815131.85 112451042.35 105792122.23 115068932.77 139039278.26 103559190.38
citrate
2253804027.08 2243257934.77 2296968260.92 2249295913.85 2233608492.31 2240029971.69 2405310227.69 2260213282.46 2146241984.00 2107452780.31 2168254808.62 2161208324.92 2124640256.00 2123449806.77 2092185821.54 2105667825.23 2230766557.54 2198202343.38 2207276297.85 2221689459.69 2193958749.54 2162821868.31 2393812325.74 2177784344.62
cortisol
306696.00 297918.54 292630.69 282457.24 307273.67 278575.62 331268.69 288334.15 331619.00 317094.67 319396.77 346949.79 297977.58 317253.42 305429.27 276266.77 326656.69 299414.15 307709.46 302260.62 297877.54 292889.08 333888.00 309916.67
cortisol 21-glucuronide
406154.38 421978.31 409831.85 414173.69 407283.31 387149.85 472872.31 405185.08 395202.85 407542.46 432294.83 400964.15 403199.15 435589.17 414893.23 395319.08 403197.08 418804.92 397358.15 399432.73 405043.23 413050.23 480812.15 410389.92
cortisone
1215040.46 1259653.38 1296222.15 1259263.69 1229066.46 1192166.08 1291649.56 1211390.54 1341859.85 1379826.31 1371243.62 1274025.38 1277594.38 1319827.08 1295372.81 1324732.31 1280956.00 1244897.92 1256524.23 1278397.50 1229847.54 1275773.31 1333458.62 1375736.46
coumaroylquinate (2)
445136.50 433553.00 418950.00 407894.94 421099.00 390731.25 439248.40 409064.50 433627.62 365904.33 416347.00 418356.29 417355.75 422920.88 431635.81 436915.62 410923.75 431411.25 455919.12 401286.06 445878.00 479569.29 486499.00 440301.25
coumaroylquinate (4)
674820.75 678807.71 678917.38 669440.80 717722.57 637887.43 705376.54 644495.25 683005.14 633649.62 674867.25 694557.69 700349.29 677570.50 687304.20 636110.50 649433.50 670712.57 658904.12 647308.87 650614.62 687892.29 710061.31 717735.14
coumaroylquinate (5)
346514.75 364076.00 319089.80 303447.82 313815.60 376971.40 296408.78 368282.50 305542.40 274345.50 290580.67 336734.20 342041.80 300174.60 292157.36 370411.00 247690.17 360588.75 260168.40 264058.31 316413.00 248738.00 336062.73 324964.60
daidzein
65556.00 71315.33 79845.67 119075.00 77085.33 88372.67 50063.36 82291.33 138026.00 80420.33 83686.00 173814.17 55144.75 92357.33 82724.67 65390.25 106584.67 102163.50 105639.67 133377.83 66782.00 94137.67 66723.17 60816.50
daidzein sulfate (2)
527290.00 398627.60 406728.83 483689.25 573724.67 419640.25 305606.89 400914.80 283472.29 463801.25 391384.40 362650.73 339586.25 527818.00 358552.30 389235.00 418297.20 490511.00 317726.67 440247.14 419627.00 404318.80 373516.59 406115.00
dehydroascorbate
1841925.25 1680820.33 2316523.43 1822742.73 1515332.10 1706952.00 9974095.00 1813676.20 12239692.77 10056601.31 7931079.00 10883930.35 11580333.15 9640561.85 10531566.36 4856931.08 6321942.58 7842627.08 7743739.08 6081708.20 7143551.69 7090114.54 17419669.79 6226525.38
dehydroepiandrosterone glucuronide
370933.91 530125.12 444371.00 464788.06 448133.78 433662.78 550656.30 435378.90 412100.00 392797.55 383998.55 426708.68 396644.11 458856.56 387858.14 450996.80 491935.22 435967.20 415545.11 397162.67 400402.00 414007.00 638774.10 447225.00
dehydroisoandrosterone sulfate (DHEA-S)
11492503.23 11201284.92 11883914.54 11689694.77 10974194.23 11606071.08 22626744.21 12007240.38 11667747.08 11447377.54 11191009.54 11262679.92 11411610.38 11033418.69 10772791.96 10854378.15 11688976.38 11836561.46 11839390.92 11340161.08 10885156.31 10906267.54 24500320.64 11739731.77
deoxycholate
137436.56 150232.43 147284.38 146840.94 194358.75 164084.33 120590.96 157032.40 148478.89 169209.50 245139.50 188824.71 171475.20 191570.00 153397.85 150016.50 128377.57 166358.00 160775.40 171060.23 129945.00 232964.33 108160.48 138960.71
desmethylnaproxen sulfate
5195822.00 4881250.00 5307216.00 4079485.50 3753694.50 5112303.00 2429910.12 6389665.00 4597092.50 4678777.50 6499142.50 5701193.00 4662784.50 5094802.50 4168876.25 6736439.50 3356576.00 4929116.50 3606652.00 5660582.75 4339284.50 5002276.50 2857870.12 6448424.50
diglycerol
1895743.00 1828147.29 2141466.00 2144428.64 2790141.00 1901836.17 1849875.04 1879672.83 3053531.50 2719059.50 2968479.25 2566045.60 1982247.17 2384196.60 2724290.89 2935005.00 2815678.50 2484821.20 2480567.20 2788952.50 2448098.80 3077619.50 1883532.46 2955134.50
dihydrobiopterin
1084590.00 1175211.15 1145427.31 1062800.15 1120689.54 1124280.92 1220790.23 1073873.54 1105265.54 1117045.15 1193550.77 1118376.38 1195731.54 1148174.54 1097782.50 1097252.31 903745.69 942405.54 875745.69 929476.69 999597.00 960861.38 1127732.26 952477.62
dihydroferulic acid
5994644.69 6173244.58 6118526.08 6272420.72 6297360.17 5766660.54 6476759.34 6029640.77 6397785.67 6015057.25 6019789.69 6576235.67 5660517.46 5852818.23 6050965.44 5840126.85 6255028.83 5809555.38 6288148.67 5841862.85 5960520.67 5743449.31 6278227.36 5850665.69
dopamine 3-O-sulfate
9573854.77 9237349.15 9646100.46 9494421.77 10010594.38 9214680.62 10576022.31 9796297.62 9307870.77 9479749.00 9195135.23 9339825.54 9617440.46 9645325.46 8913330.12 9216160.15 10069549.92 9012704.00 9377279.77 9555894.54 8897396.92 9267251.00 10340369.74 9257142.15
dopamine 4-sulfate
4133573.08 3658213.31 3763274.46 3722011.38 3914758.54 3923592.54 4242974.38 3799460.31 3635723.85 3456039.85 3624968.92 3685619.08 3831261.46 3567389.46 3490295.19 3466918.92 4205659.54 4140973.15 4112408.77 4017959.88 3726496.15 3885564.31 4329577.56 3735082.08
enterolactone
604393.20 526819.60 567831.00 730066.75 553266.50 551250.40 2062692.04 560554.00 799856.40 621407.60 497565.14 818957.17 675141.80 607194.60 599618.30 651234.20 810830.83 753659.83 740548.50 892623.69 671958.20 617046.86 1888135.25 733855.80
epiandrosterone glucuronide
1983467.31 2132291.77 2125556.77 2089289.00 1990805.38 1986430.69 2756013.85 1933194.38 1936697.54 2040008.85 2025807.38 1914214.50 1931634.54 2004829.54 1971952.88 1985314.38 2007772.46 2070081.69 2015864.31 1925505.65 1954073.85 2108226.92 2847964.77 2111540.69
epiandrosterone sulfate
2890078.69 2893863.23 3030389.38 2988654.88 2827279.38 2751440.69 4876915.31 2958742.38 2671243.23 2775299.62 2877431.85 2701606.85 2528273.69 2648671.85 2621501.31 2813722.77 2821215.62 2851506.46 2960952.00 2819658.12 2663708.69 2793746.15 4953417.41 3031322.92
equol glucuronide
155443.62 161300.57 137960.10 160120.25 135559.50 138827.11 139458.48 148058.00 160336.71 135336.56 140092.67 148375.75 151255.14 147152.50 143878.00 136026.00 155760.50 164481.00 141001.75 151744.31 148173.38 156534.50 152837.14 159357.00
ethyl glucuronide
5875614.60 5161557.75 5231784.33 5101750.22 5808043.50 4585604.00 6364111.76 5559580.73 4872559.17 4998702.91 5696958.27 5050148.13 5346368.18 5219482.64 5432850.10 4837691.17 5303542.64 5813721.30 5227258.18 4824683.65 4536634.38 5184407.55 6066339.77 5139731.50
etiocholanolone glucuronide
26552086.08 28115349.62 27862292.08 27541335.38 26265204.54 25768010.23 31541207.31 26102968.92 25639847.77 25893672.00 24818692.69 24369865.04 25945525.54 25627355.54 24725121.77 25553288.85 25676843.85 27084887.62 27393880.15 24446046.32 24643833.38 26421036.46 32169674.77 27510609.54
eugenol sulfate
18145668.15 17794315.15 18995449.23 18716356.96 17922520.92 19568938.92 18982661.10 18928404.15 18849593.46 18824954.00 18414096.92 18730995.96 18389738.31 18810088.00 18076756.65 18046296.77 19343226.23 19130494.62 19265092.77 18500157.77 18456589.62 18052794.92 19032551.72 19566000.08
ferulate
572398.75 609254.36 744585.78 599119.25 559687.67 672464.70 652426.97 601816.55 711040.90 601002.18 576610.75 654962.56 624144.75 574426.42 588637.62 628577.67 565400.08 616633.82 679407.73 633996.92 526213.85 636662.08 607248.50 601854.23
ferulic acid 4-sulfate
30065956.38 28795639.46 30601181.92 29131719.65 29858147.15 27458113.92 30582025.87 30318032.23 30668593.62 29923926.69 29950218.38 29739903.85 29444673.77 29595612.85 29463255.35 28049016.92 30190130.92 28331520.69 29313800.46 29233025.50 28743674.54 29534659.85 30149368.00 29414341.31
ferulylglycine (1)
17959706.77 17596692.62 18722272.23 17685013.77 17675806.62 16743798.92 20317384.41 17932449.08 17480806.85 18087186.92 18028573.62 18001341.62 16868366.62 18217647.08 17729338.77 18362975.00 18177555.92 17412621.31 17289521.54 17687020.77 17164567.85 18076515.38 20749296.38 19028351.38
ferulylglycine (2)
7753029.15 8312345.69 7843558.00 8012239.31 7759879.77 8068696.00 8964392.49 8941485.15 7703983.85 7256745.00 8858823.46 7390538.69 8277676.15 7310377.85 7242895.73 7314865.54 7855685.54 7774949.15 7931994.08 8707513.08 7971425.31 7556204.62 9329734.85 7318554.38
fucitol
21236691.38 20908957.31 21563082.38 20509907.04 20359280.69 19854948.69 21714570.13 20671960.77 16119896.23 15666898.46 16231376.92 15885295.85 15878659.77 15835048.23 15397171.50 15883753.08 15968644.38 16077338.85 16090330.77 15766318.85 15413819.92 15565989.92 18663540.51 16232653.54
furaneol sulfate
23304052.62 22583778.23 23238981.38 21454343.62 22377022.15 22676809.62 22775882.72 22661535.00 22280038.54 20548895.92 21041590.69 22325663.19 22346024.62 22043015.00 20869539.35 20492614.62 22736336.62 22331884.46 23916202.85 21620961.54 21365459.46 21446010.23 22607730.23 21091800.38
galactosylglycerol*
6108517.54 6077627.85 6084148.54 5798632.81 5673894.62 5830658.38 6436003.87 5379629.54 5636546.69 5737763.15 5489654.38 5850940.12 5657118.31 5531670.69 5489653.58 5361553.85 6082624.15 6087592.38 6299256.08 5652140.65 5965300.69 6349519.85 6738494.56 6368708.85
gamma-CEHC
595414.62 527010.15 550994.46 671329.92 528535.92 556112.92 459507.18 621861.31 345047.62 300088.77 291034.23 374137.65 302374.00 301401.77 290177.19 322619.69 295958.25 260908.08 262841.75 332572.80 239138.23 243720.38 287424.97 271587.58
gamma-CEHC glucuronide*
13755820.46 13729915.15 14130865.23 13676661.58 13546323.00 13677453.62 14678459.18 13760390.46 13638847.38 13825916.00 13679512.31 14015795.42 13697718.85 13617545.00 13593175.00 13834761.38 13714155.77 13673083.08 13645565.38 13513673.54 13387577.92 13439098.31 14852162.54 13924106.23
gamma-glutamyltyrosine
244206.90 270767.50 240630.00 255176.53 246831.00 254267.30 242818.00 234802.18 250165.36 281295.50 259430.30 265514.45 263035.10 264836.70 258300.57 263182.10 264700.90 262462.50 267623.20 270034.40 271438.60 266021.00 257170.36 285192.70
gentisate
18354795.92 19736428.00 19616208.54 19194116.27 18490930.00 18622417.31 23181599.69 18794888.77 19116645.38 19113324.54 19389413.85 19261945.81 18642963.92 18852414.54 19086101.12 19514876.31 18686438.54 19651920.77 18611744.08 18991337.65 18921832.85 18566138.00 23944957.36 20523901.46
gentisic acid-5-glucoside
1078868.92 1024061.92 1044537.54 1057958.48 930927.50 1085144.77 1559921.56 988449.15 957928.31 1026613.15 938475.08 1030703.48 1054036.46 1123425.54 944961.56 1011370.46 1115162.54 913166.31 1125817.50 957378.21 1044945.55 1139251.38 1677610.67 948022.33
glycochenodeoxycholate
84189.43 97098.50 87675.83 84969.77 87552.25 96259.17 67052.70 107241.00 83856.17 87529.83 76890.00 81051.23 73012.57 91517.50 83806.20 74290.17 79121.20 64918.50 72533.33 76403.00 71613.80 66098.50 59468.82 95089.80
glycochenodeoxycholate glucuronide (1)
1102743.62 1091169.92 1191606.46 1015235.12 1080539.92 874710.31 1372741.15 1050621.08 946276.92 922619.31 897501.25 889436.48 983429.64 922649.23 844300.16 1093824.17 1006900.69 999658.00 1114821.62 922129.31 923182.23 976984.58 1381740.69 1038465.85
glycochenodeoxycholate sulfate
1948315.69 1764314.31 1957917.38 1849477.50 1604368.62 1571727.15 2317702.55 1759983.38 1537430.77 1598656.15 1525350.46 1527804.52 1595638.58 1430029.92 1389219.31 1463262.54 1798960.92 1610980.38 1865199.25 1635692.85 1540303.54 1762521.00 2290498.49 1683426.77
glycocholate
416433.38 466853.58 430145.77 450751.16 450069.42 412776.85 515050.30 453733.17 449759.25 450467.58 436543.00 454253.28 424837.25 440010.15 422587.73 427622.75 426465.58 394162.92 402297.33 398505.46 381718.58 390470.33 465781.34 416241.08
glycocholate glucuronide (1)
2186707.67 2320994.00 2264191.58 2271576.29 2601325.70 1965528.77 2328193.29 2037106.33 2115841.55 2114157.58 2145281.75 2133441.35 2304895.09 2339986.55 2167842.70 2318321.45 2658031.50 2447041.00 2269327.09 2279088.74 2305147.90 2111106.77 2211130.50 2141403.92
glycocholenate sulfate*
4026154.00 4199693.92 4072714.77 3698247.08 3852210.92 3437969.15 4627626.67 3854521.54 2989726.92 3313627.33 2883230.92 2869188.22 3167674.17 3262379.45 3025144.00 3365381.31 3646810.54 3669727.77 3995621.46 3489696.46 3166294.62 3551638.38 4699803.13 4219843.92
glycodeoxycholate
318794.56 271369.09 344967.50 312651.12 226335.60 349049.00 251751.66 302135.40 332570.00 331342.88 294482.56 262720.75 288046.44 265936.40 295895.58 247448.36 244433.11 274763.62 279216.00 262989.76 301216.29 284755.38 265138.31 311746.25
glycodeoxycholate sulfate
2566573.31 2484644.31 2468113.54 2231217.62 2214145.15 2036839.62 3021801.49 2183119.62 1932038.00 1964563.62 1927432.08 1817245.85 1787146.92 1884909.23 1860336.46 2345369.92 2368205.31 2135232.38 2428742.38 2053839.73 1918168.38 2074240.54 2907333.59 2428116.46
glycohyocholate
332438.50 235077.29 306034.83 309886.17 178692.00 295016.67 195399.66 235553.38 242209.71 316794.00 245339.75 252383.00 280760.00 304650.50 233319.13 253473.29 206847.22 261142.14 235727.62 266269.29 226270.62 300862.17 194538.34 252003.14
glycolithocholate sulfate*
6973575.62 7064177.69 6788138.62 5751068.31 6295652.00 5145051.62 8833410.69 6173801.00 4346931.17 4411496.31 3988883.00 3603959.75 4448647.73 4220485.45 4824951.21 4159176.00 5580432.08 4776125.38 6048351.62 4629241.35 4086491.31 5656034.92 7473221.85 5040430.54
glycoursodeoxycholate
343051.20 336293.44 375385.00 304225.00 298578.64 299336.18 414141.85 279226.50 325421.55 332892.70 361764.78 307211.43 322265.80 298935.80 288664.86 274052.55 313828.10 268973.27 319869.00 289468.70 337869.89 305501.30 439287.73 327595.90
guanosine
476661.23 468606.46 465137.23 458502.88 478588.67 472960.46 481212.41 500467.50 422941.08 416733.08 415378.38 434169.62 448353.54 407950.92 435993.38 416238.15 438698.69 427481.15 426626.54 428676.69 412665.31 413606.77 469588.15 424728.75
guanosine-3^,5^-cyclic monophosphate (cGMP)
339478.45 386279.56 398127.60 379130.65 319639.25 366892.00 368773.17 371392.20 340305.50 333114.08 370980.60 342353.13 346709.92 369204.18 358249.77 381786.40 337097.25 404080.67 362691.09 392556.06 334929.08 331839.25 390537.00 359025.10
heptanoylglutamine
288437.50 264131.85 274061.17 264998.48 289133.55 274290.92 317886.22 279196.33 293803.50 287062.75 295524.58 292825.13 274434.00 282889.83 254825.50 265972.92 274004.83 265937.17 302365.64 262870.00 248131.92 284055.92 307074.87 276469.83
hexanoylglutamine
24725677.62 24349696.38 25153282.69 24280543.04 24547363.54 23949385.23 28538804.54 25177638.92 24441528.00 24959650.62 25258605.08 24997341.81 23869132.54 25155457.54 24441366.31 24802504.31 24908898.62 24196773.15 24030217.31 24361511.92 24686086.38 24496699.62 29058460.59 24852326.46
hexanoylglycine
10673198.08 10211434.23 10628501.00 10562887.00 10406484.00 10520468.92 14697086.49 10639857.08 10520583.85 10622902.23 10519079.69 10615821.85 10134212.31 10574878.31 10199354.88 10461590.69 10780525.54 10596531.00 10796797.23 10332708.35 10367806.69 10286578.00 15040337.46 10963582.85
histidine
148292189.62 145052388.31 146861631.62 145560450.50 142232288.08 144687969.85 211831539.03 145581030.23 151097703.31 153310716.92 152008562.62 151877476.31 150413647.00 152906195.31 151026441.50 153135882.62 160788496.23 158535997.69 158020809.62 157155792.50 154233585.85 156165431.31 220413147.56 161092911.31
homocarnosine
1045995.54 1145514.69 1213856.31 1084866.42 1091335.15 1221659.75 1342324.47 1151139.00 1172298.08 1136081.00 1086986.85 1109761.77 1095052.77 1025607.62 1037687.50 1131905.46 1200857.00 1118673.46 1141185.15 1183806.27 942308.42 1087733.00 1292376.03 1203373.69
homocitrulline
8476623.69 8314187.46 8410040.38 8135903.46 8160091.31 7973192.69 9109260.28 8187874.38 8531252.85 8359935.31 8323544.46 8400971.23 8475333.85 8258984.92 8224190.96 8262258.85 8821380.08 8557510.31 8858463.46 8504084.35 8377040.15 8347594.23 9370123.10 8428316.69
homovanillate (HVA)
17717692.15 18113107.62 18131734.62 17922972.04 17544206.69 17480882.46 18757139.03 18026493.54 18432406.15 18278573.31 18264723.77 17874664.27 17441837.54 18068282.15 17426234.58 18305122.46 18390757.62 18060384.08 17877207.38 18141107.46 17082130.46 18023560.15 18786561.72 18208058.92
homovanillate sulfate
2518735.30 2410207.00 2623687.73 2502787.09 2342746.09 2106781.58 2403869.03 2259637.58 2661656.30 2400259.09 2528802.50 2689781.47 2622472.40 2659005.44 2498645.16 2280897.00 2640469.89 3113729.20 2586508.70 2634619.75 2795698.10 2583770.50 2459411.31 2675650.50
hydantoin-5-propionic acid
11800695.31 12082346.23 11893099.62 11780689.08 11713881.46 11595841.69 12369785.97 11633645.92 11240813.69 11575412.08 11406849.77 11407954.77 11318754.69 11296072.00 11291145.46 11226866.92 12384177.08 12446830.46 12150869.69 12363349.04 11953701.69 12344703.77 12804521.64 12685194.62
hydrochlorothiazide
85086012.00 78431948.00 86234640.00 86682634.00 87047544.00 88677688.00 62525353.76 82296404.00 83260504.00 81811260.00 81536364.00 85260574.00 84881004.00 85360652.00 81995836.00 83904392.00 85393428.00 92539224.00 85354976.00 85395374.00 81508528.00 85923980.00 64266948.65 82889968.00
hydroquinone sulfate
15151345.85 15080824.62 15335177.38 14684807.96 15285656.38 14593569.00 17986693.54 15074222.38 15342541.69 15248467.46 15278991.77 15602821.88 15052823.69 15660364.54 14953347.27 15193285.77 15382460.08 15801312.00 15377114.77 15219790.31 15543675.08 15624259.92 18036589.90 15817760.38
ibuprofen
973532.33 977133.00 947720.33 1196548.00 927507.67 834401.67 425700.33 966169.33 802336.33 468175.33 384772.33 339035.71 358551.00 346294.33 402056.17 423017.67 176875.67 162875.00 293199.00 230726.60 283351.00 146479.67 114651.67 171560.33
ibuprofen acyl glucuronide
17810226.57 16374725.57 17378302.29 15641453.46 13746711.43 18661411.50 17413409.04 16546445.50 10780902.57 15551859.88 16672290.12 17572391.53 18012947.14 14702932.88 16954563.47 16924046.57 16735988.11 17856796.33 17439710.56 18727225.44 19043089.38 18709587.11 19042340.03 20515782.11
indole-3-carboxylic acid
574391.20 435319.67 542512.80 631867.15 595553.17 678058.80 593244.56 528929.50 691472.33 573337.43 511799.57 834226.25 709852.40 751785.20 617685.50 557029.86 523160.22 585615.86 782516.60 815480.00 707211.80 603287.00 696504.35 602215.83
indoleacetylglutamine
10987232.69 11057595.00 11242945.85 11231885.38 10718150.69 11090655.54 11242777.23 11248761.38 10872279.85 11184107.38 10994427.77 11076905.77 10729859.31 10886490.92 11051882.92 10839823.62 11134808.08 10925072.77 10855601.08 10919206.46 10476859.23 10800681.69 11109822.13 10922359.23
indoleacetylglycine
408329.45 378136.50 359888.62 385168.79 376891.67 392575.25 402547.31 383815.33 415098.17 409398.67 405213.67 418624.75 394402.67 454787.36 404882.29 405461.42 409275.58 370312.92 384656.25 429923.64 398266.58 364136.83 403827.53 388001.17
indolelactate
13358591.54 12473485.23 12998233.31 12804894.31 12904003.08 13093510.23 12787043.69 12854033.54 12991509.08 12495335.54 12358143.23 12857898.12 12517928.00 12863823.77 12169527.81 12195138.85 13371386.69 12529822.92 13487027.31 12745616.96 12172316.77 12878521.46 12553804.54 12356498.38
indolepropionylglycine
12302192.69 12535294.54 12777582.62 12613834.46 12356190.08 12667266.31 15002157.90 12599391.46 12481503.23 12794397.38 12405029.54 12590727.42 12152677.62 12509036.08 12515224.04 12673268.92 12859522.85 12816368.46 12291373.15 12619100.54 12036530.62 12782236.08 15615695.03 12594508.00
inosine
1130013.92 1064079.85 1119073.92 1165615.54 1097415.69 1085782.46 1301512.15 1126785.23 1166331.38 1104687.69 1112246.46 1269911.65 1111631.08 1101199.46 1086851.15 1213496.23 1246700.54 1123970.08 1114878.38 1281956.69 1095161.62 1121253.62 1324310.00 1210776.85
isobutyrylglycine
13794559.62 13626966.54 13776416.92 13656098.81 13432616.69 13468473.62 14631454.97 13631957.85 14134942.69 13756253.85 13340030.15 13860379.35 13641351.00 13932869.15 13173395.50 13384179.08 14112673.15 14008230.92 13912176.23 13630508.77 13376618.23 12951466.00 14525284.18 13912595.85
isocaproylglutamine
774982.92 763558.15 803137.08 780335.08 789055.31 762585.54 829007.69 793141.31 785141.08 785357.46 777899.62 800356.96 756193.46 777548.62 792698.38 784719.62 805655.69 773410.08 764932.62 779586.58 757986.92 772248.92 835705.87 784157.54
isocaproylglycine
3770497.38 3680804.23 3801926.69 3755221.00 3651035.38 3723742.38 4216118.54 3851678.69 3702224.23 3768560.69 3785784.38 3782025.46 3693610.54 3826744.69 3668310.92 3725811.69 3852778.23 3871400.77 3812896.08 3710866.77 3653129.31 3634767.00 4207628.90 3832017.54
isoeugenol sulfate
333084.17 305549.18 352887.82 352288.86 350132.18 291741.08 321988.75 304784.33 289781.75 316791.91 326253.36 319006.45 325848.64 320993.09 311123.00 312045.09 288185.50 289967.50 324042.64 311491.91 306928.82 294773.08 306507.46 315804.91
isovalerylglutamine
3048402.38 3777835.92 3660265.46 3713618.54 3470869.85 3365618.15 3780107.67 3367496.54 3274899.38 3804383.54 3964841.77 3523176.46 3274093.38 3334064.23 3901121.54 3994987.08 3235867.77 3734182.69 2809916.46 3624290.00 3753686.08 3809435.46 3944971.18 4223011.69
isovalerylglycine
33068036.15 33864326.23 35628273.54 34371609.62 34311331.85 34131894.54 39955176.21 33899187.85 33321250.15 33749559.77 34077455.92 33967444.19 32754898.38 33853277.46 33676776.15 34263488.85 34093414.23 34744133.85 32911793.62 33831352.15 33141476.00 33605211.08 40400257.87 34863941.08
I-urobilinogen
311646.00 253925.80 246889.83 176011.75 141058.00 240001.75 206602.33 241579.83 260841.86 227282.86 273158.14 206811.21 183431.00 268288.67 269263.38 227606.00 227812.40 181582.75 205288.80 199787.14 111447.00 215862.00 168315.72 159386.71
lisinopril
13826719.00 12701377.00 15825889.00 12907937.50 14608124.00 13232970.00 10196332.00 13194200.00 13225286.00 12464334.00 12955202.00 14777964.50 14764302.00 13775603.00 13658044.50 14963622.00 13068489.00 14271833.00 16247950.00 13056951.50 12134529.00 13374832.00 10563994.47 13531754.00
malate
21916094.69 21374000.15 22241724.15 21673053.38 21451305.77 21832617.69 24095720.49 22139603.85 21535063.69 20300416.92 21069250.62 21411291.04 21038394.00 20740666.38 20222157.62 20976888.62 21624692.38 21323190.77 21982613.31 21244088.88 20811830.31 20778717.38 23367295.56 21721825.08
methyl-4-hydroxybenzoate sulfate
7648271.92 7403534.00 7069377.46 7558655.96 7319737.54 7867906.23 8874043.87 7365992.38 7539146.69 8017175.33 7371029.62 7327318.62 7307644.69 7301403.08 7327887.69 7084803.23 7776128.85 7626756.15 7822729.62 7497790.19 7795613.08 7260362.31 9061574.69 7608839.85
mevalonate
8485220.00 5357933.44 8679909.45 5615806.26 7349828.36 6961653.92 5872788.73 7103658.50 9185275.18 8019769.10 5474772.00 8632046.00 5860779.82 8705767.00 6676205.39 6263901.45 6182345.58 4898785.45 7468638.08 7306937.04 5394232.27 6751932.70 4820537.59 4769967.75
N1-Methyl-2-pyridone-5-carboxamide
148745939.38 150291135.23 153969614.15 151773542.15 146316685.23 147255775.54 159700254.97 153175623.54 151893794.31 152382989.69 154541384.62 152093514.46 143043978.00 151874200.92 148290628.54 149537038.92 150892638.77 151515081.08 148347555.08 148327582.69 151245556.62 149290216.00 160305071.03 155693428.62
N1-methylinosine
8650737.38 8367419.46 8719606.85 8366519.27 8446111.92 8458193.69 9603008.95 8575731.85 8423094.23 8610390.08 8476163.31 8502662.31 8308494.46 8793226.00 8385854.35 8405397.62 8784064.62 8659518.31 8650648.54 8471017.81 8210235.77 8695821.31 9624205.08 8468215.46
N-(2-furoyl)glycine
521291709.46 553081691.69 562639992.62 521915886.50 539852770.23 510915051.46 857904924.62 553194340.85 545478052.77 520337253.69 524126652.23 518650966.23 497083644.15 519952996.46 524520550.08 508238588.15 541673345.92 519160192.23 531371479.92 540088480.73 524897605.08 546510177.38 855035287.74 538439355.46
N2-methylguanosine
4882495.46 4744751.00 5003537.92 4647228.04 4861494.54 4770880.15 5045242.26 4803465.38 4556097.92 4485035.54 4557493.54 4679797.08 4595483.31 4617744.38 4552517.88 4573141.00 4653061.69 4483447.00 4650617.46 4564237.54 4494101.54 4520745.62 5013587.77 4556128.00
N2,N5-diacetylornithine
35037753.85 33344612.15 34858445.38 33181255.19 34861093.31 33123627.77 33218366.23 34154837.85 34090864.31 33370479.08 33367143.23 34648086.15 33177099.15 34577762.69 32736211.73 32588461.46 33569035.46 32968487.62 34041171.54 32623787.92 33115038.00 33122467.46 31992235.18 33017721.77
N2,N6-diacetyllysine
2797309.23 2776228.62 2887384.92 2757209.19 2782878.62 2734991.54 3049516.54 2763256.85 2803886.62 2813193.62 2757495.92 2894293.69 2776647.31 2870095.23 2737315.92 2741732.69 2836660.62 2773817.08 2761050.00 2768682.88 2736784.15 2758920.38 2999683.64 2802336.85
N3-methyluridine
975160.54 876370.15 944629.77 929125.16 930191.23 938467.31 1021430.37 969539.69 927272.46 916032.15 903345.62 966263.85 933616.46 963694.54 930760.35 978337.42 1029519.77 932958.69 1005777.00 938739.42 913285.38 934814.62 996309.23 869921.00
N4-acetylcytidine
6141819.08 6229739.15 6503585.77 6371399.62 6394582.85 6314954.62 6696895.18 6274734.38 6147919.00 6368637.31 6265200.00 6150718.19 6119746.38 6302788.00 6311421.00 6452284.31 6393547.77 6311534.08 6130078.69 6276906.38 6298566.77 6276611.38 6823197.15 6393527.85
N6-succinyladenosine
3892024.15 3761199.69 3861070.62 3745424.69 3801631.00 3758669.08 4054951.85 3794309.54 3895730.38 3869081.92 3827686.62 3943445.84 3989091.77 3972284.08 3851367.69 3878771.46 3837644.15 3908182.08 3903970.69 3821333.15 3823047.08 3825772.85 4158577.18 3829957.92
N-acetyl-1-methylhistidine*
2107005.62 2398784.85 2451738.15 2341146.00 2246097.08 2202852.15 2353054.28 2434738.31 2221900.23 2405529.08 2535824.85 2450485.65 2096146.69 2356410.85 2419471.04 2594543.62 2081870.38 2220295.00 1845048.54 2221045.92 2399147.54 2175416.38 2514572.85 2666791.92
N-acetyl-3-methylhistidine*
1713821.85 1617245.08 1722927.54 1646420.46 1685727.31 1634414.23 2303389.87 1672557.23 1713234.08 1718790.69 1711337.69 1772170.46 1702102.69 1831165.92 1674998.46 1720896.62 1735645.46 1711933.08 1653315.08 1647424.50 1700522.15 1630824.15 2284344.03 1672379.69
N-acetylalanine
2536797.23 2572431.23 2306984.92 2563200.40 2511292.67 2460070.08 2878929.74 2197148.38 2692689.69 2675533.67 2761930.00 2631798.27 2247449.38 2832406.33 2626303.00 2852431.58 2581060.08 2602180.69 2745816.15 2660455.00 2570935.75 2564034.62 2759343.24 2295998.77
N-acetylasparagine
18780611.46 20715397.00 20839910.54 21434324.62 19662951.85 19642195.23 24860797.26 20691733.92 21565283.92 23604535.85 22206950.00 20453942.62 19814321.92 20985585.85 22598032.85 22956676.92 23755005.77 24572086.62 21201913.85 25170838.35 26214837.85 25175421.85 30132016.26 28737807.62
N-acetylaspartate (NAA)
35467312.77 33967146.38 35014143.31 33553323.42 33044700.85 34679044.38 36558966.74 34631806.77 34565036.92 32798588.69 32521733.15 34423592.42 32583294.62 32851451.31 32927661.12 31981287.54 35365321.62 32865491.54 35198377.31 33828350.88 32729987.85 33120176.85 35738823.28 31764813.46
N-acetyl-beta-alanine
9007005.92 9254900.62 9198895.77 9228706.62 8782659.54 8903666.46 10609962.21 9102770.69 8942297.92 8947579.46 8943852.08 9010498.00 8552192.92 9040729.31 8729708.69 9164995.92 9791228.85 10010333.23 9813188.54 9818043.58 9623119.69 9631363.31 10858015.67 10156297.46
N-acetylcarnosine
31994883.54 32519515.00 32805629.62 32716905.23 31547836.69 31471246.15 35975558.41 30817448.31 31706225.08 34386138.23 33044650.77 32223672.81 31446723.69 32974434.15 33186224.81 32203322.69 31820705.54 32448803.08 30893565.92 31874391.00 32269274.62 32804804.54 36542909.67 33026312.85
N-acetylcitrulline
7296149.85 6782399.23 7144100.62 6833445.42 7001200.92 6729535.77 8024882.51 6862363.92 7010172.54 6775136.92 6917561.77 7107813.31 7574216.92 7363295.62 6687669.77 6922189.46 7089786.38 6993866.92 7111697.00 6717234.92 6705858.46 6604279.38 7830321.67 6680277.23
N-acetylcysteine
4655209.91 4210350.92 5598664.82 3245182.82 4392767.08 4918019.82 5601392.89 3890184.45 5548434.00 4626532.67 4545018.08 4695866.24 4252566.91 5531760.18 5611630.64 4602382.92 4399214.73 4521285.17 5432730.75 3314463.41 4053516.67 4151413.58 4634413.68 3888597.00
N-acetylhistidine
13297812.92 12595630.46 12964645.08 12646110.73 12916544.69 12620010.77 14721832.67 12598960.00 12724365.54 12254816.31 12363606.92 12859176.54 13540252.08 13330139.69 12185315.04 12761968.92 12760510.23 12672163.62 12933584.92 12181611.69 11996432.69 11962622.00 14344754.18 12454360.23
N-acetylisoleucine
10548182.08 10265155.85 10767611.31 10485377.88 10145963.77 10749829.31 11498013.08 10726861.77 10530796.77 10465433.15 10395894.15 10713804.62 10117840.85 10576209.77 10373008.65 10409132.00 10812228.85 10408565.69 10659218.23 10343046.77 10169141.38 10712423.23 11449082.23 10432405.85
N-acetylkynurenine (2)
170923.80 190482.50 190804.20 186448.50 181119.50 177964.50 181627.94 184235.00 188498.10 185105.70 194406.30 204114.05 188577.50 184785.00 180702.15 193217.00 176868.20 171937.60 168992.80 185049.05 178513.30 182843.67 160104.82 184171.50
N-acetylleucine
2536954.23 2543271.92 2639120.38 2591623.23 2514177.31 2522632.92 2926245.97 2585323.00 2546320.69 2574559.69 2576045.15 2582982.08 2568038.38 2626096.85 2546594.62 2583852.23 2637379.62 2551594.85 2531607.46 2588586.42 2523845.38 2609478.62 2977704.82 2515277.54
N-acetylmethionine
449099.38 438585.00 466443.31 417195.12 445320.42 446026.08 462074.68 436212.38 464625.23 456795.62 454512.92 458219.42 416387.00 478856.62 474079.62 462302.85 435472.46 425302.92 451758.08 414060.46 402990.58 443162.23 444252.08 454712.92
N-acetylphenylalanine
3576444.85 3606338.38 3690893.31 3571031.69 3586682.62 3547354.77 4014201.18 3639266.62 3577060.77 3533959.31 3629218.31 3646990.08 3543132.23 3577099.31 3564834.88 3605967.69 3648768.00 3549149.15 3590111.77 3584435.27 3506695.00 3542961.54 4051018.23 3641969.08
N-acetylpyrraline
9426916.62 9479377.46 9682813.92 9678702.35 9119813.46 9291840.54 9518736.00 9660727.31 9341805.38 9175297.31 9214958.62 9420472.12 9246664.15 9375885.54 9129030.77 9234984.54 9622830.77 9292373.54 9251228.46 9267146.00 8942400.31 9418280.15 9487831.90 9216070.08
N-acetyl-S-allyl-L-cysteine
4259179.50 4172676.67 4250081.50 4264621.83 3986567.08 4208021.83 4086876.57 4391273.67 4232277.33 4309471.17 4405289.50 4295106.50 4163201.25 4321806.83 4226812.50 4367252.50 4306714.92 4215769.25 4238241.08 4187197.92 4019779.58 4223405.08 4187926.41 4364659.50
N-acetyltaurine
17468317.00 17996981.38 18867639.00 18088392.04 18095111.23 17155177.08 19536057.62 17868066.00 18288953.77 18809677.62 18657430.38 18208786.62 17841458.77 17887438.69 18211258.54 18747532.77 19036076.85 19005101.00 18481453.08 18811805.77 18947638.92 18646108.69 20755515.97 19896071.38
N-acetyltryptophan
1273233.69 1277647.92 1320074.92 1296362.08 1319405.46 1299422.92 1411330.23 1268890.08 1263894.92 1279823.92 1290671.23 1305461.15 1273632.00 1292032.62 1280605.00 1278852.31 1335444.85 1278443.85 1264139.08 1285378.54 1237513.69 1302907.62 1397420.41 1308873.31
N-acetyltyrosine
3790074.23 3773620.08 3878236.15 3767275.50 3687922.62 3717877.31 3988978.92 3729987.62 3697740.77 3709540.23 3762896.15 3805950.42 3689585.69 3718971.69 3713193.23 3751276.23 3743377.08 3770502.92 3676156.31 3692852.46 3644571.31 3730673.62 3968929.15 3817154.00
N-acetylvaline
11073683.15 10883506.69 11228126.69 10964795.19 11086692.31 10947458.69 11877458.92 11176580.62 11111828.08 11117981.77 11096490.85 11053863.42 10775973.54 11193802.46 10953912.92 10937302.69 11256467.08 10967223.77 10682155.23 10936350.27 10749019.69 10773609.31 11827322.36 11130804.38
naringenin 7-glucuronide
430195.45 395401.67 425266.91 494167.15 408986.58 416767.58 423426.44 425628.73 469931.73 428537.55 437928.64 436743.78 482258.00 432967.00 419936.36 433122.73 426273.67 503537.20 415983.67 443839.05 488953.20 394421.17 491436.39 474128.40
N-delta-acetylornithine
1834320.15 1814540.38 1859762.54 1727045.00 1723233.54 1692723.46 2151227.10 1761909.08 1842008.77 1717016.15 1781380.15 1734793.04 1763002.15 1713493.08 1623625.65 1762575.46 1833478.62 1650038.85 1839688.31 1728095.96 1706420.15 1751362.54 2235990.56 1758507.69
N-formylanthranilic acid
5882085.15 5959378.54 5809675.38 5980776.62 5812155.23 6003961.08 6176540.21 5880078.85 5836393.38 5724201.92 5738210.69 5938061.65 5920580.62 5754753.08 5690365.42 5865775.85 6149580.23 6260254.92 6214762.46 6248116.88 6018204.54 5984003.31 6276569.90 6054631.31
N-formylmethionine
2873209.77 2661136.85 2796034.85 2551937.04 2477538.31 2606645.54 3323328.36 2651300.23 2886054.69 2691880.85 2739504.62 2811744.50 2582122.85 2866850.31 2824952.19 2725280.15 2862468.08 2669617.46 2763202.23 2556891.69 2481979.15 2637794.08 3454474.90 2792560.23
N-methylhydantoin
654668.58 646964.44 551337.82 662957.76 524094.55 714968.44 601790.21 544017.64 799580.38 573331.56 420815.10 484481.95 385784.00 514977.00 561665.00 598703.55 526843.33 563807.17 581605.22 665839.89 528196.20 517116.57 540303.16 653099.44
N-methylpipecolate
1985078.67 1848242.00 1890656.92 1883042.42 1816200.23 1775842.69 2562668.05 1804248.15 1951323.00 1885482.00 1937659.08 1855849.81 1890777.50 1987794.33 1766515.92 1854749.00 1827051.62 1841077.31 1955671.69 1945125.40 1876845.23 1832131.92 2490572.67 1962698.23
N-octanoylglutamine
798582.92 777059.54 812714.00 769925.73 756189.85 764287.54 921616.23 771937.38 807353.38 805225.31 793276.23 809111.85 740943.62 779804.38 753466.38 776019.85 789538.46 779268.00 785115.69 753762.42 778806.00 761142.46 928689.62 777759.46
N-octanoylglycine
286390.73 314873.90 283590.25 287994.09 276044.73 264784.50 345789.50 351466.44 396229.67 299193.00 361194.50 315317.38 299299.43 301962.43 376560.92 369390.57 271672.69 284000.64 300129.45 288849.48 287133.45 306049.30 373664.83 341915.11
N,O-didesmethylvenlafaxine glucuronide
3552214.00 3517259.00 3543454.00 3425880.50 3497000.00 3545435.00 2521709.87 3424767.00 3299129.00 3224071.00 3861105.00 3795974.00 3519815.00 3443076.00 3610161.50 3307501.00 3230431.00 3485584.00 3402026.00 3289920.00 3091877.00 3386109.00 2611492.33 3696345.00
o-cresol sulfate
2355100.00 2323413.62 2351755.00 2314064.69 2291065.00 2273539.46 2570217.97 2288526.15 2372922.23 2271889.00 2362003.08 2353202.96 2259002.54 2331083.38 2290720.77 2279106.69 2314033.69 2330938.69 2327076.31 2300261.62 2294703.00 2317445.77 2552924.67 2403843.38
O-methylcatechol sulfate
113224323.38 112507378.77 114190344.46 113766928.46 111150401.77 112239815.15 124668055.03 113868626.62 111167253.23 111853682.46 114574616.15 112563246.85 110152920.31 112583653.54 111739160.50 114493139.69 114383657.23 115285988.31 112620856.31 113229049.23 111134912.62 112913446.62 126821420.72 113600395.38
O-sulfo-L-tyrosine
57170111.54 56348850.00 57761247.38 55194618.92 57525068.31 54725072.00 64165675.33 55768495.38 57451422.62 56522777.54 56791926.77 57063820.85 57213932.46 58746719.69 55750614.15 56353576.46 56154083.54 56988162.62 57393029.54 56013780.31 56256082.15 55615195.38 62877770.00 57027459.69
oxalate (ethanedioate)
23707096.85 23394949.08 22803381.62 23327685.62 22825825.77 23344080.77 23822192.38 24187976.62 25768102.23 24404515.62 24761646.77 26300682.58 25455828.38 24831159.15 24461861.42 23579758.62 23347505.38 21870874.69 22853628.31 23971689.58 22460961.46 22087894.46 23275742.08 21787874.15
pantothenate
179209376.92 168481466.31 177369766.15 173459898.23 183407699.69 163283429.85 219076713.44 175115109.69 176850117.38 187675540.62 173270706.15 171204234.77 174890881.38 184304034.00 171760916.54 183615014.15 173758864.46 179334988.77 175162017.08 175416277.92 168750282.77 173334148.46 212443109.54 183706516.92
paraxanthine
12414116.23 12027341.54 12306353.54 12225971.38 12003893.15 11934701.38 12859622.26 12074537.69 12143040.77 11872378.54 12365134.00 12213253.92 11719965.38 11868915.54 12038333.69 12242659.69 12227237.85 12241152.62 12350172.15 11968359.00 11641869.85 12056902.54 12877729.64 12416989.62
p-cresol-glucuronide*
126083109.77 124116093.46 130446907.69 128657937.96 125091969.31 129100627.69 140446087.18 130697144.77 124424317.62 127139253.00 128554115.77 125464028.69 125298010.77 123982457.31 125432155.46 126877936.69 125991678.54 122644433.31 128183175.31 125777097.15 119794049.46 126904872.08 141561533.49 128217553.62
p-cresol sulfate
2124580275.69 2058257518.77 2119607505.23 2124570600.00 2057985601.23 2142667325.54 2468316007.38 2145328128.00 2092517088.00 2104071505.23 2133548044.31 2121491145.85 2057078889.85 2117143106.46 2063627545.85 2112971840.00 2122802212.92 2120886072.62 2114652278.15 2103679714.46 2062878774.15 2105798508.31 2483918838.15 2144647091.69
phenol sulfate
675028640.00 680998476.31 686340829.54 688137603.69 661470409.85 693588115.69 845160859.08 675079619.69 683991271.38 680178646.15 683113544.62 690827064.62 674890715.08 675354491.08 675732151.38 697687693.54 683677240.62 691596936.62 687371798.15 682289972.92 662237726.77 682484337.23 850410612.51 695508898.46
phenylacetylalanine
4078806.54 4199130.23 4249429.92 4151849.85 4034723.85 4128575.08 4556268.10 4187344.15 4196429.38 4016414.31 4095721.15 4274414.65 4132440.23 4067258.23 4113633.46 4095314.62 4189123.69 4116410.54 4078875.92 4085829.96 3946754.00 4103680.23 4578806.69 4090964.08
phenylacetylglycine
6987992.38 6933881.38 7224616.38 7139328.65 6927186.85 7041218.31 7852895.41 7154950.69 7106354.54 7119442.08 7100802.77 7112987.27 7063997.54 7153584.15 7023167.58 7050961.46 7217436.08 7054061.77 6928178.38 7064683.88 6904335.92 7116040.92 8018090.92 6850112.77
phenylacetylmethionine
3121902.31 3052039.15 3264503.31 3011358.08 2755746.77 2928543.38 3363427.67 3023110.38 3119325.92 3077298.15 3138820.15 3074759.58 2948082.23 3137600.92 3169346.19 3225285.08 3169706.85 2902694.15 2927480.08 2848664.08 2681139.92 3037265.54 3466380.64 3127328.15
phenylacetylphenylalanine
130195.45 145214.00 157962.20 140558.52 131114.18 144579.90 147715.12 142588.82 149271.00 161643.29 143025.38 144129.05 153834.11 129165.30 138312.68 155967.00 145660.70 125235.50 132343.82 135143.86 141847.40 129665.09 146708.49 152252.40
phenylacetylserine
4344681.09 4301931.25 4670690.73 4653486.36 4425626.36 4342297.50 4709597.42 4587597.18 4673787.82 4595217.64 4355370.00 4165042.29 4103295.92 4358479.25 4260108.75 4622348.55 4468138.91 4514867.91 4336297.18 4420941.87 4606240.91 4563583.27 4861515.69 4372378.00
phenylacetylthreonine
3540902.92 3426655.85 3589333.00 3511839.50 3457855.23 3494292.31 3761961.67 3573351.92 3457456.54 3508727.15 3462126.69 3533394.62 3456998.31 3460518.08 3434260.04 3496925.46 3598105.77 3477282.69 3468620.08 3494296.77 3416748.62 3447466.92 3779627.33 3461413.92
phenyllactate (PLA)
2133069.69 2164760.17 2133759.23 2309811.84 2163910.92 2198788.17 2217893.44 2387713.75 2116151.85 2126731.00 2372537.42 2111563.19 2083885.83 2189123.62 2267830.92 2331843.50 2032319.00 2253144.75 2131753.67 2200311.04 1986646.62 2064494.54 2273906.14 2114985.31
phenylpropionylglycine
812234.62 830548.54 872404.38 891549.24 823357.77 862505.31 964403.59 840557.38 844122.85 841501.77 846270.92 851419.96 787769.85 845175.62 833997.19 836493.31 820934.46 841992.69 833663.92 870987.92 815694.38 820933.23 969894.87 851822.08
pregnanediol-3-glucuronide
11107480.38 10916738.85 11152258.69 11281893.85 10636987.54 11136020.92 16368308.49 11317542.54 10758093.46 10322469.77 10252815.23 10402507.88 10129423.69 10763116.54 10491509.85 10283725.00 11010318.00 10721127.46 10667481.77 10568753.15 10532199.46 10052136.54 16474895.79 10986253.62
pregnen-diol disulfate C21H34O8S2*
10911602.08 11052487.54 11402775.08 10693589.46 11484589.08 10330372.00 13781713.13 10764620.69 9899227.85 11038693.92 9363652.92 9171993.04 9196421.62 10807192.38 9464716.35 10247688.38 10766672.46 11114288.23 11638002.77 10651653.92 10059503.08 10992561.77 14372884.67 10901436.23
pregn steroid monosulfate C21H34O5S*
157942.33 185542.80 172521.20 187859.20 136687.83 154887.83 121631.28 201911.00 151968.17 149789.33 151374.67 158682.27 151746.00 167328.00 140289.45 159796.20 159639.80 134197.83 182640.80 166538.70 158972.80 156425.80 123525.83 182184.80
pro-hydroxy-pro
9621890.77 9692473.23 9665796.54 9510702.35 9120981.08 9588639.92 11323405.92 9109040.00 9781305.08 9601505.92 9653538.31 9374620.31 9240310.54 9086138.54 9082013.50 9016206.31 9897213.92 9454786.23 10384474.08 9546822.31 9277902.77 9578360.15 11805642.54 10447658.31
propyl 4-hydroxybenzoate sulfate
925070.00 1028981.62 1022026.62 1016020.94 997496.75 1059101.25 3073839.83 1023644.25 1030918.00 1028479.12 953526.12 1065463.44 941034.56 1013860.62 1001049.12 984964.88 1075520.38 1042941.62 1043270.75 983977.65 1056970.75 887362.22 3322927.79 919578.78
pseudouridine
209825923.08 213943791.38 216973617.23 210865047.69 215668422.77 203641554.46 223749157.74 212030244.92 210008824.00 216022441.85 217036033.85 213829342.77 210517715.08 215198651.08 209647685.85 214005315.08 215932577.23 214739515.69 211185733.54 214635783.38 211183790.15 207667442.46 225606174.15 220014475.08
pyridoxate
442038701.54 435369720.62 453822136.62 443948211.69 430691549.54 436613437.54 697717430.77 447313086.77 449701096.31 442734452.92 447562218.46 444921153.23 427642230.77 439480917.54 437559404.92 439489740.92 453811607.38 442158128.62 440764658.77 442449468.15 429252279.38 439811315.08 674827547.08 449956965.54
pyrraline
7590208.77 8756324.54 8605711.23 8260401.08 7344988.77 7985761.15 7914717.41 8314609.15 8294891.08 7974302.92 8502934.00 8128483.12 7269578.15 7554581.54 8051610.00 7741488.46 7858421.85 8025140.54 7478451.62 8082011.96 8236926.38 8174306.69 7862743.74 8409730.08
S-(3-hydroxypropyl)mercapturic acid (HPMA)
4147495.23 3997733.92 4185236.54 3963296.27 4256523.92 4004680.54 5532513.72 4052327.62 4212155.62 4066216.00 4163745.23 4310164.54 4249069.85 4453663.54 4262721.73 4092323.46 4247537.23 4253353.08 4240905.00 4033720.23 4122706.77 4069489.69 5698796.49 4111430.62
saccharin
3327770.50 3509112.17 3494292.58 3399914.25 3280077.58 3290097.17 5449262.46 3516820.83 3259147.00 3445670.58 3631462.08 3398524.50 3362006.83 3470505.50 3411309.50 3689010.67 3266110.42 3429266.17 3154284.33 3385165.88 3446783.00 3497613.00 6403828.51 3711003.42
S-adenosylhomocysteine (SAH)
625130.83 600099.15 616458.46 645914.91 575938.15 587500.85 640621.71 594822.38 618286.08 585690.15 586253.92 636538.74 622924.08 615223.33 606145.31 617601.92 582187.50 600225.00 621537.83 613987.70 596269.50 591172.83 634726.26 662709.91
salicyluric glucuronide*
5692817.77 6639932.85 5715860.38 5823274.12 5524785.85 6070741.54 8216521.69 5464777.08 5999600.00 5544048.62 5747369.85 6506258.62 6501234.46 5800260.92 5853873.88 6232887.38 5894013.08 6202446.15 6051281.23 5879935.35 5942530.38 5469088.23 8288602.74 5607431.23
sebacate (C10-DC)
2419009.54 2404361.23 2386453.38 2469060.81 2454873.23 2374400.38 2378388.44 2480804.77 2390851.46 2391978.54 2367486.69 2474592.38 2283918.00 2341549.38 2432075.81 2453969.31 2376934.08 2469676.54 2377380.54 2499955.88 2395572.77 2311000.38 2432501.49 2407146.85
succinimide
1494501.92 1473155.00 1295410.46 1356248.35 1348967.62 1365134.38 1525235.32 1267687.67 1309819.92 1164118.92 1295936.92 1276183.38 1247240.23 1291244.42 1214683.92 1386018.46 1281453.92 1311455.33 1295885.69 1270994.52 1342713.25 1240022.25 1402977.65 1362791.58
sucralose
1038111.78 980224.22 1029020.67 1038476.72 1007413.00 1007573.22 2110317.00 1010831.00 1049727.00 1051501.56 979873.33 1032051.83 1003784.22 1035300.56 1017626.28 1126646.00 1072534.56 1019122.89 1053357.44 1062065.00 994198.33 1030613.00 2069502.32 1012057.44
sulfate*
486402808.62 483031325.54 483388374.15 479549523.69 486504132.92 475542380.31 616548775.79 483707476.92 500975654.15 486893085.54 501484579.69 499885463.38 498121998.77 499447284.92 491096808.62 498603022.77 514713356.31 514612523.08 517543691.08 515283971.69 513106440.62 500027158.15 637750800.00 495665485.54
syringol sulfate
834226.00 867161.92 836146.92 865172.15 861904.46 859368.77 1020860.67 868791.38 823079.31 866596.46 855096.46 864026.54 832121.92 885377.08 889583.42 910077.31 879001.54 917867.23 903608.85 891530.42 863985.31 873481.15 1064929.23 862345.92
tartarate
10948465.38 11180575.92 12172373.17 11287808.88 11103518.75 11541771.92 13095743.00 10895588.08 9366797.46 9691133.83 10083538.00 9579754.20 10610605.91 9243163.00 9171022.20 9782590.42 11267191.91 9898367.33 10307966.42 10065633.54 9649981.58 9016619.77 11307658.78 9740603.67
taurine
63103986.62 60155943.77 62453253.38 61500227.81 61155112.31 60980355.38 70252437.97 60802955.69 77362550.54 76843568.54 75442064.38 75576689.96 73073026.54 76535897.00 76628461.73 74264235.85 81835166.08 82235805.92 82999608.15 82191315.54 82443643.62 81232048.23 84347428.23 83923914.23
tauro-beta-muricholate
319565.90 357229.44 329396.50 340086.11 313451.00 326054.60 336149.06 325330.80 364248.00 336904.40 370651.11 348344.44 324513.40 344819.89 332874.74 314939.30 350575.44 370494.00 364426.56 342569.26 313072.10 345577.11 324578.41 380411.00
taurocholenate sulfate
1273249.46 1273435.62 1257467.31 1193163.65 1214646.54 1125411.85 1450708.79 1183193.54 929532.75 1052620.75 899027.58 821492.62 1077630.10 973292.82 982743.61 1014616.17 1149335.38 1127099.23 1176905.77 1100233.23 1040716.69 1135949.54 1556654.85 1288848.62
taurolithocholate 3-sulfate
2489425.62 2121277.23 2226103.08 2058435.96 1793296.46 1748574.23 3344411.59 2160621.15 1627628.60 1718024.60 1416382.20 1353323.71 1671367.89 1298338.55 1549528.05 1725324.30 2059665.23 1776903.00 2064621.08 1650230.62 1493056.85 1797345.15 3066876.92 1768004.69
tetrahydrocortisone
480632.30 363312.38 503331.18 490776.61 441330.50 406883.15 529106.51 392509.54 504963.08 496912.83 473236.46 577064.44 464124.00 555547.82 481651.44 558405.64 515522.42 592353.80 493333.64 605836.95 460098.67 535483.55 613758.69 520715.42
theophylline
9648631.69 9260680.54 9416751.00 9416081.08 9463411.69 9235560.00 10187059.18 9154672.77 9533533.46 9270146.23 9573647.31 9752700.77 9251109.15 9327247.69 9422034.77 9193822.77 9508163.31 9012124.38 9717381.23 9268032.77 9233504.69 9304084.92 10083135.92 9280596.69
thymine
1359070.31 1383843.31 1420138.00 1406147.54 1331928.00 1304460.08 1475161.87 1385211.15 1363371.77 1400487.54 1430711.46 1332759.08 1351061.54 1349699.54 1309604.31 1391946.31 1357129.62 1412366.46 1311495.85 1387497.69 1348040.00 1307522.85 1469740.46 1485678.31
thymol sulfate
4007603.77 3978788.92 4050818.92 4109972.12 4180445.50 3748462.46 4111340.59 3893475.77 4221305.33 4076445.85 3970239.23 3873069.46 4076726.67 3912794.92 3830901.77 4301131.58 3853372.15 3958122.08 3882950.85 3798186.62 3777763.77 3911610.00 4138562.23 4070591.08
trans-2-hexenoylglycine
7001819.15 6812238.54 7182522.62 7015531.81 6993045.15 7025465.54 11613712.54 7136145.38 7019170.23 6948012.77 6943274.31 7121727.31 6903084.23 7134194.08 6921991.73 7008706.23 7229308.31 7188727.85 7003686.31 6966158.31 6936343.00 6773716.77 11551566.36 6967592.92
trihydroxybutane
805357.00 904560.09 857220.08 938045.04 936729.11 812425.69 951896.20 878090.08 893557.92 859089.08 906205.46 913586.83 869225.85 794548.09 889166.46 855801.08 830849.42 875823.25 890141.55 840712.00 856191.64 920444.00 914905.97 979834.64
tyramine O-sulfate
1967820.17 1818497.62 1900599.69 1813898.40 1690842.18 1849154.54 2039555.53 1889987.15 1796997.38 1817322.17 1807282.38 1856890.58 1882888.50 1871433.33 1727624.67 1790850.17 1961015.77 1920961.08 1869464.92 1914726.44 1775817.46 1944584.33 2151210.95 1915137.75
umbelliferone sulfate
11232290.23 11052610.38 11116129.77 10744437.31 10719869.62 11158855.15 12896824.79 11403536.23 11496226.23 11015886.46 10630882.54 11616240.35 11492520.38 11266174.62 10967133.54 10526582.31 11970169.62 11767674.23 11663751.85 11472178.31 11400907.00 10166279.15 13284223.69 10961299.15
uracil
15883326.77 15559663.00 15728762.46 15683621.88 15542701.54 15550144.31 18031835.18 15967756.85 16006478.00 15785447.54 16255717.23 15878811.73 15383099.92 15974644.38 15428687.50 16108564.62 15827336.31 16313133.38 16006351.69 15807618.77 15774116.00 15457823.38 18038999.97 16580209.00
urate
940946798.77 952375320.62 943398045.54 948214796.31 920796504.62 941291340.31 1011135754.67 960549824.00 848465038.77 844367138.46 885746089.85 839788720.00 854063940.92 833076886.15 829208632.62 851426828.31 893526643.69 901584206.77 900363438.77 928379420.31 911611561.85 899666626.46 1007564645.74 915066107.08
uridine
1306407.69 1303611.23 1354408.77 1347091.73 1272899.77 1318640.38 1449652.69 1282584.69 1420742.69 1310623.00 1343148.54 1510284.12 1323813.85 1361155.46 1342788.08 1306208.15 1442642.54 1291849.15 1421703.00 1407616.92 1347464.08 1313720.92 1445493.97 1292281.00
Urolithin A
2794182.80 2212618.00 2595800.00 2299916.08 2177512.33 2508574.00 4251644.38 2378116.67 2512077.67 2137925.83 2493634.33 2966589.83 2819608.40 2322550.33 2579611.36 2350237.83 2672901.00 2218198.00 2636078.00 2572753.83 2328739.60 2528131.00 4148617.54 3011617.20
ursocholate
336572.64 322404.75 339802.42 317027.91 328775.82 309416.45 383539.17 339641.64 307758.55 326276.00 333234.36 296383.96 263393.00 308941.33 306725.30 309136.58 296553.45 320983.55 322133.18 318837.41 313154.50 309122.58 364423.97 323225.18
vanillactate
2518236.38 2448116.00 2580008.92 2486940.77 2442971.31 2422930.23 2631538.23 2460138.31 2451262.23 2473207.15 2428678.00 2441929.15 2368231.15 2468405.54 2452869.08 2415272.31 2416305.15 2411669.69 2385817.69 2431926.85 2399487.15 2428859.08 2662014.77 2491513.54
vanillate
3607465.25 3668976.31 3777273.33 3360727.08 3278253.31 3340050.85 3943698.42 3631150.15 3488980.92 3109990.54 3495444.83 3422840.77 3310090.00 3372487.31 3467432.76 3378155.42 3438359.31 3317187.46 3104939.62 3351047.23 3335657.31 3310860.15 3954936.21 3506164.69
vanillic alcohol sulfate
18573075.25 17213183.46 18605527.25 17844913.60 18550229.00 18073891.54 27331413.00 18028274.33 17225054.62 18501951.75 18214742.42 17592085.15 18063040.46 18775285.42 17399906.60 17386024.54 18781617.33 18173941.31 18131455.69 18364149.96 17556683.33 18942361.92 28971246.87 18885017.42
vanillylmandelate (VMA)
59678432.77 56729440.00 59076058.15 56142537.54 59239800.77 55041804.77 62527879.44 56150164.31 59333746.92 58349291.54 56878741.69 59028568.31 60110625.23 59713994.46 56727458.08 57516199.54 57707265.08 57529045.85 59140389.69 56462441.38 55230686.62 55791704.92 62120595.38 56140066.92
xanthosine
3410228.77 3481956.46 3529410.08 3396054.27 3380895.00 3305026.85 3886866.95 3453838.69 3484721.38 3437257.15 3598239.08 3579884.38 3536817.54 3537843.23 3455667.00 3447331.23 3472393.23 3661182.46 3560457.31 3523449.35 3549240.69 3425804.38 4039186.87 3629891.00
xanthurenate
5320992.92 5096956.92 5319408.31 5127679.04 4977865.92 5150376.54 5364942.90 5138817.00 5077794.08 5201764.85 5143497.77 5110476.69 4990409.54 5214181.92 5021485.81 5097096.00 5158653.69 5121820.38 5141432.00 5102946.19 5053194.08 5099409.23 5205699.38 5181871.92

Factors:

F1preservative:Borate | fridge_store_time:0 | thaw:1 fridge
F2preservative:Borate | fridge_store_time:0 | thaw:1 ice
F3preservative:Borate | fridge_store_time:0 | thaw:1 RT
F4preservative:Borate | fridge_store_time:0 | thaw:4 fridge
F5preservative:Borate | fridge_store_time:0 | thaw:4 ice
F6preservative:Borate | fridge_store_time:0 | thaw:4 RT
F7preservative:Borate | fridge_store_time:0 | thaw:none
F8preservative:Borate | fridge_store_time:24 | thaw:none
F9preservative:chlorhexidine | fridge_store_time:0 | thaw:1 fridge
F10preservative:chlorhexidine | fridge_store_time:0 | thaw:1 ice
F11preservative:chlorhexidine | fridge_store_time:0 | thaw:1 RT
F12preservative:chlorhexidine | fridge_store_time:0 | thaw:4 fridge
F13preservative:chlorhexidine | fridge_store_time:0 | thaw:4 ice
F14preservative:chlorhexidine | fridge_store_time:0 | thaw:4 RT
F15preservative:chlorhexidine | fridge_store_time:0 | thaw:none
F16preservative:chlorhexidine | fridge_store_time:24 | thaw:none
F17preservative:none | fridge_store_time:0 | thaw:1 fridge
F18preservative:none | fridge_store_time:0 | thaw:1 ice
F19preservative:none | fridge_store_time:0 | thaw:1 RT
F20preservative:none | fridge_store_time:0 | thaw:4 fridge
F21preservative:none | fridge_store_time:0 | thaw:4 ice
F22preservative:none | fridge_store_time:0 | thaw:4 RT
F23preservative:none | fridge_store_time:0 | thaw:none
F24preservative:none | fridge_store_time:24 | thaw:none
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