Data for ST000726   

(Analysis AN001139): Average values per metabolite and experimental factor (Units:Peak area normalized)

Metabolite structureAll dataF1F2F3F4F5F6F7F8F9F10F11F12F13F14F15F16F17F18F19F20F21F22F23F24F25F26F27F28F29F30F31F32F33F34F35F36F37F38
16:0-18:0 PC (M+H)+
169272.00 131169.50 184093.00 95548.67 262596.50 95224.00 104855.33 138359.00 189815.50 55637.50 132800.00 53008.00 199104.50 154263.50 135829.00 109869.00 182420.00 68226.00 116402.00 43852.00 148919.00 75601.00 143126.00 92708.00 142952.00 43270.38 148943.00 90590.50 124697.00 128655.00 157562.00 73845.33 162671.00 89414.00 145876.00 51012.00 115071.00 102413.00
16:0 LYSO PC (M+H)+
17329883.50 20352232.50 16408715.67 12291346.67 25423763.50 17281436.00 19570756.33 26775954.50 27264226.50 13387087.00 12322925.00 7384842.00 21880636.50 24745602.50 28919633.00 28175443.00 21358696.00 13753795.00 15492752.00 11116082.00 17138330.00 14181486.00 16994740.00 16580313.00 17511676.78 10150012.67 27482568.88 22069958.17 32339595.00 26358643.00 21006354.67 13529332.67 27983554.00 23740820.00 19699082.00 12192808.00 20634853.00 22764919.00
16:0 LYSO PC (M+NA)+
7306358.00 7004344.50 6985702.33 6477965.67 7967321.00 6960316.00 6529981.00 6425115.50 5736034.50 5973575.00 6812852.00 4883269.00 5982015.50 6160777.50 5266141.00 5072288.00 7665928.00 7000130.00 7204838.00 6636697.00 7630833.00 7310632.00 7399578.00 7334956.00 7329498.33 6037380.67 5660731.62 5883530.50 5265487.00 7670242.00 7479259.00 6664247.67 6089854.00 5764621.00 7550831.00 6686679.00 7668033.00 7903102.00
18:0 LYSO-PE (M+H)+
74252.00 102855.00 106702.00 68375.67 80001.00 56730.00 83650.00 96666.50 89662.50 - - - 92367.50 71565.00 128080.00 117464.00 78469.00 - 80916.00 41290.00 - - 71748.00 56534.00 84890.50 45636.33 82130.00 81039.75 84885.00 64928.00 93934.33 56551.00 74718.33 76763.00 93256.00 - 98670.00 107573.00
1-METHYLADENOSINE (M+H)+
5387.50 5603.50 9339.33 9703.33 5187.00 5003.00 8033.00 12857.50 7656.50 6029.50 7543.00 8659.00 5322.00 6298.00 7816.00 8152.00 6991.00 5502.00 9039.00 8720.00 5906.00 5043.00 7022.00 7499.00 6814.56 6709.44 8906.38 10207.00 8519.00 6852.00 7015.67 6820.00 8876.33 9075.33 5461.00 5847.00 7157.00 5953.00
1-METHYLXANTHINE (M+H)+
1721612.50 1392244.00 1759591.33 1273673.00 1439792.50 1190730.50 1053226.33 1470265.50 1687805.50 1196153.50 1664351.00 1202963.00 1290710.50 1329335.50 1970299.00 1643807.00 2034272.00 1387043.00 1869528.00 1388289.00 1646567.00 1364408.00 1606929.00 1207253.00 1769166.22 1245819.67 1624142.62 1370246.50 1646030.00 1074117.00 1954997.33 1454140.33 1651088.67 1393634.33 1790487.00 1211701.00 1585955.00 1183430.00
2-DEOXY-D-GLUCOSE (M+NA)+
132024.50 134009.00 85449.67 122617.00 70619.50 86224.00 202949.00 205370.50 46872.50 62301.50 38170.00 50631.00 86397.00 76608.00 85248.00 53627.00 116495.00 136047.00 114593.00 135858.00 76403.00 72433.00 75929.00 136230.00 108333.44 142781.78 110131.25 142342.67 81619.00 98328.00 83671.67 127837.00 79156.67 73047.67 112978.00 136079.00 101095.00 94409.00
3-DEHYDROSHIKIMIC ACID (M+H)+[-H2O]
35942.00 45997.00 25473.00 42314.33 37421.00 51954.00 46980.33 64694.50 36541.00 51426.50 22517.00 26904.00 59438.50 57577.00 35514.00 45731.00 40108.00 50792.00 41126.00 49207.00 58963.00 35971.00 34945.00 49315.00 27158.89 41619.89 37153.75 47702.20 31602.00 38267.00 31095.00 46955.00 42016.33 41146.33 44049.00 55091.00 40748.00 77029.00
3-HYDROXYBENZALDEHYDE (M+H)+[-H2O]
48323.50 229857.50 116969.00 51706.00 94168.00 205154.00 69100.50 525038.50 99325.50 323460.00 21443.00 13823.00 31939.00 299605.50 21712.00 310642.00 110933.00 42056.00 53467.00 24229.00 249618.00 627120.00 75496.00 33807.00 69391.67 32577.78 42040.00 406779.17 677090.00 897649.00 61142.33 31609.00 30236.67 484730.67 112080.00 38327.00 52671.00 278552.00
3-METHOXYTYROSINE (M+H)+
27094.00 26914.00 23012.00 17816.00 24489.50 23754.50 12547.67 21723.50 21580.00 17705.00 21505.00 19773.00 16975.50 26800.00 18604.00 17672.00 22039.00 16720.00 24066.00 24884.00 23169.00 21725.00 30989.00 27417.00 21661.00 21673.00 17935.38 17348.17 19027.00 28997.00 30991.67 31498.33 30831.33 26988.33 31006.00 26963.00 26778.00 23708.00
5-AMINOPENTANOIC ACID (M+H)+
1326485.50 1011387.00 1348370.67 1018559.67 1198864.00 997831.50 778132.33 1073407.50 1354489.50 880851.00 1499375.00 1297960.00 1004785.00 1142735.50 1338955.00 1219663.00 1383711.00 840529.00 1478868.00 1058401.00 969717.00 824984.00 1296871.00 826093.00 1321165.44 956314.11 1159784.38 1065601.33 1116099.00 794215.00 1306405.33 1017046.67 1136733.67 937478.67 1211741.00 1043410.00 1106585.00 864555.00
5^-METHYLTHIOADENOSINE (M+H)+
7957.00 5430.00 6887.67 6486.00 5318.00 4039.00 5470.00 4201.50 7177.00 4268.00 7685.00 5733.00 6846.00 5134.00 3847.00 1991.00 9596.00 6196.00 6338.00 6657.00 2929.00 4239.00 6187.00 6054.00 6053.78 5377.67 3873.40 4176.80 - 2698.00 7244.33 6001.67 3863.50 3171.00 6076.00 4989.00 - -
5-OXOPROLINE (M+H)+
134255.50 167540.00 122686.67 140208.67 152827.00 130375.00 268134.33 237015.50 166536.50 133153.00 168807.00 131735.00 141912.00 147492.00 185003.00 211357.00 145525.00 117032.00 128628.00 163764.00 154097.00 117413.00 111297.00 107641.00 138135.11 128989.12 228495.75 197742.83 209595.00 136392.00 121957.00 134223.67 191741.67 190513.67 146987.00 135982.00 177088.00 227170.00
ACETAMINOPHEN (TN TYLENOL) (M+H)+
- - - - - - - - 5911.00 - - - - - - - - - - - - - - - - 2506903.00 - - - - 19818.00 12218.00 2020.00 - - - 10226.00 -
ACETAMINOPHEN (TN TYLENOL) (M+NA)+
5316.50 3679.00 10929.33 10446.33 5245.50 4476.50 6970.00 6319.00 4992.50 3659.00 5128.00 3987.00 4830.00 3529.00 4860.00 4432.00 7286.00 6589.00 5217.00 5452.00 4378.00 - 3987.00 - 4749.78 277586.78 5123.67 5179.17 - - 22583.67 15137.00 4733.00 5520.33 - 3778.00 4077.00 19320.00
ADENOSINE 5^-MONOPHOSPHATE (M+H)+
7461.00 9346.50 6631.00 14046.00 7832.00 77373.00 - - 9184.00 8105.00 6712.00 - 19595.50 - - 7997.00 - 21524.00 - 6537.00 3467.00 26569.00 - - 7918.86 7433.83 22414.67 24700.00 15536.00 3284.00 8003.67 7459.00 - 11795.50 17687.00 22128.00 - -
ALPHA-LINOLENIC ACID (M+NA)+
257404.50 84869.00 390183.33 89806.67 269806.00 99224.50 443814.00 142911.50 261838.00 56672.50 399930.00 108357.00 157932.50 115476.00 212418.00 138171.00 219411.00 36659.00 224061.00 9327.00 276783.00 8872.00 358383.00 64595.00 299684.33 73947.00 282861.12 162358.50 277548.00 126535.00 357860.67 64227.67 327329.33 138532.00 150689.00 44777.00 199049.00 112519.00
ALPHA-TOCOPHEROL (M+H)+
65932.00 55145.50 79523.00 77519.33 54813.00 36193.50 54746.67 59742.00 54819.00 47140.50 74732.00 82457.00 41701.50 56340.00 50975.00 - 62180.00 65538.00 73609.00 61290.00 47140.00 44527.00 72135.00 98064.00 85684.89 67219.89 63347.00 59448.50 34147.00 53053.00 78377.33 69285.67 56229.00 27900.33 64196.00 68522.00 63041.00 36140.00
ASPARAGINE (M+H)+
3311.50 3030.50 6861.33 5676.00 5543.00 2645.00 3232.50 3077.50 7732.00 5062.00 3361.00 - 6922.00 7647.50 - - 10838.00 3835.00 5448.00 4824.00 4156.00 - 6057.00 4980.00 5125.56 4477.71 7568.17 6500.40 - 4091.00 4193.67 3087.00 7563.00 5762.33 9630.00 6800.00 - -
BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+H)+
104397.00 99172.00 101488.00 127525.33 91714.50 84105.00 105283.67 123323.50 107192.00 103267.00 133340.00 146478.00 164223.50 119956.00 143041.00 129210.00 88118.00 162559.00 133293.00 126867.00 115871.00 114263.00 141762.00 150441.00 118190.11 92555.67 129312.62 117705.50 112507.00 120167.00 139126.67 106957.00 139755.67 122180.33 91383.00 95181.00 100763.00 89464.00
BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+NA)+
656599.00 572552.50 788102.00 888023.67 545556.00 510931.00 802650.67 854297.50 679321.50 577138.50 914844.00 933049.00 1013981.00 747038.00 833800.00 690776.00 649392.00 857067.00 948179.00 741468.00 726595.00 624961.00 826659.00 832942.00 815494.89 596185.67 872061.25 838673.17 777808.00 625729.00 989351.00 736260.67 948461.67 770673.00 610603.00 549878.00 657712.00 609229.00
BUTYRYLCARNITINE (*) (M+H)+
533388.50 411400.00 143392.67 125488.00 273436.00 163716.00 71168.67 162581.00 246932.00 345424.50 224536.00 119641.00 297655.00 383362.00 160010.00 334915.00 144058.00 351219.00 91048.00 81325.00 258473.00 92725.00 240140.00 216276.00 201205.33 158821.22 188364.25 175400.33 72161.00 261837.00 183637.00 180564.00 179024.33 213598.67 112189.00 72735.00 205772.00 166075.00
CAFFEINE (M+H)+
30107.50 180646.00 486985.00 268827.00 33440.00 23293.00 104552.67 486225.50 118712.00 64680.00 - - 72785.50 273121.00 - - 88929.00 35782.00 32356.00 17072.00 2131940.00 1725593.00 9020.00 1539.00 29700.00 13799.33 247832.29 157263.20 157040.00 533366.00 462253.00 223763.00 170599.00 138491.00 51394.00 26133.00 197439.00 154514.00
CARNITINE (M+H)+
71233.00 179707.00 131054.67 134500.00 145959.00 376690.50 118802.00 140000.50 182034.50 123015.00 531950.00 570411.00 327003.50 228355.00 117146.00 91974.00 28343.00 144982.00 415776.00 146990.00 232365.00 163754.00 480754.00 193030.00 166472.56 266113.67 104183.12 122652.50 109936.00 349284.00 127431.00 246838.33 40592.67 114754.67 32492.00 657806.00 509670.00 560215.00
CHOLESTEROL (M+H)+[-H2O]
624451.50 549789.50 692787.00 620951.67 602521.50 600753.00 608022.67 635045.50 609753.00 434828.50 692547.00 626295.00 705294.00 633597.50 622247.00 602507.00 736579.00 597298.00 656139.00 490865.00 811906.00 617624.00 738635.00 741323.00 697128.89 472049.11 642527.38 568798.50 601061.00 666471.00 587820.67 517972.33 583402.33 490911.33 680053.00 545924.00 700849.00 674820.00
CHOLINE PHOSPHATE (M+H)+
10871.00 16361.00 10470.33 14177.00 - - 10074.00 35574.00 8411.00 15997.00 10500.00 - 17607.00 10268.00 9506.00 - 10146.00 11735.00 9602.00 18341.00 - - 11977.00 4572.00 10613.62 13876.43 14922.60 33712.33 - - 10502.67 12911.67 9869.67 11886.67 15439.00 16671.00 14206.00 -
CITRIC ACID (M+NA)+
254783.50 227934.50 270347.67 168740.00 237828.00 280629.50 117804.00 269964.00 309912.00 238619.00 254344.00 194238.00 160277.00 220062.50 179022.00 158140.00 298027.00 229396.00 262599.00 177060.00 291871.00 237197.00 290240.00 289996.00 225989.44 199221.56 162091.25 150324.00 184850.00 269279.00 250926.67 193808.33 217631.67 205775.67 291353.00 240612.00 239464.00 154840.00
CREATININE (M+H)+
44362.00 32399.00 47504.00 54459.00 66203.50 71872.00 44342.67 86965.50 - 20357.50 - 69689.00 60898.00 56952.50 - 51255.00 43020.00 93706.00 57217.00 35792.00 58353.00 55169.00 80712.00 75460.00 47323.11 49201.67 43289.12 59227.50 27534.00 30275.00 56012.33 70913.00 41863.00 25383.33 41556.00 59789.00 50630.00 35397.00
CYSTATHIONINE (M+H)+
14583.00 12335.00 11833.67 12242.67 12131.00 10622.00 16306.00 15403.50 12767.50 11307.00 13447.00 7351.00 11173.50 10643.50 10651.00 - 14179.00 12193.00 12878.00 13847.00 6721.00 6563.00 12172.00 11121.00 11990.00 12512.75 11712.86 14165.17 5158.00 6829.00 11202.00 11968.00 10291.67 10202.00 11375.00 11022.00 11273.00 13322.00
CYTIDINE 5^-DIPHOSPHOCHOLINE (M+K)+
18107.00 13787.00 13497.00 17266.33 11969.00 14052.50 - 14059.00 13943.50 15083.50 21893.00 13016.00 5854.50 11439.50 10939.00 7468.00 19422.00 16405.00 16482.00 19664.00 8613.00 2865.00 10960.00 17954.00 14630.67 14610.00 9179.80 9467.25 4138.00 7184.00 15433.67 18970.00 13159.33 9085.67 10094.00 15177.00 11229.00 12008.00
DECANOIC ACID (2M+NA)+
24817.50 25796.00 35059.33 11468.00 20656.00 17574.50 52803.33 37066.50 25581.50 23152.50 44934.00 50000.00 22057.50 85291.50 37621.00 40793.00 9700.00 - 35390.00 36845.00 21179.00 14440.00 22645.00 39264.00 24509.67 29922.71 32830.62 38133.80 158478.00 - 26535.33 42088.33 111204.67 76730.67 14481.00 23091.00 21618.00 16381.00
DECENOYLCARNITINE (*) (M+H)+
85043.00 32697.00 28236.00 19395.00 46688.00 43877.50 28694.00 33536.00 65716.00 21666.00 - - 58279.00 51058.50 141533.00 64630.00 96443.00 25249.00 31869.00 - - 64828.00 6822.00 6037.00 41884.62 21097.44 35663.80 25107.50 - 58710.00 51615.00 31902.67 21273.50 37331.33 43104.00 17507.00 38662.00 28646.00
DETHIOBIOTIN (M+H)+[-H2O]
11099.00 - - - - - 2088.00 15229.00 - - - - 7218.00 7760.00 4405.00 3666.00 - - 15782.00 7343.00 - - - - 3908.50 4772.00 5384.80 4707.00 - 3823.00 1212.00 3622.50 - - - - - -
DODECENOYLCARNITINE (*) II M+
41383.00 3952.00 38817.33 3613.00 98109.50 14862.00 20779.33 7159.00 78508.00 - 110882.00 40396.00 12537.50 13453.50 196265.00 47398.00 73417.00 - 41939.00 7022.00 133278.00 29606.00 48686.00 - 39054.89 9025.50 49358.75 11185.00 31842.00 44559.00 61697.67 12655.00 48129.33 15235.50 16369.00 7177.00 54448.00 9864.00
DUMP (M+H)+
7398.50 10433.50 9783.67 19462.67 6725.50 14885.50 28121.33 28860.00 5554.00 15174.50 5458.00 5692.00 10681.50 9711.00 6763.00 6910.00 6640.00 14942.00 7308.00 10777.00 4754.00 6968.00 8406.00 26505.00 8492.78 13801.56 12864.88 21953.50 7324.00 7536.00 8896.00 18391.33 7196.00 14827.00 9475.00 11734.00 8803.00 13476.00
EICOSANOYLCARNITINE (*) (M+H)+
6070.50 4077.00 5847.00 2303.00 6792.00 2514.50 5511.50 2898.50 5263.00 3388.00 3907.00 3412.00 5602.00 4104.00 3042.00 1025.00 5779.00 3012.00 - - 4223.00 - 4527.00 3780.00 5044.12 1363.33 6204.86 4248.75 4607.00 3471.00 5125.67 2446.50 3794.50 2464.00 6232.00 - 1768.00 1963.00
EPIANDROSTERONE (M+H)+[-H2O]
- 1396.00 9178.00 10711.67 - 2507.00 10477.00 11454.00 8053.00 6168.00 - - 8146.50 14825.00 2738.00 - 11925.00 7907.00 3872.00 9345.00 2197.00 4732.00 11855.00 10320.00 13088.22 11673.22 10646.00 10892.17 21925.00 17732.00 16079.33 15754.00 9940.33 12011.00 3817.00 - 3735.00 -
EPIBRASSINOLIDE [ISTD] (M+H)+
2231762.00 2271994.50 2123548.67 2173487.00 2263556.50 2283731.00 1660169.33 2186709.50 2174585.00 2311006.50 2314470.00 1800403.00 2228616.50 2257846.50 2122157.00 2122885.00 2325071.00 2257452.00 2264805.00 2345140.00 2238179.00 2249626.00 2188544.00 2292542.00 2165648.33 2140079.00 2122751.62 2161798.00 2222586.00 2160634.00 2199557.00 2277300.33 2241467.00 2239632.33 2210825.00 2195864.00 2155983.00 2272065.00
EPIBRASSINOLIDE [ISTD] (M+NA)+
2489191.50 2442005.50 2249899.33 2261903.33 2456497.50 2424364.00 2040502.00 2379268.50 2298721.00 2385722.00 2515443.00 2155404.00 2431125.50 2439863.50 2360377.00 2263638.00 2495440.00 2419374.00 2447269.00 2487374.00 2447308.00 2412767.00 2471487.00 2454741.00 2365086.44 2298873.44 2368713.75 2362037.50 2424683.00 2331582.00 2353976.00 2390147.00 2472500.67 2402639.67 2405516.00 2413520.00 2392435.00 2449915.00
ESTRONE (M+H)+
16733.00 9915.00 12315.33 13968.33 11860.50 12275.00 9920.00 7137.50 12228.50 16791.00 15190.00 13885.00 20161.00 11740.00 12035.00 14225.00 15706.00 22417.00 - 9055.00 21816.00 13975.00 11232.00 14987.00 13943.00 10117.56 12619.88 12161.83 9266.00 8292.00 13949.00 12708.67 12117.33 10021.67 2231.00 - 8537.00 12597.00
ETHYL 3-UREIDOPROPIONATE (M+H)+
22636.00 24935.50 21513.67 23550.33 23590.50 26159.50 19048.00 23156.00 23535.00 25259.00 22768.00 20129.00 23783.00 24412.00 22144.00 22698.00 23573.00 25026.00 23216.00 25552.00 24522.00 25741.00 24121.00 24088.00 22686.11 23215.67 22044.62 23180.50 23526.00 25721.00 21934.33 23963.67 23302.00 24377.00 21480.00 23695.00 23607.00 25007.00
GLUCOSE (M+NA)+
319563.50 134945.50 290386.33 450500.33 269485.50 354530.00 1247396.00 2058117.50 276941.50 314050.50 368886.00 496239.00 248441.00 256153.00 348238.00 409052.00 221819.00 328335.00 361008.00 524679.00 173367.00 169377.00 270006.00 292610.00 376010.00 325365.67 744316.75 1290952.33 59695.00 193930.00 312302.00 373275.33 263487.67 270819.33 515281.00 722597.00 412502.00 696002.00
GLYCEROL MYRISTATE (M+H)+[-H2O]
5551.00 3502.50 5911.67 4006.00 2348.00 - 7888.33 5739.00 1745.00 2609.00 - 3761.00 3332.50 9697.00 8740.00 3845.00 3866.00 1992.00 - - 2324.00 1913.00 3813.00 7845.00 5542.43 4556.00 7048.29 6968.75 11441.00 - 5062.00 2254.33 6585.67 5027.00 5545.00 8943.00 7281.00 4765.00
GLYCEROL MYRISTATE (M+NA)+
29334.00 31125.00 27307.33 28867.33 23833.50 31683.50 57138.33 51608.00 23439.50 15226.50 39156.00 39391.00 35539.00 96954.00 39344.00 9915.00 24739.00 29071.00 29869.00 32470.00 31490.00 34320.00 26898.00 32752.00 28331.11 30355.44 43618.75 57104.00 335234.00 27849.00 28820.50 27730.33 114709.67 91476.33 23496.00 34255.00 49023.00 50737.00
GLYCOCHENODEOXYCHOLIC ACID (M+H)+
43968.00 20968.50 77324.33 12626.00 10676.00 19558.00 17237.33 76190.00 36077.00 33807.00 103752.00 15706.00 5788.00 30945.50 46917.00 40063.00 47853.00 - 12509.00 - 4628.00 36669.00 38690.00 - 27939.22 9858.33 25645.88 39994.33 77659.00 116948.00 28242.00 11396.67 16756.00 38251.33 21233.00 7791.00 20727.00 36981.00
GLYCOCHENODEOXYCHOLIC ACID (M+H)+[-H2O]
417997.00 215193.50 717452.33 60160.67 114717.50 194731.50 176579.00 677893.00 194974.50 169151.50 857197.00 150456.00 46441.00 300299.00 460207.00 402987.00 444972.00 21310.00 121792.00 31845.00 58176.00 332652.00 370779.00 32265.00 266717.00 69144.56 246925.88 359536.67 701307.00 987977.00 220216.00 113225.33 168333.33 360810.67 235084.00 70211.00 203188.00 356375.00
GLYCOCHENODEOXYCHOLIC ACID (M+NA)+
264202.50 139024.50 446338.67 40336.33 71100.00 121868.50 112656.00 423011.50 127800.50 218472.00 539206.00 99326.00 30017.50 194225.50 286517.00 237589.00 287209.00 19724.00 78090.00 20821.00 38933.00 202319.00 235948.00 19507.00 168146.78 45978.56 154270.62 223752.00 454333.00 639176.00 162058.67 71309.67 108733.00 227904.33 151016.00 48310.00 129126.00 225587.00
GLYCOCHOLIC ACID (M+H)+[-H2O]
14347.00 9717.50 48309.33 11821.00 5247.00 14549.00 22687.00 47889.50 67785.00 7860.50 11345.00 3790.00 18033.00 33282.50 16486.00 9195.00 6706.00 - 28187.00 5992.00 6024.00 17123.00 17414.00 2933.00 28816.67 9407.00 16007.86 25421.50 21550.00 38708.00 16259.00 7099.67 14212.50 14715.33 20396.00 10517.00 20383.00 27137.00
GUANINE (M+H)+
19085.50 11420.50 16688.67 9962.67 15562.00 10414.00 22875.67 13841.00 14221.50 7686.00 16960.00 11842.00 13349.50 13423.00 18602.00 10243.00 21811.00 7240.00 14710.00 8233.00 13736.00 8867.00 21396.00 12873.00 16165.22 10840.38 24157.83 15691.00 - 9802.00 16871.00 10610.00 10675.67 10659.00 15761.00 9467.00 13730.00 8630.00
HEXANOYLCARNITINE (*) M+
192617.50 50603.00 86207.67 23091.00 161951.00 48604.50 50887.33 25895.50 138094.00 34068.50 165662.00 69784.00 84397.00 70070.00 241243.00 70280.00 174832.00 27142.00 97751.00 25412.00 244271.00 72094.00 131528.00 16875.00 97338.00 22967.44 91249.50 39641.50 69542.00 40106.00 86862.33 31252.00 98081.33 45944.33 74864.00 32436.00 87495.00 39064.00
HIPPURIC ACID (M+H)+
96987.50 476448.00 228779.00 93789.67 183676.00 400688.00 90620.00 1110751.00 198570.50 692024.50 39099.00 27680.00 60728.50 635951.50 42974.00 636525.00 220135.00 75419.00 103716.00 43989.00 495362.00 1348920.00 151421.00 65037.00 126133.78 65736.14 81971.38 832350.33 1495437.00 2035977.00 116968.00 58221.00 58401.67 1003182.00 215871.00 70671.00 100963.00 537466.00
HIPPURIC ACID (M+NA)+
125425.00 1152628.00 309663.67 127577.00 265265.50 948648.00 163852.50 1420124.50 264843.00 1720246.00 - - - 1531491.00 - 749092.00 287533.00 - 140625.00 - 634049.00 1686184.00 197578.00 - 207967.71 105659.50 159705.33 1061547.00 1930547.00 2463930.00 159953.33 - 141701.00 1286037.67 290678.00 - 123095.00 647350.00
HYPOXANTHINE (M+H)+
234408.50 91059.50 164763.00 97262.33 117874.50 152610.50 141047.67 275849.00 121287.00 94272.00 164853.00 90574.00 96775.00 17952.50 6299.00 10847.00 181418.00 205776.00 147332.00 79006.00 23268.00 106684.00 196810.00 53419.00 201695.67 76464.11 135105.43 104998.80 103491.00 2709.00 184646.00 65505.33 70131.67 137492.00 259434.00 127758.00 - 2966.00
IBUPROFEN (M+NA)+
- - - 5233.00 - - - - - - - - - - - - - - - - - - - - 5073.00 1541.00 127941.50 52372.00 - 84038.00 372602.00 62545.50 15207.00 10574.00 - - - -
INDOLE-3-ACETALDEHYDE (M+H)+
38524.00 17591.50 154621.33 130828.00 63954.00 92392.00 20451.00 - 20710.00 13759.50 - - 173302.00 - - - 34634.00 26021.00 17455.00 48249.00 - 124520.00 - 20583.00 78082.38 69596.89 7931.50 11665.00 - - 40190.00 63662.33 - - 41196.00 36145.00 - 33033.00
INDOLE-3-ACETIC ACID (M+H)+
261408.00 162703.50 155937.67 117168.00 138643.00 107820.50 77233.33 136107.50 166010.50 120059.50 200279.00 168160.00 129842.50 138897.00 181988.00 154622.00 309048.00 250032.00 130491.00 133718.00 200697.00 214973.00 115248.00 88125.00 155515.44 116419.33 131340.12 136463.83 109605.00 99585.00 212099.00 172741.33 195108.00 178894.67 244600.00 156085.00 241013.00 218148.00
ISO-BUTYRYLCARNITINE (*) (M+H)+
394114.50 306050.50 133112.33 139699.33 204561.00 152259.50 63896.67 138875.50 287510.50 257151.50 157527.00 62793.00 194449.00 305136.00 135682.00 230408.00 203538.00 260894.00 180602.00 186983.00 194285.00 117520.00 164205.00 148086.00 210970.67 163364.78 195805.62 177039.40 129036.00 178954.00 172701.50 182350.67 171211.00 258217.00 214231.00 163345.00 223218.00 177113.00
ISOLEUCINE (M+H)+
29829919.50 21229809.50 32021340.00 11786547.33 25767353.00 11260405.00 13332362.67 15720390.50 12981409.50 11269519.00 14121996.00 21052557.00 16787718.00 10342921.50 13607672.00 23369034.00 30506476.00 12804478.00 13541502.00 8735394.00 22855451.00 7130822.00 29676919.00 7004485.00 15040991.78 11788959.11 19663157.75 17473922.00 10525819.00 17274837.00 13101215.67 15002626.67 16318413.33 16540280.00 31726213.00 18946688.00 10497586.00 18019655.00
ISOLEUCINE (M+NA)+
594308.50 391860.50 611490.33 339563.67 522330.00 308808.00 439697.67 434589.50 645070.00 295543.50 909714.00 399342.00 378096.50 446570.00 633858.00 411852.00 576373.00 226999.00 649671.00 364484.00 454018.00 261298.00 662083.00 287032.00 597085.33 299660.89 510538.62 406808.00 449629.00 285771.00 623725.33 346569.67 541632.67 368739.00 591709.00 343301.00 483483.00 330499.00
ISOVALERYLCARNITINE (*) (M+H)+
269494.00 243553.50 226216.33 125435.67 165682.50 143423.50 121974.33 145955.00 317691.00 164122.50 180799.00 181243.00 143508.00 161020.50 182052.00 210844.00 261459.00 62254.00 273647.00 155650.00 304710.00 192719.00 326204.00 132970.00 232469.44 133772.78 212097.88 194617.83 97424.00 89723.00 266251.00 161757.67 291361.33 192847.67 333478.00 121752.00 170608.00 171770.00
KYNURENINE (M+H)+
518820.50 461381.00 489605.67 406998.33 265656.50 269738.50 232434.33 385389.50 424633.00 335321.50 567100.00 513570.00 419870.50 529741.00 643192.00 588754.00 497495.00 428258.00 453081.00 455402.00 401186.00 451945.00 418107.00 394863.00 421694.33 389160.33 399729.75 425126.17 363397.00 371825.00 481348.00 455577.67 447597.67 425633.67 337236.00 333604.00 506899.00 438156.00
KYNURENINE (M+NA)+
16700.00 12433.50 14461.50 11482.67 10452.00 7700.00 6224.50 11629.50 18804.50 6981.50 23898.00 15992.00 16393.50 19689.00 25785.00 17572.00 20710.00 18024.00 8513.00 15894.00 17069.00 16856.00 14258.00 15878.00 15879.43 13979.56 14463.38 14793.17 14227.00 - 19919.00 16774.67 18191.33 14083.33 7405.00 13562.00 19431.00 13323.00
L-ARGININE (M+H)+
7931.00 12907.00 9467.00 6515.33 14843.50 13561.50 13986.33 16255.00 9490.00 7284.00 11391.00 - 10249.50 13021.50 11923.00 11706.00 6643.00 7452.00 11382.00 6561.00 13181.00 8751.00 16207.00 9277.00 8484.00 6608.89 11733.50 10709.17 12143.00 17114.00 10590.00 6171.00 5647.50 6225.33 6362.00 13192.00 11826.00 4573.00
L-ARGININE (M+NA)+
5045.00 6411.50 7901.67 5491.33 7327.00 5757.00 13423.33 11344.00 5810.00 - 6945.00 4528.00 3644.00 3473.00 7056.00 - 6424.00 4091.00 5594.00 4510.00 - 2098.00 5534.00 5571.00 6903.44 4820.57 8469.57 9232.75 - 3451.00 6286.67 5296.00 4485.50 2925.50 8220.00 7650.00 7294.00 4699.00
LAUROYLCARNITINE (M+H)+
19231.00 10368.50 12467.67 8779.00 30144.50 21271.50 12707.50 14971.00 28624.50 10050.50 19844.00 34424.00 10950.00 8829.00 60374.00 40452.00 23112.00 11721.00 15694.00 12603.00 26633.00 14820.00 23215.00 17315.00 20089.00 13729.22 36804.25 19276.20 25306.00 99971.00 26532.67 21016.67 31631.67 23201.67 12465.00 9359.00 19922.00 11676.00
L-TRYPTOPHAN-15N2 [ISTD] (M+H)+
3888260.00 4063112.50 3610208.67 3868629.67 3905653.50 4101706.00 3020036.00 3827457.00 3813564.00 4188189.50 4012751.00 3317518.00 3975348.50 3971854.50 3646707.00 3718100.00 4038811.00 4104883.00 3815658.00 4185045.00 4179276.00 4111621.00 3804848.00 4075608.00 3706595.44 3822092.11 3712858.38 3823663.83 3933544.00 4020113.00 3765102.33 4028078.00 3845122.00 3994295.00 3803745.00 3930209.00 3878835.00 4115739.00
LYSINE (M+H)+
31634.00 31814.50 38052.33 27583.00 23623.50 21816.00 48311.67 44821.50 30314.00 23654.50 29898.00 23538.00 32556.50 36756.00 32441.00 34683.00 36365.00 23598.00 43115.00 36658.00 34256.00 28268.00 30631.00 22014.00 34357.78 26979.56 47273.75 42647.83 40365.00 34452.00 39644.00 31762.00 32681.00 32488.00 39233.00 32583.00 35326.00 23298.00
LYSINE (M+NA)+
6749.00 7254.00 8279.00 6227.67 6701.00 4958.00 12362.00 12062.00 7225.50 5589.00 6601.00 5265.00 6882.50 8210.00 7494.00 7260.00 7366.00 5230.00 9600.00 8060.00 6435.00 6499.00 6228.00 4488.00 7390.17 6327.75 11203.88 10751.83 8391.00 6780.00 8430.00 7074.67 7557.50 7070.33 9184.00 6535.00 8596.00 5137.00
MANNITOL (M+NA)+
- 27897.00 - 17574.00 - 70632.00 - - - 24238.00 - 22308.00 56409.00 - - - - 29890.00 - 15075.00 - - - 16298.00 - 18149.89 - 1323.00 - - - 9962.00 - - - 19732.00 - -
METHIONINE (M+H)+
2172375.50 1476224.50 2078141.67 1186791.33 1682483.50 1216862.00 1215527.00 1674139.50 1896619.00 987918.50 1644998.00 1075279.00 1384683.50 1527898.00 1958890.00 1351058.00 2438814.00 931726.00 1938843.00 1067847.00 1708548.00 1159365.00 2385784.00 1324936.00 2051795.56 1055696.25 1835367.50 1382480.33 1421753.00 1376722.00 2174833.67 1251335.33 1620178.00 1185822.00 2420324.00 1294743.00 1712583.00 1100412.00
METHYL BETA-D-GALACTOSIDE (M+NA)+
14661.50 5851.00 8832.00 4121.00 8075.50 5827.00 1688.00 9369.00 15482.50 9804.50 4796.00 2994.00 24504.00 13100.00 6211.00 4366.00 28229.00 50900.00 13912.00 5710.00 - 24340.00 11444.00 17746.00 10015.56 7291.78 12546.33 7714.75 5564.00 11316.00 20060.33 7566.33 17202.33 24179.50 7475.00 6010.00 - 3433.00
N-ACETYL-DL-SERINE (M+H)+[-H2O]
121074.50 132827.50 102640.67 107196.33 135233.50 112072.00 291917.50 240609.00 150591.00 117579.50 131424.00 178598.00 117269.00 122050.50 132517.00 140185.00 143871.00 108661.00 106562.00 111444.00 127604.00 70134.00 - 97025.00 129026.62 112252.33 214702.62 202983.67 165044.00 150596.00 103727.00 122854.00 156304.67 145971.67 117633.00 124770.00 - 197288.00
N-ACETYL-D-TRYPTOPHAN (M+H)+
- 738337.00 - 870149.00 - 784749.00 - - 1781.00 968440.00 - 796766.00 835206.00 2699.00 - - - 1008894.00 - 914289.00 - - - 914582.00 1889.25 826897.11 2012.75 3292.00 - - 2425.00 926016.67 2144.00 - - 721597.00 - -
N-ACETYL-D-TRYPTOPHAN (M+NA)+
- 449773.00 - 549018.33 - 496566.00 - - - 599573.00 - 486139.00 531571.00 - - - - 641646.00 - 566606.00 - - - 575095.00 - 511026.89 - - - - - 584281.67 - - - 443154.00 - -
NICOTINAMIDE (M+H)+
40016.00 14890.50 88374.33 83167.50 27915.00 27248.50 16112.00 18985.00 34468.50 16526.50 44335.00 23422.00 151492.00 20895.50 36301.00 22606.00 42747.00 12134.00 40614.00 24800.00 46300.00 15427.00 50630.00 - 52162.44 25203.43 52805.50 34158.00 40858.00 36399.00 46331.33 26035.67 29493.33 31824.33 88756.00 13976.00 44908.00 33488.00
OCTENOYLCARNITINE (*) M+
340508.50 225044.50 80542.67 46038.00 476280.50 350868.50 96164.00 106477.00 396453.50 258841.00 506162.00 391981.00 169124.50 187805.00 418038.00 423964.00 499331.00 434010.00 239688.00 204204.00 967070.00 1054225.00 214107.00 - 176580.33 117275.29 145166.62 108019.33 203046.00 247421.00 294983.00 149064.00 127946.00 123220.50 259455.00 130298.00 118586.00 98283.00
OLEAMIDE (M+H)+
445243.50 1458427.50 805731.67 693970.33 1482788.50 1856814.00 1559700.00 1076962.00 519714.50 208968.50 1062839.00 1088627.00 2306082.00 2980679.00 1523140.00 1938769.00 132688.00 201807.00 286122.00 312818.00 2021536.00 1699527.00 225525.00 580065.00 347685.78 315745.33 1668644.75 1421689.33 2262325.00 123893.00 533849.67 296739.33 2061156.33 2539349.67 125572.00 190836.00 1786250.00 2060125.00
OLEAMIDE (M+NA)+
646966.00 3341631.00 1371085.00 1079254.00 1855010.50 2205723.50 2468009.33 1438490.00 765806.50 421568.00 1811384.00 1833660.00 3071380.50 3516932.00 2063595.00 2589117.00 146606.00 - 420802.00 487461.00 2998597.00 2460851.00 318394.00 791305.00 513613.89 590167.33 2339464.38 1877379.50 2475943.00 116539.00 860860.00 870156.00 2669297.00 3056633.00 143091.00 - 2492056.00 2716194.00
OLEIC ACID (M+NA)+
115271.50 90003.50 150182.33 181882.00 94118.00 120305.00 119900.00 60846.50 103141.00 131898.50 150631.00 207642.00 103446.50 102455.00 95213.00 126366.00 73927.00 170811.00 99098.00 149093.00 128417.00 101006.00 148351.00 116160.00 152401.71 188747.12 113783.00 93601.83 98538.00 61388.00 130403.67 182396.33 109668.33 143232.33 66643.00 140955.00 140639.00 125772.00
OLEOYL-GLYCEROL (M+H)+
10800.00 17043.50 23769.00 25078.00 21923.00 79926.00 169134.67 107695.00 51527.50 4644.00 48991.00 18684.00 71262.50 164875.50 84294.00 61488.00 4933.00 7875.00 11611.00 7462.00 33040.00 16597.00 12738.00 196953.00 11784.88 11367.33 102631.75 173653.67 714484.00 24950.00 32534.00 19812.00 130691.67 147181.67 15775.00 13711.00 85913.00 115771.00
OLEOYL-GLYCEROL (M+H)+[-H2O]
- 14453.00 16122.50 20874.50 22199.00 48579.00 73660.33 59394.00 30346.00 2101.00 29464.00 - 57573.00 77130.00 45276.00 43943.00 - 5275.00 - - 14006.00 10519.00 - 100488.00 10626.00 4939.67 50534.25 77367.50 304019.00 3001.00 42759.00 11884.00 68173.67 70228.67 10470.00 6883.00 46865.00 67938.00
OLEOYL-GLYCEROL (M+NA)+
153641.00 158849.50 379966.67 297134.33 278532.50 404704.00 2941016.67 1305548.00 784811.00 81562.50 894621.00 253193.00 929770.00 1882310.00 1016530.00 676628.00 102651.00 73331.00 154039.00 110622.00 486338.00 179032.00 156728.00 2170275.00 160293.00 141645.22 1390649.75 1979418.50 8984353.00 201938.00 528401.67 198085.33 2020801.67 1670131.00 189521.00 178728.00 1326626.00 1344870.00
ORNITHINE (M+H)+
7330.00 6796.00 8919.33 5617.33 6595.50 5677.50 10455.67 8308.00 8209.00 4863.00 11097.00 - 7376.00 8575.50 11046.00 8979.00 11577.00 5457.00 9088.00 6269.00 8595.00 7789.00 7956.00 4772.00 8307.89 5513.00 11909.25 9218.17 11219.00 9351.00 10166.33 6769.33 8702.33 8449.33 9373.00 6608.00 9027.00 5462.00
PANTOTHENIC ACID (M+H)+
24414.00 22690.50 23828.00 24403.33 26566.00 24021.50 16863.00 20000.00 37545.50 23532.50 30397.00 23499.00 21933.50 20276.00 24535.00 22829.00 25257.00 23727.00 20192.00 20156.00 33757.00 24586.00 21185.00 18368.00 21273.00 19031.22 22010.88 20303.67 3850.00 19219.00 21736.00 24738.33 27826.33 25971.33 16178.00 19376.00 16781.00 16674.00
PANTOTHENIC ACID (M+NA)+
13463.00 9527.50 13655.33 13960.33 13586.50 13012.00 12327.50 9347.50 19123.00 21780.00 15770.00 12614.00 12130.00 10667.00 12958.00 12039.00 14311.00 12328.00 12865.00 11706.00 17591.00 11547.00 5303.00 9945.00 12285.33 9975.44 12266.75 12792.50 - 10831.00 12921.00 11549.00 14935.67 14746.00 9380.00 10131.00 8585.00 8459.00
PIPECOLIC ACID (M+H)+
280718.00 284677.00 386137.00 315764.00 232632.00 235062.00 244101.33 247162.50 309074.50 232102.00 149067.00 185563.00 253497.00 305157.50 223127.00 205797.00 357028.00 298675.00 277871.00 246885.00 227080.00 209391.00 287468.00 294887.00 237698.00 237854.44 319294.12 325084.17 156143.00 284572.00 210652.33 229265.67 221539.33 230372.00 154174.00 198925.00 283431.00 244646.00
PROLINE (M+H)+
471424.50 410597.00 407765.67 554893.67 573734.50 510042.00 437365.00 580053.00 309354.00 298316.50 2231.00 385514.00 398500.50 744344.00 2380.00 460812.00 555348.00 476434.00 402610.00 341801.00 698839.00 529177.00 605296.00 358670.00 380839.89 323210.89 508288.14 337756.67 621520.00 396254.00 408553.00 385050.33 350872.00 281204.67 485776.00 620334.00 785972.00 537430.00
PROPIONYLCARNITINE (*) (M+H)+
236114.00 204764.50 106963.67 130472.33 171909.50 152300.00 52344.33 68529.00 425906.00 204747.00 57366.00 221018.00 230590.00 273306.50 191898.00 199520.00 146571.00 164050.00 137441.00 127301.00 122665.00 184296.00 191939.00 63333.00 125542.78 101847.78 147379.38 100532.00 157103.00 86860.00 160714.67 136084.00 71760.00 106799.00 190735.00 116006.00 123380.00 130692.00
SN-GLYCERO-3-PHOSPHOCHOLINE (M+H)+
9887.00 18867.00 22078.33 66029.33 15239.00 25733.00 12483.67 70041.50 25433.50 24792.00 11693.00 17151.00 6099.50 31206.50 61499.00 65960.00 18099.00 32232.00 34337.00 - - 7941.00 19009.00 35458.00 31085.56 46392.50 19967.38 37832.60 32167.00 26172.00 33631.33 56463.67 20973.67 34743.67 39374.00 56565.00 2966.00 47492.00
SPERMIDINE (M+H)+
44050.00 28148.00 39351.33 44765.33 28007.50 44166.50 39301.33 28089.00 37719.00 21406.00 38782.00 26442.00 1096490.00 14304.00 25126.00 18791.00 66916.00 - 18663.00 21977.00 44473.00 12887.00 25219.00 17974.00 29481.75 20476.29 54378.29 28358.50 76097.00 - 28438.67 14926.67 13028.67 23516.67 95396.00 26161.00 25620.00 16621.00
SPERMINE (M+H)+
12664.50 2039.00 11444.33 75142.00 5297.00 9617.00 15844.50 12256.00 5307.50 - 7058.00 5591.00 88582.00 10405.00 4923.00 4372.00 7988.00 - 6971.00 6309.00 3232.00 4543.00 2570.00 2115.00 11200.62 12695.57 15172.14 11591.00 9140.00 - 10052.33 10531.00 5808.00 6592.50 31527.00 8507.00 8332.00 6376.00
SUCROSE (M+NA)+
3182.00 13194.50 4752.67 26234.00 2058.00 22912.50 4496.00 3900.00 14661.00 22039.00 1904.00 17161.00 33210.00 2850.00 78850.00 2797.00 2291.00 49548.00 - 27023.00 1368.00 1466.00 - 39287.00 3094.57 32637.11 8904.20 10522.17 1532.00 3321.00 2617.67 36826.00 1773.00 3432.33 2442.00 24586.00 1538.00 6622.00
THEOBROMINE (M+H)+
205069.50 85593.50 2930454.00 1052462.00 79220.00 58443.00 157765.67 295095.50 271671.50 326817.00 15343.00 9939.00 645919.00 584377.50 - - 954996.00 523620.00 46141.00 32554.00 762927.00 657341.00 45536.00 33992.00 146294.40 145953.00 418224.00 405673.00 234390.00 296990.00 758882.50 497315.00 197940.33 163380.67 331853.00 228029.00 120601.00 102324.00
THEOPHYLLINE (M+H)+
104998.00 152457.00 127526.50 99164.00 80460.00 60635.00 181318.00 586546.00 161004.00 95991.00 - - 117283.00 149572.50 22088.00 - 88053.00 44347.00 - - 1582632.00 1372301.00 25046.00 - 20633.00 - 268489.20 223779.00 115983.00 386871.00 922462.00 490101.00 430900.00 359624.00 56552.00 - 234760.00 195983.00
THEOPHYLLINE (M+NA)+
14159.50 19597.50 7875.00 13769.33 13090.00 9203.50 24033.00 19852.00 4014.50 12283.00 2681.00 - 14454.00 27420.50 11498.00 11276.00 12194.00 8694.00 2967.00 14306.00 34249.00 147935.00 4135.00 15427.00 8458.33 14183.17 15346.88 29713.40 28284.00 58048.00 10267.00 7417.00 16543.33 10594.00 17188.00 13511.00 55780.00 51070.00
TRYPTOPHAN (M+H)+
12220651.00 9369987.00 13640482.33 9013961.33 10258116.00 8564559.50 7080709.00 11460719.50 13493284.50 9996096.00 11260169.00 8722566.00 8977662.50 11231122.00 14700697.00 11388340.00 12684650.00 7727821.00 14020081.00 9672169.00 7822505.00 7229325.00 11076671.00 8731072.00 13065603.33 9342876.00 11899627.00 10718111.00 11721407.00 7333076.00 13308250.67 9881672.00 11469960.33 9894298.33 12437184.00 9019676.00 9291992.00 7174336.00
TRYPTOPHAN (M+NA)+
585990.50 454617.50 653562.33 460655.00 496105.00 419051.50 348126.33 560582.00 637703.00 486707.00 546631.00 428470.00 448678.50 541633.50 684164.00 545203.00 607755.00 389244.00 668670.00 491259.00 392047.00 366997.00 534827.00 440415.00 621318.67 467065.00 569832.50 525509.17 549506.00 388079.00 644799.00 498202.33 562365.00 491034.00 611190.00 463373.00 470724.00 365810.00
TYROSINE (M+H)+
6156003.00 4788875.00 6391107.00 4153700.33 5100253.50 3892017.50 4095496.00 4441069.50 4103087.50 2357372.00 6254452.00 4697805.00 3446677.50 4011163.50 7758186.00 5893578.00 5353073.00 2663938.00 6162947.00 4588690.00 3738930.00 2909909.00 5657513.00 3952631.00 6253753.33 4197629.78 5630057.00 4261608.83 6398391.00 3500840.00 6639017.33 4742988.00 5258342.67 4067454.33 6335462.00 4615097.00 7125979.00 3696493.00
TYROSINE (M+NA)+
222198.00 301795.00 270687.00 206904.33 260804.50 256126.50 202522.67 215439.00 278254.00 127771.00 331073.00 253243.00 215250.00 191038.50 440483.00 276540.00 336179.00 186532.00 317475.00 244798.00 212520.00 157374.00 322076.00 269384.00 269103.75 232952.33 214568.62 207846.00 231645.00 160367.00 258506.33 238153.00 257472.33 191681.00 204056.00 256447.00 274544.00 241582.00
URIC ACID (M+H)+
2242897.50 2152784.50 2624753.67 2736073.33 1833986.00 2073052.50 2723681.67 2901781.00 2285794.00 2432937.50 3104414.00 3651070.00 2155917.50 1888721.50 2108095.00 1862600.00 2459895.00 2869934.00 1925154.00 2416105.00 2285033.00 2327925.00 1653049.00 2255564.00 2185309.11 2550516.89 1996056.75 2258077.67 1538419.00 2197834.00 2367175.33 2628978.67 1875639.33 2089802.67 1704201.00 1698544.00 1673192.00 1471299.00
URIC ACID (M+NA)+
101484.00 89602.00 140154.00 170640.00 100515.50 119596.50 184679.00 220454.50 151217.50 126233.50 167628.00 206926.00 110979.50 74846.00 110975.00 117026.00 166448.00 165338.00 122184.00 139998.00 119471.00 119706.00 69621.00 147933.00 124466.33 139491.44 132697.00 155386.67 82607.00 124274.00 126057.67 158952.67 113448.67 101315.00 86585.00 98785.00 73400.00 84352.00
URIDINE (M+H)+
68764.50 62429.00 66024.67 55152.00 63816.00 54213.50 44712.67 51319.00 58643.00 52784.50 62862.00 67457.00 46611.00 47871.50 63507.00 69135.00 62244.00 41081.00 64280.00 64337.00 52752.00 39697.00 64404.00 58698.00 67531.33 55747.44 60642.38 54210.83 61457.00 47192.00 69197.00 57992.67 55062.33 45583.00 62594.00 54103.00 50266.00 48493.00
URIDINE (M+NA)+
48244.00 51148.00 48071.33 66437.33 62190.50 46563.50 66989.33 65563.50 58001.00 75600.00 56725.00 124543.00 64199.50 59121.00 74312.00 71545.00 52274.00 30426.00 39074.00 65527.00 55938.00 26323.00 53336.00 48914.00 62567.56 64537.89 65301.62 73427.17 35091.00 59184.00 50305.33 64814.00 70089.00 55819.67 41198.00 62154.00 69417.00 36595.00
VALINE (M+H)+
2758674.00 2085796.50 2985906.67 2203234.33 2389467.50 1745628.00 3082470.00 2552393.50 2928621.00 1846202.00 3493347.00 2838571.00 2066056.00 2260659.00 3221056.00 2524030.00 2676686.00 1509682.00 3145208.00 2346927.00 1984841.00 1513426.00 2537407.00 1723441.00 2893360.89 1977991.44 2769853.75 2355122.17 2602652.00 1673269.00 2960485.33 2257591.67 2929749.67 2103710.67 2750269.00 2100355.00 2312622.00 1835705.00
VALINE (M+NA)+
19661.50 10670.00 14541.33 12213.67 15044.00 11019.00 65570.33 49867.50 19149.50 10803.50 20768.00 13386.00 12677.00 10573.00 19652.00 11517.00 11946.00 7711.00 20130.00 13675.00 6316.00 5180.00 20165.00 9736.00 14652.33 11458.56 37884.14 32269.17 7901.00 5985.00 17780.00 15342.33 16032.33 9923.33 19518.00 12615.00 12747.00 7868.00
ZEATIN [ISTD] (M+H)+
637246.50 633740.00 581708.67 569065.00 620113.50 641339.00 478747.00 622888.00 610684.50 630653.00 615690.00 488607.00 623058.50 632579.50 617516.00 621437.00 634825.00 607711.00 610671.00 615824.00 633029.00 618551.00 622405.00 629777.00 578023.44 558417.44 586637.50 592418.50 597692.00 602658.00 572514.33 577903.33 583066.00 596161.00 599723.00 565767.00 576699.00 612277.00

Factors:

F1AGE:12 | Assay:BC TP | DISEASE_STATE:Control | Timepoint:-
F2AGE:12 | Assay:BC TP | DISEASE_STATE:Control | Timepoint:270
F3AGE:12 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:-
F4AGE:12 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:270
F5AGE:12 | Assay:OGTT | DISEASE_STATE:Control | Timepoint:-
F6AGE:12 | Assay:OGTT | DISEASE_STATE:Control | Timepoint:120
F7AGE:12 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:-
F8AGE:12 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:120
F9AGE:13 | Assay:BC TP | DISEASE_STATE:Control | Timepoint:-
F10AGE:13 | Assay:BC TP | DISEASE_STATE:Control | Timepoint:270
F11AGE:13 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:-
F12AGE:13 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:270
F13AGE:13 | Assay:OGTT | DISEASE_STATE:Control | Timepoint:-
F14AGE:13 | Assay:OGTT | DISEASE_STATE:Control | Timepoint:120
F15AGE:13 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:-
F16AGE:13 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:120
F17AGE:14 | Assay:BC TP | DISEASE_STATE:Control | Timepoint:-
F18AGE:14 | Assay:BC TP | DISEASE_STATE:Control | Timepoint:270
F19AGE:14 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:-
F20AGE:14 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:270
F21AGE:14 | Assay:OGTT | DISEASE_STATE:Control | Timepoint:-
F22AGE:14 | Assay:OGTT | DISEASE_STATE:Control | Timepoint:120
F23AGE:15 | Assay:BC TP | DISEASE_STATE:Control | Timepoint:-
F24AGE:15 | Assay:BC TP | DISEASE_STATE:Control | Timepoint:270
F25AGE:15 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:-
F26AGE:15 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:270
F27AGE:15 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:-
F28AGE:15 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:120
F29AGE:15 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:30
F30AGE:15 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:90
F31AGE:16 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:-
F32AGE:16 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:270
F33AGE:16 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:-
F34AGE:16 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:120
F35AGE:17 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:-
F36AGE:17 | Assay:BC TP | DISEASE_STATE:PCOS | Timepoint:270
F37AGE:17 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:-
F38AGE:17 | Assay:OGTT | DISEASE_STATE:PCOS | Timepoint:120
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