#METABOLOMICS WORKBENCH araskind_20170605_134746 DATATRACK_ID:960 STUDY_ID:ST000678 ANALYSIS_ID:AN001043 PROJECT_ID:PR000480 VERSION 1 CREATED_ON June 30, 2017, 11:06 am #PROJECT PR:PROJECT_TITLE Functional genomics study on Non Alcoholic fatty liver disease (NAFLD) PR:PROJECT_TYPE MS analysis PR:PROJECT_SUMMARY In this study, we determine the genetic mechanism of action by which variants PR:PROJECT_SUMMARY near PNPLA3 and PPP1R3B exert their effects on promoting NAFLD PR:INSTITUTE University of Michigan PR:DEPARTMENT Internal Medicine PR:LABORATORY Speliotes Lab PR:LAST_NAME Speliotes PR:FIRST_NAME Elizabeth PR:ADDRESS Ann Arbor, MI PR:EMAIL espeliot@umich.edu PR:PHONE 734-647-2964 #STUDY ST:STUDY_TITLE Functional genomics study on Non Alcoholic fatty liver disease (NAFLD) ST:STUDY_TYPE MS analysis ST:STUDY_SUMMARY In this experiment, vector , GCKR (WT), GCKR(P446L), PPP1R3B, TM6SF2 (WT and ST:STUDY_SUMMARY E167K) overexpression stable HuH-7_Lok cell lines as well as Non-target, GCKR ST:STUDY_SUMMARY shRNA (52621), PPP1R3B shRNA (2640), TM6SF2 shRNA (382426) knockdown HuH-7_Lok ST:STUDY_SUMMARY cell lines are used to do the lipidomics experiments 3 X 100 mm dishes of cells ST:STUDY_SUMMARY were seeded (1x106 cells/dish) for each cell line and incubated at 37? C for 24 ST:STUDY_SUMMARY hours, then replaced medium with delipidated serum DMEM medium. After 24 hours, ST:STUDY_SUMMARY treated with BSA-OA (200?M) for another 24 hours before the collection of cells ST:STUDY_SUMMARY Add 4mL/dish 50 mM ammonium acetate wash cells and then quench cells by adding ST:STUDY_SUMMARY liquid nitrogen covering all the surface of dish. Store the cell samples in ST:STUDY_SUMMARY -80?C freezer. ST:INSTITUTE University of Michigan ST:DEPARTMENT Biomedical Research Core Facilities ST:LABORATORY Metabolomics core ST:LAST_NAME Kachman ST:FIRST_NAME Maureen ST:ADDRESS 6300 Brehm Tower, 1000 Wall Street, Ann Arbor, MI 48105-5714 ST:EMAIL mkachman@med.umich.edu ST:PHONE (734) 232-8175 ST:NUM_GROUPS 6 ST:TOTAL_SUBJECTS 1 #SUBJECT SU:SUBJECT_TYPE Human SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS SU0016258 S00026014 Construct:Vector SUBJECT_SAMPLE_FACTORS SU0016258 S00026015 Construct:Vector SUBJECT_SAMPLE_FACTORS SU0016258 S00026016 Construct:Vector SUBJECT_SAMPLE_FACTORS SU0016258 S00026017 Construct:PPP1R3B_3 SUBJECT_SAMPLE_FACTORS SU0016258 S00026018 Construct:PPP1R3B_3 SUBJECT_SAMPLE_FACTORS SU0016258 S00026019 Construct:PPP1R3B_3 SUBJECT_SAMPLE_FACTORS SU0016258 S00026020 Construct:GCKR(WT) SUBJECT_SAMPLE_FACTORS SU0016258 S00026021 Construct:GCKR(WT) SUBJECT_SAMPLE_FACTORS SU0016258 S00026022 Construct:GCKR(WT) SUBJECT_SAMPLE_FACTORS SU0016258 S00026023 Construct:GCKR(P446L) SUBJECT_SAMPLE_FACTORS SU0016258 S00026024 Construct:GCKR(P446L) SUBJECT_SAMPLE_FACTORS SU0016258 S00026025 Construct:GCKR(P446L) SUBJECT_SAMPLE_FACTORS SU0016258 S00026026 Construct:NT SUBJECT_SAMPLE_FACTORS SU0016258 S00026027 Construct:NT SUBJECT_SAMPLE_FACTORS SU0016258 S00026028 Construct:NT SUBJECT_SAMPLE_FACTORS SU0016258 S00026029 Construct:PPP1R3B_2640 SUBJECT_SAMPLE_FACTORS SU0016258 S00026030 Construct:PPP1R3B_2640 SUBJECT_SAMPLE_FACTORS SU0016258 S00026031 Construct:PPP1R3B_2640 #COLLECTION CO:COLLECTION_SUMMARY - #TREATMENT TR:TREATMENT_SUMMARY - #SAMPLEPREP SP:SAMPLEPREP_SUMMARY - SP:SAMPLEPREP_PROTOCOL_FILENAME A004 - Shotgun Lipidomics.pdf #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE Reversed phase MS:INSTRUMENT_NAME ABI Sciex 5600+ TripleTOF CH:COLUMN_NAME Waters Acquity HSS T3 (50 x 2.1mm, 1.8um) #ANALYSIS AN:ANALYSIS_TYPE MS AN:ANALYSIS_PROTOCOL_FILE A004 - Shotgun Lipidomics.pdf #MS MS:MS_COMMENTS - MS:INSTRUMENT_NAME ABI Sciex 5600+ TripleTOF MS:INSTRUMENT_TYPE Triple TOF MS:MS_TYPE ESI MS:ION_MODE POSITIVE #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS peak area normalized MS_METABOLITE_DATA_START Samples S00026014 S00026015 S00026016 S00026017 S00026018 S00026019 S00026020 S00026021 S00026022 S00026023 S00026024 S00026025 S00026026 S00026027 S00026028 S00026029 S00026030 S00026031 Factors Construct:Vector Construct:Vector Construct:Vector Construct:PPP1R3B_3 Construct:PPP1R3B_3 Construct:PPP1R3B_3 Construct:GCKR(WT) Construct:GCKR(WT) Construct:GCKR(WT) Construct:GCKR(P446L) Construct:GCKR(P446L) Construct:GCKR(P446L) Construct:NT Construct:NT Construct:NT Construct:PPP1R3B_2640 Construct:PPP1R3B_2640 Construct:PPP1R3B_2640 CE(16:0); [M+NH4]+@10.96 55593.99355 18257.08351 2591.304498 29737.06184 40848.03518 47033.66848 24057.81649 13219.16078 10829.05947 8842.686235 1547.719245 4086.883472 6948.429765 10903.40923 6550.498557 2066.879374 19421.85425 7714.694061 CE(16:1); [M+NH4]+@10.68 74760.9954 30056.09294 12149.66827 27886.09216 53688.60283 64865.25748 36248.71365 16135.05363 24050.15282 24573.32326 3508.386089 3033.060911 6543.023182 11262.30354 17291.87723 6176.071671 32382.56827 10897.98171 CE(17:1); [M+NH4]+@10.77 9489.075046 12011.04948 1486.872696 10206.50262 8843.826571 21428.64002 12634.68035 6071.664573 2292.375608 8275.755366 365.8172015 3101.169439 4466.06046 7646.181566 5486.365378 1755.056355 3731.448609 12047.2313 CE(18:0); [M+NH4]+@11.33 19964.55186 6102.735815 5863.327393 9669.362455 11620.53525 16031.0679 12221.26605 7052.661309 5976.219492 10243.39089 1211.605651 1755.158533 7392.972919 12438.24936 17595.09346 2052.886454 4358.186555 6102.324839 CE(18:1); [M+NH4]+@10.89 1484470.335 831130.3433 338045.9357 828918.5218 1165131.399 1518811.115 1138844.605 671630.5041 532445.8384 626231.2392 123438.6917 144786.7574 501996.3444 502006.7768 259208.6687 128483.9658 657157.6448 416224.2966 CE(18:2); [M+NH4]+@10.75 474305.5608 109274.7497 32159.9546 214195.0423 227610.3012 337686.6971 224459.6536 130460.3789 83749.93453 83073.00837 15425.84141 26848.70953 53175.49796 63241.61775 22520.2635 16467.27979 50361.50471 66856.69331 CE(20:1); [M+NH4]+@11.27 778639.482 300419.2107 60267.63105 170046.9249 161535.2778 378113.4733 198442.2424 106197.7872 127440.6686 84084.13874 16851.02572 30565.05619 93505.19851 106721.0439 43922.58816 38334.57982 146993.2098 118053.2568 CE(20:2); [M+NH4]+@10.98 1795852.206 810877.5844 204515.3171 495174.827 424320.7981 822754.1798 489953.6955 330220.152 346361.1522 287091.2479 64381.93691 60206.78893 234771.4742 185696.8361 117440.7538 46668.57504 203411.78 175048.1497 CE(20:3); [M+NH4]+@10.80 316715.1197 114017.2622 64284.06107 105557.5236 123722.3123 125449.8154 132829.3333 69048.96494 84961.60991 86659.85167 18634.72993 18552.61244 81930.16118 79759.18325 51002.40831 25660.46179 104801.0971 66113.22749 CE(22:1); [M+NH4]+@11.62 181041.2281 84196.05358 49751.33673 68670.35194 76092.81419 133962.1973 84383.13899 65266.75571 39907.80864 53515.02716 13541.2947 13438.03254 52027.70437 51715.50135 36651.19603 26958.38531 87180.35348 53362.51689 CE(22:2); [M+NH4]+@11.32 292590.7124 102676.3306 48227.82766 119300.2017 110196.5646 113274.4319 99757.43137 72279.30693 86634.18475 89193.83022 13785.64541 15908.03394 57914.21057 50261.22455 60045.04995 24693.75299 56775.06117 44643.09602 CE(22:4); [M+NH4]+@10.86 494505.2958 157396.0849 33925.36397 91154.26335 132149.6352 161751.0549 109551.2187 79060.4328 53686.30762 51633.7037 11096.15324 12370.02277 63458.69704 60833.64658 25902.65074 21899.99175 126713.1485 75783.92904 CE(22:5); [M+NH4]+@10.69 500918.8664 112428.2392 29993.04506 97672.97417 74738.41211 93739.10855 78440.54343 55059.14611 56791.3859 28991.15749 4530.452286 13247.02035 35563.77456 47989.43377 27996.3508 34070.94096 113334.2281 84575.1199 CE(22:6); [M+NH4]+@10.48 488616.403 175536.8669 69778.76515 113847.4987 104848.1676 163671.8654 122325.1463 83811.88928 79677.80872 62708.56051 13056.16929 13332.02577 64714.06152 56496.04117 46504.39016 76060.57042 222364.4292 174029.1652 CE(24:1); [M+NH4]+@11.93 433860.5798 218992.5139 50181.29145 225310.418 203291.66 291656.363 188767.4438 117934.4495 104772.1236 119439.2421 25758.08344 30674.96597 91440.44269 120878.5453 64991.7119 39231.86586 156941.2965 120676.2964 DG 28:0; [M+NH4]+@6.77 79772.34086 31674.24853 7517.682652 30767.27328 44551.72615 22845.67536 27530.15921 10796.4646 8784.85599 31401.46591 4637.533243 5912.064345 18127.6066 14667.97285 7988.74914 6777.072006 25475.42461 20647.57138 DG 28:1; [M+NH4]+@6.26 315550.0499 157183.4066 24208.29311 146438.904 110395.8734 155283.2869 176958.2912 108833.143 61704.41852 85477.05679 20055.11537 36339.32032 43082.05501 51112.61815 26970.73717 11328.98904 74111.32896 45368.77314 DG 29:0; [M+NH4]+@7.01 456648.4207 244158.2448 25498.76878 98374.61076 69872.22303 125262.112 116674.9807 75845.50536 72310.17178 88988.71527 24957.35654 25603.30578 75364.73874 56445.8034 35789.82796 18488.70558 100774.6144 62224.03512 DG 29:1; [M+NH4]+@6.51 26389.14001 9798.295614 3658.535077 14348.7979 12115.23014 8679.230415 7437.612997 5790.573056 4644.795825 8376.353246 3355.145859 1593.591782 5581.779509 10063.94785 9318.451546 846.0596976 3600.165857 2988.441122 DG 30:0; [M+NH4]+@7.34 795771.4162 443522.1003 312448.4283 375002.4871 370856.3326 515300.9323 590616.2957 361151.4986 345747.0097 601809.0483 123082.5858 156476.3187 384689.1798 509352.182 527728.0737 219691.2734 583626.1355 409303.0303 DG 30:1; [M+NH4]+@6.85 1386021.159 604722.6943 159598.4259 357912.2254 308203.578 415036.9615 523528.8255 318853.7709 307053.4704 500999.9663 111192.8935 117438.1057 250292.6911 218101.7766 163837.4922 125986.3979 403306.634 329245.4286 DG 30:2; [M+NH4]+@6.42 388885.9355 163336.3534 36829.51653 84286.1412 64246.14562 91670.22138 132088.6022 68526.59535 61357.14864 86690.90201 20243.51466 22520.75991 53955.9842 60175.99954 34546.12112 24612.14937 90802.921 77547.2649 DG 31:0; [M+NH4]+@7.52 354269.6799 273573.9565 118536.228 260433.8723 249112.2664 391710.2866 236818.2047 162220.3386 122797.9535 186786.5493 47536.8804 57478.9818 177958.8924 231918.6943 256145.298 50680.79707 167683.3871 124206.8139 DG 31:1; [M+NH4]+@7.10 495461.0805 253836.6404 76042.18308 198020.3093 141129.8492 232742.1843 234537.8086 137119.88 163019.5419 205252.1811 40150.31148 49866.00585 177329.4851 165222.5339 124686.4127 42672.41182 145410.4024 98431.34977 DG 32:0; [M+NH4]+@7.85 4700186.084 3116106.028 558350.1033 1894881.389 1670931.825 2275290.675 2058857.628 1302010.459 1165745.794 1852652.527 367191.8375 446126.1534 1064518.967 1003695.571 711954.5629 751483.7441 2461318.133 2088026.692 DG 32:1; [M+NH4]+@7.44 20716172.04 19319658.64 3003395.346 8408813.028 8035872.867 11810682.27 12690763.1 8021060.377 7142409.721 10510910.1 2162715.209 2341641.683 4961937.922 5320449.232 2335298.364 2022813.184 9143184.918 8260092.439 DG 32:2; [M+NH4]+@7.05 5532382.117 3718479.772 826665.3331 1688383.712 1382503.612 2099267.331 2597993.158 1314064.13 1299406.796 2006560.499 488676.1422 514967.315 948122.4582 1078059.146 564742.1178 372593.2967 1734740.354 1423509.776 DG 33:0; [M+NH4]+@8.04 577004.8106 422186.4136 89072.27892 332659.3212 391357.3915 532788.2325 290823.014 203892.1711 166009.6025 237603.268 37579.18909 59938.96015 156329.5089 207132.317 130418.3552 68489.08652 208467.8312 165714.1964 DG 33:1; [M+NH4]+@7.67 1622110.922 1783525.924 421586.8322 1036170.705 1237246.868 1837221.996 1210266.414 660179.1511 611678.1571 887420.9941 178710.0817 233830.9734 715228.0322 865910.8557 659389.5938 233803.5163 693461.7488 537129.8616 DG 33:2; [M+NH4]+@7.30 863958.1078 656029.4463 160637.1129 452803.039 384765.4313 487631.3508 527030.2313 263747.5127 253480.5375 486822.6972 84652.65826 103671.6323 247174.0991 267299.397 149087.7451 72015.01384 301182.9857 248424.3002 DG 33:3; [M+NH4]+@6.93 128554.4248 77900.54973 23915.22373 50233.26249 29792.79129 62870.82724 59539.41283 27324.87929 22111.39557 51200.03142 7957.237607 11896.45228 19896.11931 42776.06508 18805.56309 6502.012803 44230.27536 28475.59458 DG 34:0; [M+NH4]+@8.38 1414374.906 723392.3352 140013.1424 506631.8827 453513.2542 681197.8419 558996.0101 368974.442 369287.0501 446574.1755 92787.8463 104020.8466 331114.5181 282898.8001 196621.6603 208815.8071 671965.1897 514405.3848 DG 34:2; [M+NH4]+@7.58 17616035.33 25574231.75 5717612.282 12394276.28 13486204.83 20299555.75 17965475.53 10304270.57 9549182.222 13135445.58 2488516.515 3307146.225 6880117.902 7827032.155 5065315.468 3128411.023 12297176.6 8754759.725 DG 34:3; [M+NH4]+@7.18 3195403.776 3342161.094 1463471.98 1455988.785 1390266.782 1681320.536 2726246.332 1591867.213 1534986.807 3136590.005 666572.8062 762531.6104 1271806.202 1334541.888 771199.5175 398095.5237 1713427.212 1361899.097 DG 34:4; [M+NH4]+@6.86 672869.7415 518341.6773 106952.3811 172808.4642 136453.3625 276305.9964 236265.8365 149094.8282 181241.2503 237160.411 54774.14162 63943.3133 83868.25696 100866.5262 53235.69644 19951.51412 150687.7788 98511.83894 DG 35:0; [M+NH4]+@8.56 265277.9248 218287.0509 23674.86743 139117.7508 145122.2964 255997.3978 182796.7089 102137.134 96217.07331 75202.88544 14345.78611 17121.06481 64122.30771 89736.75579 25933.44804 15289.61841 78764.81678 85850.83034 DG 35:1; [M+NH4]+@8.15 2040084.444 1792414.764 544665.3722 1409153.818 1519536.423 2116243.061 1316769.015 759752.8651 727548.4451 1085042.838 194164.2339 273736.6927 960582.313 1169971.064 783875.8665 314351.5213 1029930.061 679519.4017 DG 35:2; [M+NH4]+@7.85 2070927.247 1477879.207 331163.6775 1037771.031 874565.1281 1305693.557 965648.0162 547068.0584 559897.7227 779315.0928 166297.3205 203113.2056 799641.1954 815675.7094 572249.8619 285982.3604 857295.7457 662477.6967 DG 35:3; [M+NH4]+@7.49 706540.8869 509911.5026 82005.15963 345769.98 317662.4068 475909.737 384600.0995 219280.0175 186736.3133 220458.4114 53057.49309 57483.96916 205212.608 196481.2917 107377.7856 42631.88603 181694.4373 160254.9655 DG 36:0; [M+NH4]+@8.87 195627.433 150978.002 23454.24058 94898.62125 112599.7945 223299.9055 162145.9048 88925.41512 86728.41396 58595.85932 11678.97171 11943.44928 51621.27058 61945.15673 23590.8024 16705.24926 82340.24833 71544.07371 DG 36:1; [M+NH4]+@8.43 5100062.79 4250466.698 1283419.622 3134836.603 3327630.446 4605113.794 3511422.074 2168782.863 2161023.58 2662887.141 490154.1329 646776.0213 1889115.765 2108166.37 1463441.954 974221.3191 3424632.988 2073972.468 DG 36:2; [M+NH4]+@8.05 42369402.86 48035486.61 25447984.66 30674138.18 31948213.2 50073460.41 43771245.3 27109825.92 25869421.46 40122916.9 7270775.787 9563681.436 29501512.05 34076924.61 21784581.13 10758463.35 42133954.39 24666513.8 DG 36:3; [M+NH4]+@7.75 13209907.82 11048661.98 2920764.236 6798156.029 5920845.8 8773359.959 8840121.86 5260018.82 4847153.431 6433200.791 1215354.484 1594847.954 4581974.687 5043350.3 3395522.888 1716676.275 5525863.544 4369565.403 DG 36:4; [M+NH4]+@7.45 1588563.132 1396972.564 746485.4749 1181305.251 1310576.746 1717223.183 1659980.801 1099971.292 912532.1071 1179570.924 264884.4154 321771.4823 964247.7259 1337757.152 1208439.502 381661.6156 944095.7666 741003.9538 DG 36:5; [M+NH4]+@7.05 174452.3481 151674.1147 62244.31574 92829.86268 74001.2501 51685.85551 113566.0077 59974.01205 66037.8543 125414.5881 24001.76282 29576.54475 71897.71426 63449.95123 45931.12421 25231.68713 45694.77978 65593.9207 DG 36:6; [M+NH4]+@6.88 210516.9606 53626.92433 11843.47931 33332.8007 22837.77684 35946.13518 47955.75989 21671.71537 20135.40797 32963.58931 6741.400917 9616.651703 20779.41826 25696.76605 12517.46813 14288.09588 66461.15257 43310.53379 DG 37:1; [M+NH4]+@8.61 1717712.879 1023876.74 87620.0605 1016625.367 771544.1395 1564927.957 718956.3172 430618.457 317312.5456 295144.1928 79379.04371 87357.82031 296605.4488 338707.4631 83205.73875 56096.01498 351991.5314 357875.5784 DG 37:3; [M+NH4]+@8.15 2764046.381 1300677.513 277672.4394 1369926.067 1254758.214 1838560.5 1243205.213 805505.2601 694329.6894 571573.9881 117114.2108 155780.4729 861682.5519 1041226.785 574710.7165 269575.531 749003.2652 708519.9528 DG 37:4; [M+NH4]+@7.80 1217489.176 593910.6622 93270.2886 322923.2894 381977.7615 603042.3351 381703.4296 239586.7114 203374.7763 178668.0084 43470.88496 52349.56528 284998.6477 371246.9411 174473.1129 68899.71882 299997.5249 274109.3491 DG 37:6; [M+NH4]+@7.15 101132.5179 106607.42 14939.25124 27104.28388 23966.55386 22703.75767 32393.82128 16066.5596 7918.032492 22280.43997 5240.564778 6032.75762 17323.64233 19724.384 10754.66535 6111.945498 28202.85651 21699.54501 DG 38:0; [M+NH4]+@9.28 150487.7049 60961.2503 3881.697833 31942.30688 37398.2195 79363.64241 58628.01049 20386.01371 34241.00359 11771.72402 2612.495975 4108.185274 49145.06937 36705.06183 5476.390574 3926.793259 21614.25049 18606.68596 DG 38:1; [M+NH4]+@8.88 434925.8772 354445.9466 88308.58497 275938.6374 327280.7928 510856.7696 280708.0104 174000.4278 156382.1952 189319.4974 32951.77287 43464.32903 181061.1536 223492.9616 123837.335 75150.83883 302453.9382 200157.5586 DG 38:2; [M+NH4]+@8.50 16664241.53 9705497.614 2950217.123 5490137.247 5657975.841 10058254.99 8136113.228 4360910.256 3963808.433 4317854.896 1008213.59 1099300.423 5170816.602 6267158.451 2402695.308 1415467.514 9005683.685 6502486.092 DG 38:3; [M+NH4]+@8.27 84548194.53 40786285.39 8393017.204 29437542.83 28304946.77 46863621.13 39175450.6 21756944.04 18058217.4 14954132.87 3713778.14 3842316.578 19763000.03 26533963.39 9334143.259 6135398.79 30505464.26 29450392.39 DG 38:4; [M+NH4]+@7.95 18622352.07 20439941.02 3729723.461 8248013.169 9769807.822 17421997.45 17694025.7 10925437.74 9874797.638 6572843.255 1315502.82 1829947.162 7394195.277 10200007.02 3088872.081 1936576.267 11095427.84 10804414.89 DG 38:5; [M+NH4]+@7.63 4516339.248 2400188.626 349227.9259 890915.6875 940685.37 1568151.067 1656280.7 961748.4092 727030.4606 685346.7583 156765.5546 195424.1405 906993.9527 1226008.319 532676.4023 342209.205 1603941.619 1572880.193 DG 38:6; [M+NH4]+@7.42 1806404.238 2030757.396 258643.1001 1036672.9 952001.1759 1675022.726 1233142.388 755194.4279 665604.5921 661273.8145 158782.8946 197262.6482 355809.3782 378548.9641 178992.3806 218398.2828 1099108.235 1055988.698 DG 38:7; [M+NH4]+@7.02 380835.3194 301155.6743 63548.67859 241459.2529 216362.5386 307000.2104 254271.009 130931.2967 133818.5969 167779.1739 39512.74676 46175.98439 67763.29531 64096.66366 40401.83518 39382.39141 194964.6116 144080.5838 DG 39:3; [M+NH4]+@8.57 1084619.182 639058.5963 110551.85 698511.1304 892793.2304 1319690.743 521869.2543 398818.7715 326789.9619 174601.9299 42463.95766 52677.67762 334623.9284 431358.6176 276217.3462 128028.6884 337817.5419 312228.8167 DG 39:6; [M+NH4]+@7.62 219970.9022 120135.1581 17533.31684 78650.14513 64051.9208 102364.3808 63747.66963 53841.04931 46080.94792 44928.01366 8659.14602 16920.593 34095.1532 66799.8096 34278.72445 23622.41627 70271.2043 75194.68415 DG 39:7; [M+NH4]+@7.28 30225.01193 34300.32273 9566.471221 33607.71851 25362.25071 43714.1302 30375.98324 10877.88727 8859.871888 25514.55108 4603.236208 7544.897029 6159.445906 8507.937893 6677.672938 5207.453388 28822.31602 26049.86025 DG 40:0; [M+NH4]+@9.62 33909.5026 14197.06997 7744.794563 20483.90152 31276.82865 44696.93534 18448.34592 11681.5257 11607.71595 15064.66174 2250.94118 2861.489762 12480.43659 12482.80766 16074.6071 7191.906931 21705.40837 12036.36168 DG 40:1; [M+NH4]+@9.28 530773.0444 241255.0215 37054.86478 188054.114 197981.4919 312603.3585 192832.4505 127359.4497 115292.4843 119643.8848 26457.64436 33092.15537 151464.337 144854.6012 55625.41148 52474.32177 198259.0177 204294.7159 DG 40:2; [M+NH4]+@8.94 1280178.445 850994.0042 262729.2784 620385.9955 591614.5891 955777.2408 608017.5382 374777.514 469728.9999 512113.7355 86293.5355 143171.575 617199.8003 673173.5468 410801.354 221167.2658 904313.1309 649192.0659 DG 40:3; [M+NH4]+@8.62 2481559.485 3038343.309 515084.8649 1390183.045 1681871.176 3059111.448 2899512.945 1479915.918 1321571.766 761903.5378 161381.3182 230245.2525 883127.1464 1335038.577 386687.7281 233172.8395 1558672.935 1446317.749 DG 40:4; [M+NH4]+@8.45 1391070.149 1696716.357 932055.8284 1249381.616 1336649.057 1906026.547 1419414.747 879222.641 821015.7995 1195874.053 227831.3921 292626.633 1295443.754 1437607.319 1028374.74 350866.0272 1432062.584 924445.1441 DG 40:5; [M+NH4]+@8.09 2687832.257 1373960.198 338859.8355 706572.7936 736484.0635 1308947.253 1098252.204 675913.2955 504404.7951 471464.8476 119283.6134 117300.5159 679471.3753 834941.2829 356675.0982 200877.3023 975451.6042 1059342.691 DG 40:6; [M+NH4]+@7.92 3666397.64 1546300.744 261008.4525 717186.8504 664936.0327 991761.7774 1046566.419 600353.9421 563447.4802 327355.3732 105644.7872 111893.9445 554587.3134 752980.3685 244510.9739 251571.3266 1155074.827 956551.1756 DG 40:7; [M+NH4]+@7.55 2364881.53 2114977.894 475419.7613 929847.2196 892136.7776 1305757.069 1555724.582 1017559.784 882839.4318 1092129.914 218400.1385 264328.7415 846022.6218 756438.6452 342786.9202 393256.8884 1852659.667 1626366.224 DG 40:8; [M+NH4]+@7.17 33148.41413 38579.5482 18351.65642 30281.25968 18842.96055 35459.67159 59801.48886 20750.12111 29271.21417 37532.4154 8030.22424 7146.928835 18097.74759 21277.29427 12481.96585 4673.449886 31330.81955 21486.35371 DG 41:1; [M+NH4]+@9.45 47640.46547 28630.00331 6180.400016 20828.29502 30236.38711 56866.94701 23039.1968 19554.4436 14644.07284 25273.21457 3485.931859 6179.069012 28863.06809 29021.77436 18483.76324 4664.150375 14135.43976 13601.37521 DG 41:6; [M+NH4]+@8.06 24651.29494 17891.56265 8735.920321 17685.68606 11687.27385 38744.42206 13186.45932 10893.19305 9409.94499 13256.94478 1781.201785 3082.465289 9492.819387 12726.90441 11085.89175 4480.91195 9742.759261 7447.191523 DG 42:1; [M+NH4]+@9.63 388325.6727 234744.1948 29999.66698 241247.0181 298350.9363 418471.1662 212483.8026 131663.7961 125376.8862 139165.3556 24002.28868 30539.15828 115809.041 124680.1383 44111.05971 29112.95057 138169.2164 144647.8985 DG 42:2; [M+NH4]+@9.33 555334.532 417325.4868 131558.3675 405197.0377 440270.9005 679948.5984 396444.8191 229905.3823 232407.2305 291479.0591 59973.71389 83425.23924 307861.0841 332909.1212 183168.2812 101274.8037 386165.2653 277519.4357 DG 42:5; [M+NH4]+@8.49 311379.419 597301.7283 198414.0912 215329.8037 265038.5391 516246.7407 484365.0989 269309.9746 269394.1756 271449.9179 52112.50608 69931.48763 245494.9695 357466.3597 111498.2427 27950.86211 231199.6851 174433.3074 DG 42:8; [M+NH4]+@7.72 171896.6398 213774.6777 20637.65128 45506.87446 52486.33948 115470.1438 99693.4856 55200.98187 56009.32362 47547.13746 9875.683434 13176.69412 40764.70512 60146.44764 20743.24382 9128.032196 73828.43533 46777.05889 DG 42:9; [M+NH4]+@7.47 117228.1325 153385.3221 28192.46617 75008.3844 77300.61448 121933.4937 92081.40192 60404.91057 60569.15153 71533.51398 16418.60837 19814.33936 36524.26451 59583.70985 16257.74228 17842.81027 85917.72798 60750.52521 DG 44:1; [M+NH4]+@9.97 46013.55604 17583.08519 10532.34366 41234.15006 21236.97375 42669.40794 23210.28639 12906.0856 11790.52413 20116.95254 3270.85682 4663.418647 16598.94582 27895.62351 29903.40985 10431.89752 19671.42908 13069.29625 DG 44:2; [M+NH4]+@9.64 705504.329 350964.4275 65655.74715 241263.6936 246092.5431 388542.9391 319085.9994 181139.6288 156415.5252 221307.4909 52664.84499 55897.55518 216815.8914 248015.3034 82750.61575 57879.51605 304687.1469 262048.3834 DG 44:3; [M+NH4]+@9.37 143506.4748 115587.0139 31263.81823 120839.8401 178289.0745 266357.7853 110382.0696 79843.78838 64471.04488 73611.58083 18262.01766 26462.24943 96090.7128 112447.9025 35207.55254 25141.01157 144964.5883 116059.1005 MG 17:0; [M+Li]+@3.21 83327.9754 96869.755 40614.75875 104757.9936 102568.3223 145784.0283 122442.9612 64750.59899 57853.63393 63524.09435 11594.48834 16600.76049 51863.88654 66879.09508 38727.57328 17664.81391 89347.62376 58344.13666 MG 18:1; [M+NH4]+@2.98 367252.0503 706409.0144 101436.8225 181232.8543 136082.7359 275839.5831 421951.8411 210474.2249 196636.9557 251555.9428 26588.31512 33493.72564 343572.253 331471.9425 145865.0357 49428.09515 322429.0712 159281.2772 MG 20:2; [M+NH4]+@3.14 21221.84706 35494.60909 28361.60504 15938.11584 18760.13217 22915.46188 47222.81837 17449.43486 16792.84864 18740.09319 2975.603676 3189.152122 34351.86588 43478.81988 30680.10385 6698.235524 15778.24047 9270.909825 PC 32:0; [M+H]+@6.46 22947815.72 10064330.25 16301112.6 12345703.69 11435678.53 13622510.64 15637705.08 9905450.145 9695641.555 18109673.31 3823634.881 4156508.693 17805250.75 22446144.47 34206851.62 8929388.924 18172664.9 10779072.58 PC 32:4; [M+H]+@5.13 856280.1577 395546.3086 144628.7742 261708.4058 199787.1389 405287.0579 391065.2043 172135.7118 242050.9409 412810.1021 63141.75039 57942.71226 232560.4976 255217.306 202891.3606 79343.3611 255972.8004 143811.8389 PC 34:6; [M+H]+@5.34 662238.038 362108.443 103976.697 160713.1132 224338.2654 276004.3056 294997.7001 137826.7367 141759.7821 208706.1709 47924.92884 48270.95525 133838.5326 120447.9139 73012.84737 15619.36131 92480.06086 62635.47082 PC 35:5; [M+H]+@5.48 678647.6215 262800.9814 37131.47386 166771.374 261882.3482 438879.1332 125778.9562 125595.413 101443.5409 80017.60199 21064.71758 25432.38698 89115.16031 84149.76317 37824.62425 24998.32068 114078.319 70111.70264 PC 36:2; [M+H]+@6.84 84295508.32 41873381.59 33641475.44 40272575.29 39412754.75 55331553.96 49702113.94 30428196.84 29741084.77 45796079.57 9291697.369 11251577.92 40485918.22 48267124.71 46876079.64 18244140.8 47651189.47 26945772.56 PC 36:3; [M+H]+@7.13 1094571.878 410368.3683 166147.6645 627169.8094 519936.3322 810198.4605 401390.3185 245962.5768 198402.3921 291060.908 56643.8999 68674.45551 202613.1542 206019.0997 122368.0067 104432.1889 214188.6571 139455.5472 PC 38:6; [M+H]+@6.33 4541495.695 2006480.97 843606.1586 2040055.211 2269332.045 3043371.717 1443138.971 1238582.54 1122716.318 1330182.751 240099.692 15117.36442 1466477.114 1742249.598 1561313.121 635237.2579 1113564.045 1337704.436 PC 40:8; [M+H]+@6.32 34185.57779 13664.85475 8888.573953 11568.61245 18446.42614 26559.36868 23333.16539 10031.61988 10012.97042 18236.59367 4167.004263 4534.488715 22146.28199 18480.87349 16696.27152 14385.76434 29062.1046 17514.86036 PC 42:10; [M+H]+@5.70 410331.7983 360772.0453 50210.05343 178393.1331 194680.2642 327376.3701 298802.6704 186827.6874 205001.1295 124899.0684 24569.26674 31805.97701 130404.7552 194188.7395 41319.68466 26040.78402 203714.2522 167569.7431 PC 44:4; [M+H]+@8.24 191036.396 129616.3226 71066.63782 279077.5899 288231.3557 415313.6495 226631.2405 125571.1745 108885.2742 150790.8553 36007.56259 41259.86439 156152.0817 214629.9891 142405.2954 36456.83683 103374.6166 105105.291 PC 44:6; [M+H]+@7.53 177636.8703 224103.0096 34781.93048 289115.9293 222027.6146 425325.4257 190197.7062 127387.4522 104997.8321 145468.4312 26346.91476 35398.60328 111660.5059 122468.0925 40217.78901 29101.69657 137433.4568 119975.32 PC 46:4; [M+H]+@8.66 134934.6854 83505.04067 14069.96818 119387.648 141989.4071 215785.2311 107346.9881 56828.71259 51152.76059 95882.00842 15411.38089 17471.9947 62373.18071 29101.55806 32630.43645 15396.92289 55087.96904 41537.38413 PE 30:1; [M+H]+@5.54 157953.2126 117038.6589 17093.01301 91821.48828 144541.8961 177175.6674 136478.6678 89157.23463 60936.9511 64009.83917 10347.11206 16686.80941 35460.72596 52600.08157 22717.68688 6425.987342 30220.14526 32317.20077 PE 32:2; [M+H]+@5.67 425448.736 197422.3094 81249.96668 291500.5525 304973.6232 470419.3096 351333.7918 227960.4869 197211.3251 203487.182 36243.94947 45232.81138 145092.9419 185147.6819 183727.4723 25233.74326 76439.40877 66958.19205 PE 33:2; [M+H]+@6.01 333983.1854 80663.19978 16186.56409 60071.66239 58380.84777 76478.18382 66636.3463 45227.34351 27565.18746 42189.61617 8556.331797 8980.395464 21121.24516 40563.83814 23610.58057 6409.11483 55705.91868 26325.82596 PE 34:2; [M+H]+@6.32 8932524.505 2796599.262 1123806.023 3056690.45 2556295.479 3267101.982 3667299.081 2356651.13 2331773.403 3287252.271 562517.2278 618120.0318 2370122.015 2293708.582 1972411.329 803995.7506 2129478.111 1836721.744 PE 35:2; [M+H]+@6.65 445101.6539 182935.0284 33389.67246 250548.4272 224912.8119 307428.3975 159360.5211 99528.31803 100550.6329 95298.26911 20799.18578 24795.59857 122670.7882 135802.3201 80029.541 28824.9106 80946.91856 72618.59126 PE 36:1; [M+H]+@7.40 6268073.198 4795557.092 1333387.959 3935273.335 3668713.822 5945199.184 5001277.262 2850425.708 3230757.326 3316954.619 690744.5686 821861.3995 4027057.942 4572217.423 1786378.503 609253.9088 3746029.812 3200919.141 PE 36:2; [M+H]+@6.93 41543593.11 11924706.26 6393661.537 8402273.086 7507081.255 11873359.4 13795930.44 8285488.104 7996595.008 11338558.87 2752541.689 2539057.355 12939617.94 15436490.68 9563187.845 3457799.789 15390112.75 10202943.89 PE 36:4; [M+H]+@6.29 7550610.805 4601777.764 1413311.841 4560055.345 4016506.298 5809777.356 4057071.223 2334714.273 2403006.362 2975314.558 621892.6504 712131.9253 2273805.835 2336993.202 1257029.319 727713.8574 3308597.799 2835135.147 PE 36:5; [M+H]+@5.86 1568825.421 1041613.307 163958.7133 701432.5063 759820.4279 1254471.321 928079.3271 590088.2817 584806.1969 484285.4972 87262.76218 118610.8411 328038.221 372221.167 110237.3227 67663.61097 362529.3127 373715.357 PE 36:6; [M+H]+@5.48 764591.3526 399767.2259 38438.60586 416743.3145 499738.1828 808289.1978 402037.7853 297238.4437 174560.1084 248309.7625 59919.98162 46076.95399 110203.443 162481.4685 36878.3659 13349.54249 109678.0688 116107.9819 PE 37:2; [M+H]+@7.33 785494.8531 688759.6413 209703.8347 437393.8519 444567.5725 789067.5347 676927.6043 428410.0184 342802.042 387001.7457 64002.84425 86841.58134 412895.3919 469626.9553 194961.5554 43084.05845 298734.8345 228960.9382 PE 38:2; [M+H]+@7.46 5455115.702 3385857.458 933748.7528 2607168.525 2827277.955 4082197.26 3235516.43 1946179.402 1869914.106 2238407.751 450266.9027 538661.301 2210582.776 2375792.025 973844.019 392640.1422 1986329.494 1779357.084 PE 38:3; [M+H]+@7.27 12934698.14 9382992.678 1578116.326 12449525.78 10697405.62 16484266.84 8111425.792 4883348.422 4866154.562 8352544.646 1096351.11 1284450.156 3959932.405 7121478.393 3011459.931 784792.9791 4068927.419 4133940.706 PE 38:4; [M+H]+@6.86 79271210.56 21762898.66 7763316.235 19668168.67 15985946.6 25795282.17 20055617.15 11458117.71 10859687.34 15347008.06 3646138.96 3345412.954 11380979.92 12101362.67 6971393.09 4331650.855 18974755.9 15090293.57 PE 38:5; [M+H]+@6.44 15578629.82 7262859.122 4403858.63 7327259.08 6979455.865 8716919.336 7103716.788 4484988.775 4339693.44 7743715.183 1409128.723 1592664.249 5894433.212 6643560.424 6357250.15 2889451.248 7669905.375 4651399.318 PE 38:6; [M+H]+@6.23 2385410.13 1101555.95 578842.361 1148337.163 1232815.828 1533100.289 1085046.904 676066.4022 689212.2584 1123673.342 202522.0563 257019.154 944624.4073 1003244.969 973157.6381 329256.2155 900343.9937 645460.0886 PE 38:7; [M+H]+@5.72 1775541.777 709303.4212 147058.3073 532674.2318 570722.8089 851958.616 652318.0563 391392.1984 363436.3897 376421.833 82098.77269 86899.46118 387190.5065 395570.522 136062.3955 39046.51617 357327.5831 276629.4845 PE 39:3; [M+H]+@7.52 1094571.878 410368.3683 166147.6645 627169.8094 519936.3322 810198.4605 401390.3185 245962.5768 198402.3921 291060.908 56643.8999 68674.45551 202613.1542 206019.0997 88467.87707 76409.34597 214188.6571 139455.5472 PE 40:2; [M+H]+@7.94 236312.0812 163779.5843 46465.04754 123719.3681 176056.7087 157640.3391 136201.3328 78490.82167 90719.61059 97384.48072 13987.72058 20404.20136 139517.8642 161454.4661 65829.73059 26824.93871 120028.3609 107468.0724 PE 40:5; [M+H]+@7.07 5982158.952 2139126.853 746422.1364 1721487.916 1563112.862 2342332.339 1958564.547 1089679.623 1184313.291 1199994.806 295002.2301 301540.1382 1643135.539 1885398.167 846155.1558 292149.0274 1544301.983 1342685.713 PE 40:7; 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[M+NH4]+@10.05 15980052.42 5427472.916 1352118.433 5675635.01 4768117.649 7484511.464 6404523.298 4114311.738 3799460.818 4899846.714 848693.2331 1131887.788 4112834.493 4261394.516 2953913.422 1391100.504 3602114.728 3110299.19 TG 46:2; [M+NH4]+@9.81 10483821.2 6522221.006 1640537.681 5969480.599 7581744.768 10701361.35 7339431.132 4674570.813 4062143.209 5186917.774 908822.0374 1258443.958 3727390.608 4580744.619 2661526.747 778677.5013 2202571.098 1892575.93 TG 46:3; [M+NH4]+@9.63 2210348.54 1905375.573 457978.4118 2026383.549 2217205.998 3049133.345 2298122.99 1299636.459 1242744.794 1828038.26 336839.1478 454965.8567 1002891.369 1173717.866 773273.9595 136738.6725 419958.5811 368299.4676 TG 48:0; [M+NH4]+@10.55 891535.6435 304395.2792 218661.0698 451849.05 627610.1762 811245.4528 485192.4936 346516.3895 299770.2712 347601.1837 71624.4944 98230.37538 449615.1087 404302.6379 761038.1667 237286.9672 338004.5569 271206.1133 TG 48:1; [M+NH4]+@10.31 16007793.93 7133750.052 1565274.09 7316971.868 7206636.096 10796206.5 6412534.795 3951486.672 3959179.664 3844570.433 822878.8666 1092339.214 4225472.253 3940596.748 2528092.599 1265510.671 5065049.405 3839435.366 TG 48:2; [M+NH4]+@10.09 28057362.32 14601132.27 5029747.538 14587113.48 15568446.47 22235453.25 15793912.71 9849979.753 9220626.216 11674710.98 2041210.609 2971487.935 9573956.265 10884867.72 8356187.389 3264707.116 9043740.943 6233397.507 TG 48:3; [M+NH4]+@9.86 37375276.94 15533480.13 3148296.082 12125801.32 11490435.32 20062852.15 15616513.03 8777995.476 7808477.448 10350411.09 2335105.53 2382460.189 7616861.661 8597519.805 3314611.192 1270487.917 5805351.492 5699812.527 TG 49:0; [M+NH4]+@10.66 423815.9831 257117.9381 44046.10781 256884.4786 265523.76 451203.1636 254012.1017 138282.953 104569.3575 92293.18922 23383.25335 38583.43481 153311.9361 84522.05117 85174.05263 45149.43721 144326.1433 92306.79155 TG 49:1; [M+NH4]+@10.45 3924417.829 1742165.86 347859.0058 1749904.865 1873413.329 3080067.973 1361309.044 775785.1341 852957.3564 940013.6906 170577.847 226996.7623 1195564.187 1051165.815 755426.9407 273273.089 958333.1951 788959.7423 TG 49:2; [M+NH4]+@10.26 10846966.86 3376311.934 1040843.418 3970047.768 3497994.267 4759793.546 3403218.402 2229926.227 2139145.337 2684361.735 540850.1724 663890.4583 3303243.45 3161062.166 2612616.36 879044.8184 2309799.044 1877063.088 TG 49:3; [M+NH4]+@10.05 4076706.944 1608109.469 493999.5427 2162763.272 1745609.913 2631062.42 1819880.902 1114469.85 1082765.187 1588892.263 281223.2838 344066.1215 1440078.153 1407877.739 1036489.652 267694.6351 808770.6368 607884.3943 TG 50:1; [M+NH4]+@10.56 12798718.67 5466616.815 1333485.79 5373047.638 4993795.781 8088902.883 4941299.976 2972074.975 2809200.757 2853937.788 579600.3887 776706.5893 2954870.127 2534533.984 1917397.415 1196971.347 3672815.299 2633238.546 TG 50:2; [M+NH4]+@10.32 49600182.99 15686002.65 6932596.188 15020748.37 14740810.69 18065089.16 16896134.13 11143107.4 11020826.14 15766052.09 2946754.565 3491704.213 13810774.63 12172095.1 13266546.81 6391445.987 15981046.37 11764745.29 TG 50:3; [M+NH4]+@10.14 58486788.81 23125234.95 9005303.767 23377273.9 19998679.17 26580576.91 26295566.96 16257047.66 15868747.39 23719042.84 4176748.654 5074333.301 16902310.61 16200168.9 11730803.14 6268956.102 18132574.39 13312837.37 TG 50:4; [M+NH4]+@9.95 28586731.73 12956499.27 3909281.275 10398939.29 9572581.511 16256234.47 13028649.34 7303496.372 6596387.775 10218433.81 2265390.943 2336126.886 6731777.352 7537923.221 3261119.163 1156717.089 5929366.827 4971557.815 TG 51:1; [M+NH4]+@10.71 4769088.81 1260206.804 310170.2707 1300359.182 1429466.731 1862800.508 1151086.998 732851.63 663500.4074 921945.9372 159793.9152 200014.276 926903.0868 812510.5148 648236.3507 334834.7221 681584.5127 639085.3679 TG 51:2; [M+NH4]+@10.49 11132809.98 3272578.027 1274711.668 3535073.954 3319412.74 4343978.406 3254185.698 2161337.223 1928975.459 3211314.798 495854.8033 636286.442 3200855.719 3002852.666 3181452.034 1280381.113 3149739.841 2184499.073 TG 51:3; [M+NH4]+@10.31 6564574.71 3805762.744 913941.1862 2783368.414 3283950.168 4948751.978 3675871.538 2176326.514 2449254.913 1713872.642 375805.5777 515182.4053 1951846.69 2299820.199 1018493.204 358683.6066 1816862.765 1382491.913 TG 51:4; [M+NH4]+@10.11 2054047.301 1237684.311 333779.9987 1671959.548 1478062.539 2377256.562 1139060.944 683806.5031 671666.0867 856420.9512 172688.7606 220480.9732 906343.8426 985035.5278 492324.6555 145553.21 597916.2064 448444.7312 TG 52:0; [M+NH4]+@11.04 705236.1431 271613.9219 112939.2442 635420.2979 376682.1677 867532.8087 664420.1153 408424.1313 348366.8598 354749.242 69295.65422 86115.58332 289516.4976 307348.2062 488139.302 190342.411 316219.4733 225850.1595 TG 52:1; [M+NH4]+@10.81 28031940.44 6381982.554 1344409.67 5830540.623 5766123.14 8471746.355 6989225.004 3794163.134 3708558.049 4079531.678 765401.1728 853094.351 3435402.081 2440738.559 2112174.916 1633396.59 5068633.159 4195703.384 TG 52:3; [M+NH4]+@10.38 71750560.3 23758726.15 13164245.99 19866853.1 20608020.72 24435945.32 25962798.82 17754843.28 17041600.78 28179283.09 4476807.385 5683536.749 20585926.27 17797897.7 19918832.45 10717842.02 27154019.1 18966082.66 TG 52:4; [M+NH4]+@10.20 22123245.37 12671612.9 8394418.903 12438002.75 14179302.79 17526823.91 14325483.3 9621595.467 8741090.308 13027573.57 2531813.043 3548848.916 9993182.281 10826051.48 9555909.368 2982536.254 9319260.829 5736662.677 TG 52:5; [M+NH4]+@10.01 6718530.817 3342068.765 1777621.565 3705169.939 3200446.518 4266414.728 4065530.31 2480176.486 2446513.055 4074323.14 745873.7254 913327.6923 2842078.622 2959171.644 2087068.218 762064.8933 2513606.862 1767286.165 TG 52:6; [M+NH4]+@9.83 1432796.913 1518571.374 425060.5687 928263.0448 1052604.776 1782178.374 1691104.092 931337.0568 835992.0832 1050135.416 195510.8318 270189.5722 600700.3202 807612.3179 279423.903 97526.57224 607875.7024 469139.5034 TG 53:0; [M+NH4]+@11.16 364429.3148 139646.0764 30485.63899 154077.9572 406208.7398 517565.8679 364112.7228 100839.0046 108605.2094 142730.3293 14289.95378 19525.18203 60183.72362 82304.10887 84373.28084 33745.31555 141806.142 110619.8279 TG 53:1; [M+NH4]+@10.92 3113204.578 1317409.455 217356.9198 1730852.595 1731004.21 2688517.098 1249924.681 700551.905 723330.6722 655561.5976 128227.0874 170282.0952 722807.8598 638689.571 431249.2403 219051.012 643576.1663 612234.8026 TG 53:2; [M+NH4]+@10.73 10142784.93 2766509.451 901972.9773 3705865.798 3062280.425 3445268.796 2622946.718 1752209.231 1888306.601 2625280.163 414731.8808 547049.8115 2881570.068 2311998.718 2389862.908 1004327.591 2131839.961 1653678.029 TG 53:3; [M+NH4]+@10.53 10914261.44 2813810.159 1093256.444 2652776.63 2615726.324 3420843.341 2678789.74 1588208.908 1570581.475 2260797.016 391418.7671 481220.4639 2604320.5 2306733.294 1904941.437 874742.0144 2345855.974 1754830.591 TG 53:4; [M+NH4]+@10.36 1798703.636 1180750.032 419300.0538 1012187.53 1293439.388 1756882.507 1257156.31 734670.3351 827773.433 709397.1146 159521.152 186558.654 905601.278 913171.6997 459710.5981 122748.6784 697088.5322 481912.4624 TG 53:5; [M+NH4]+@10.16 2281495.034 722158.1937 217921.0106 754679.0111 692245.5384 1039339.33 681485.8518 388370.7141 365150.837 480220.1352 104709.0774 127496.1216 745892.9306 848199.6842 350220.6171 120787.4954 482081.1761 421318.2229 TG 54:0; [M+NH4]+@11.28 964968.0154 295677.8943 41370.10611 335209.4837 451049.4449 569286.9524 423095.0093 292771.0613 250510.4137 138764.4431 24976.16701 55170.13996 204589.0984 161375.0374 136015.781 99171.11184 276127.1493 213751.4116 TG 54:1; [M+NH4]+@11.05 17967178.21 4599495.728 879886.8761 3791135.798 4171824.283 6684473.739 4732498.271 2774942.412 2342650.97 2376001.247 489663.1418 558989.2523 2536096.233 2172831.522 1306617.064 906839.6767 3672609.782 2852539.737 TG 54:2; [M+NH4]+@10.83 34430965.4 17512808.25 4887569.185 17840137.16 15639282.1 25082951.03 17547780.76 9731410.52 10500258.79 11530311.78 2056874.804 2817724.578 9939221.424 9421853.882 6230856.831 3820712.857 13948809.98 10038074.9 TG 54:3; [M+NH4]+@10.62 72836839.01 24846350.13 16851597.59 23121829.84 18758164.71 23084136.56 26825960.52 18988364.81 17997311.39 32156598.52 5424658.383 5828236.023 24064752.8 20923806.19 24146567.45 14058192.83 29011938.04 18044822.1 TG 54:4; [M+NH4]+@10.44 37655570.85 13900664.54 9775858.217 13121010.78 12097254.44 14968671.37 17103123.17 11082646.84 10760557.74 19312956.42 3033079.46 3623987.457 12337574.64 11859733.9 12683506.79 5666072.245 14149578.85 8805598.14 TG 54:5; [M+NH4]+@10.28 8088760.092 5480933.677 2445431.287 5660118.258 5862570.004 7985895.837 5377832.14 3308372.66 3390457.792 4226033.195 919048.0881 1067308.136 4303790.322 4184979.305 2607159.345 847060.5514 4176583.032 2809238.096 TG 54:6; [M+NH4]+@10.10 6815284.822 2721966.9 1174060.873 2091106.54 1917397.667 2897052.079 2697070.102 1556120.175 1374978.305 2246423.656 511347.4849 526676.5126 2232268.143 2516085.47 1201439.64 498559.6351 2699977.272 1892485.304 TG 54:7; [M+NH4]+@10.00 6251388.813 3554558.567 480440.9021 3448150.103 3018647.012 5513063.835 3346832.468 2225965.349 1524124.452 1849282.287 479238.3398 526131.62 1395198.518 1632037.298 512741.5083 318424.1029 1875229.538 1586344.067 TG 54:8; [M+NH4]+@9.71 534810.9192 473785.7332 153166.0449 392747.7225 431689.3673 605778.9791 411256.3603 230613.0758 232049.1913 342742.2621 68153.15038 86801.08393 260576.5062 284363.1925 160799.074 87248.1625 291841.3109 170565.2216 TG 55:1; [M+NH4]+@11.12 1443901.435 465626.3604 91608.65416 591161.8202 626313.8734 831057.8456 470933.5458 291081.8565 264507.796 305469.7109 47775.15012 67105.26967 362487.3584 284497.0553 258794.6256 116259.6905 294554.8532 133190.5436 TG 55:2; [M+NH4]+@10.93 4649814.738 1365796.922 412935.1047 1814815.787 1531338.395 2249885.472 1384918.235 901923.6577 799300.3317 1143852.139 184547.3476 235077.2174 1227665.695 1155381.439 1025849.536 454847.0644 1139947.319 880299.9393 TG 55:3; [M+NH4]+@10.75 4770882.91 1344679.615 543613.6335 2062703.919 1506256.644 2186224.011 1471770.351 991989.0155 893969.4474 1319003.852 229724.8333 278488.6209 1380734.16 1235313.313 1202150.661 538381.3933 1309214.721 1002941.427 TG 55:4; [M+NH4]+@10.61 1949625.406 833643.6821 248610.7244 705363.8679 689841.259 829855.9632 519161.8607 335039.2212 320513.7638 468597.4554 90112.88898 108695.6071 713843.3404 471686.632 429406.0661 159455.3948 344425.2288 339550.1547 TG 55:5; [M+NH4]+@10.47 1014429.365 600473.0253 207611.6403 646130.5059 684698.2501 1013547.2 605015.8806 286415.2344 305265.3374 491231.7015 91183.77568 93359.49128 515782.8241 519199.0122 365234.6359 113396.094 434838.8368 357335.4958 TG 56:1; [M+NH4]+@11.29 3081918.956 1642688.326 222264.2541 1818419.056 1045583.441 3397690.77 1651025.093 1017385.689 460696.5269 766309.957 122503.9114 225955.4325 914881.193 791542.7083 254506.3812 202909.3193 864313.3087 889678.1417 TG 56:2; [M+NH4]+@11.07 12644112.37 7303473.88 1820588.332 7328715.536 7242780.652 12311142.95 6731441.53 4066836.822 3810770.23 3704293.343 708318.1021 1021112.723 4403639.907 4087912.17 2120667.529 1307956.459 5905219.877 4510321.771 TG 56:3; [M+NH4]+@10.87 31757830.79 12314803.78 7407881.773 11609605.54 9146279.54 13475186.74 12907137.13 8269385.185 8385105.358 13088157.79 2305254.686 2924109.628 11300195.99 11508396.42 10369973.14 5353683.155 15487665.87 9195918.834 TG 56:4; [M+NH4]+@10.68 29159566.49 10758873.23 8020985.75 11431232.18 9593830.439 11568419.46 12967560.55 8483977.723 8364319.401 14970895.49 2476533.198 2827258.894 9929907.542 8790399.048 9799943.336 4434086.114 10464399.14 6757103.062 TG 56:5; [M+NH4]+@10.53 12426833.16 4455261.995 4550590.756 4990155.441 3957558.479 4855730.183 5191923.802 3596477.588 3671988.058 6551688.783 1210831.56 1393424.469 5642753.995 5027200.472 5522051.749 2280688.36 5553386.706 2984768.959 TG 56:6; [M+NH4]+@10.41 5821930.474 2055210.556 1076224.562 1510223.638 1578749.641 2268907.365 2092391.655 1176556.427 1132445.843 1778528.012 369951.156 383933.9155 2251994.015 2203975.038 1305523.706 576220.2228 2678124.168 1863547.191 TG 56:7; [M+NH4]+@10.28 4380155.787 1658009.574 676999.9496 1294572.088 1387537.638 1769536.414 1544191.275 1093184.75 997363.0613 1437839.109 296035.9428 328392.6205 1565265.646 1567172.381 890694.6666 618138.9187 2461544.024 1868968.005 TG 56:8; [M+NH4]+@10.09 2315037.676 1063150.996 461670.9784 1112107.083 839925.5721 1322904.744 1321850.196 803705.1068 713049.1941 1229094.674 213916.4872 262634.7166 973323.7763 931100.8301 619508.5808 455785.9861 1536865.509 1066701.505 TG 56:9; [M+NH4]+@9.83 612934.7814 483279.2717 136656.0696 338437.2951 329767.1019 509574.9303 367819.8307 267517.7671 258264.7408 424095.0879 81655.12702 92514.62243 268300.7883 285786.4689 136284.2222 59752.2549 304488.5164 247911.0127 TG 57:7; [M+NH4]+@10.38 523119.7918 159558.6316 64712.41282 151804.703 128736.3517 201010.3129 107275.9911 108611.5524 82714.0589 120599.7557 21553.6252 31279.2887 151034.5658 207427.4275 108961.1805 50893.56792 205866.3601 116020.5273 TG 57:8; [M+NH4]+@10.23 165605.7719 81551.07065 43786.50752 107794.151 119652.9994 129706.1342 67997.64908 49057.49833 50788.04619 72177.22646 14459.37777 17134.53797 87945.0164 86230.98956 69629.52374 27387.77534 108785.6241 55439.65695 TG 58:1; [M+NH4]+@11.57 2143244.065 739262.1464 72359.66435 836658.327 878339.6194 1233558.537 822490.4215 848213.9015 449646.6139 450898.434 79738.52617 76745.54 427947.0494 383671.4365 161665.1236 118335.4058 340532.9532 411194.2577 TG 58:10; [M+NH4]+@10.00 226340.5368 137647.2487 48689.28505 155487.3582 119969.331 193491.1556 172085.9406 105259.7275 100277.7785 160614.1745 25125.67794 30617.23544 115605.9396 131570.1958 83282.15027 52895.28613 141983.1514 111510.774 TG 58:11; [M+NH4]+@9.80 53622.0888 40164.28282 9754.978571 28683.49879 52673.38701 31342.22291 35007.69444 21450.48099 28126.70583 31930.59268 7225.492769 9116.095065 28271.52925 46475.39093 12499.0647 6679.453063 43723.59512 28653.92094 TG 58:2; [M+NH4]+@11.31 13470571.58 4738920.972 931153.4503 3657910.236 3846261.37 7145343.665 4330948.088 2540724.966 2233488.929 2547104.28 485166.6086 557889.5034 3040273.83 2978730.606 1339521.754 743148.8401 3647699.328 3043549.937 TG 58:3; [M+NH4]+@11.08 24199634.51 8847697.018 3004222.269 6493523.06 6151924.721 10227327.47 7662722.563 4686286.45 3899765.282 5860964.136 1215395.085 1332636.103 6609614.616 7273318.133 3058071.946 1736250.237 9932282.431 6699634.573 TG 58:4; [M+NH4]+@10.92 9648605.452 4396987.862 2730224.796 4448037.378 3773383.538 5068613.357 4746577.843 2842645.714 2844277.914 5020692.357 889648.9143 1116372.937 4066579.151 4062319.415 3424183.978 1664279.766 5112016.263 3225344.075 TG 58:5; [M+NH4]+@10.74 8133504.316 5855363.745 3448955.418 6849572.345 5594492.293 8246507.6 6701557.734 3913507.235 3654482.408 5879612.075 1190642.506 1476177.687 5885758.429 5713279.944 3499998.902 1431101.427 6383805.955 4238278.912 TG 58:6; [M+NH4]+@10.58 1477097.554 951905.8454 444405.3494 951851.183 890834.0175 1342780.863 846149.3923 509789.1268 516753.8141 725880.7439 136208.6415 172395.7725 787606.6518 732749.5409 585941.0297 205693.4571 863221.8005 502152.436 TG 58:7; [M+NH4]+@10.52 1733184.679 1047978.137 567325.9663 878591.8953 955123.5888 1431606.58 1128741.694 641595.3126 666962.551 877128.2147 163556.3999 214374.1931 1152419.895 1129671.197 763810.5194 357928.4946 1659002.657 1021273.902 TG 58:8; [M+NH4]+@10.31 2453918.13 1471192.623 761629.2282 1171013.317 1197761.52 1759258.338 1473033.275 958665.639 934179.3373 1204096.085 255231.9509 313830.9074 1426745.746 1510773.983 810778.227 513452.9787 2938486.591 1803191.769 TG 58:9; [M+NH4]+@10.19 733973.7035 428660.4471 232386.9351 593959.8083 625256.415 808909.2995 654759.3483 400582.3912 328808.7079 545949.8731 80353.20938 111024.891 475782.6989 539458.136 228021.572 118693.3098 634452.2027 416108.7123 TG 60:10; [M+NH4]+@10.28 1120791.246 663225.2821 178894.7199 323796.6383 282311.0865 623672.5517 403831.8933 272232.3019 273418.0245 327618.7768 60166.11713 79850.7089 370897.1228 426376.8695 178416.2328 97025.16434 547778.5516 416512.2369 TG 60:11; [M+NH4]+@10.14 408258.1662 223030.5927 41110.55761 144013.3555 64079.87477 188112.1166 129723.6043 80232.53517 78698.06828 107548.6868 19684.0664 19485.84307 94922.0123 107437.0167 42587.12423 30743.92466 176366.3594 120315.5719 TG 60:3; [M+NH4]+@11.29 15187820.35 6390269.846 1442012.514 5012148.84 4922714.185 8267236.532 5799114.04 3411538.086 3080936.558 3873513.154 834412.779 873881.4993 4752585.618 4914857.386 2002817.685 1056544.793 5554337.882 4160665.84 TG 60:4; [M+NH4]+@11.12 2603312.79 1770303.247 880988.1925 2005780.005 2349884.76 3336218.18 1968793.785 1245567.15 1042554.753 1684255.589 310028.9528 417839.5256 1691534.877 1913719.351 1415161.538 508435.531 1702340.763 1115817.625 TG 60:5; [M+NH4]+@10.97 3655372.155 1935032.777 1096221.823 1935613.606 1650541.11 2260163.41 2033079.853 1265016.235 1188929.593 2348797.319 395503.7897 476146.2871 2092760.281 2088745.684 1783725.898 662335.7318 2179646.393 1446218.548 TG 60:6; [M+NH4]+@10.79 3507508.416 1587898.085 914290.5174 1181391.83 1230182.514 1755751.486 1539748.707 791062.5779 795637.7165 1433008.211 298095.7333 337821.1704 1449757.374 1630920.456 945366.72 302759.8064 1405338.939 907050.8665 TG 60:8; [M+NH4]+@10.50 627181.5675 343660.3641 184741.8298 269373.9848 285156.7313 363754.792 355130.2245 206023.3862 219385.7818 251771.7634 50214.11894 63338.13918 361329.1499 314186.1702 230823.4801 168257.4093 670208.8655 441799.8298 TG 62:12; [M+NH4]+@10.22 119028.3899 37246.57765 8569.101116 36458.77158 27471.45103 50454.18575 31166.86248 26476.13908 20582.1116 41017.89752 8530.4016 6059.646867 45932.69685 47877.73339 21825.70092 13874.7561 74874.53428 54122.4559 lysoPC 16:0; [M+H]+@1.61 2101187.029 1082833.64 322843.7159 961278.9881 936970.2383 1390186.22 1077679.862 638638.5302 596993.2507 1079207.041 186027.246 212484.4884 566408.8045 580596.422 281071.7263 148738.0311 935665.8867 763664.1387 lysoPC 16:1; [M+H]+@1.28 203536.4327 136082.0725 50614.20148 136988.8838 138834.2494 182093.6914 152751.8646 112658.0985 99360.17532 241785.7031 33311.91973 40202.73294 77218.28093 82401.92469 65584.58951 27989.14606 109909.6378 70938.46535 lysoPC 17:1; [M+H]+@1.46 20483.14398 14609.97332 6958.422359 19605.40598 25746.57565 34225.96131 20946.62078 10909.23326 10170.37927 24459.79519 3530.811847 5357.236403 11033.40059 15928.93253 13577.54962 3738.886861 18417.03986 7475.78435 lysoPC 18:0; [M+H]+@2.39 477012.3006 553959.8217 118076.2505 461543.5039 542522.9812 885063.0691 505476.2194 335136.9663 281254.8556 304650.5221 44278.386 69886.6546 156251.345 167151.7799 59252.44419 41144.23049 321496.8598 258757.4388 lysoPC 18:1; [M+H]+@1.79 1910247.687 1179238.72 500569.202 861980.9016 899348.8053 1355123.292 1345020.854 847753.0591 724475.004 1902792.729 307045.0652 316466.5392 961227.2127 975812.7416 488736.221 210950.7267 1441674.864 1030104.406 lysoPC 18:2; [M+H]+@1.37 184609.4276 155063.9712 28878.95643 184192.5281 188771.5108 274783.1568 229833.7662 116362.8391 87108.08738 150351.6155 31887.53034 30896.0771 58887.63934 57493.36045 22061.32244 10467.43918 73522.07241 53925.21893 lysoPC 19:0; [M+H]+@2.60 17495.11713 18790.95664 9502.222663 24610.79085 36308.29515 43613.14473 14816.8762 13597.08457 10634.94857 9417.123283 3164.655125 5040.536285 12505.54189 11909.66048 12476.14614 8317.311097 20286.01556 9044.975301 lysoPC 20:1; [M+H]+@2.52 129402.5751 93934.83634 15723.34961 55876.03657 59160.98354 105076.0937 41266.50718 39760.63805 31016.02165 42774.49224 7492.68948 7456.024103 33727.76616 49090.31692 15012.65217 8238.364397 74253.43709 59445.42387 lysoPC 20:2; [M+H]+@1.96 52279.20587 33693.48369 10465.84001 35438.30123 40637.41112 59290.50282 46581.70928 26637.15647 23619.22469 54335.15432 7023.093557 10036.87 27232.77044 21487.53338 15615.24777 6244.186125 35500.31673 28457.58176 lysoPC 22:6; [M+H]+@1.26 27933.13119 28202.03276 15735.88629 29981.40948 27601.05494 30327.04137 48344.58252 19439.75654 25239.40558 44786.66825 6714.283038 2548.412489 22596.44729 24594.36251 22430.74851 5550.673395 34783.60367 19858.09306 lysoPC 24:1; [M+H]+@4.25 7518.90867 11283.56563 6145.739589 22132.48464 19759.08667 24845.08695 16946.01595 2714.229684 9233.666685 20110.6926 2524.443618 2295.104769 11714.34007 7106.71987 8096.572726 3953.136094 26510.83274 11362.55858 lysoPE 18:2; [M+H]+@1.34 24451.91473 16629.75913 4017.53994 14952.67925 13712.79686 16574.34746 12378.19975 13348.34066 8890.411633 13941.81645 2204.162045 2187.084564 7835.593514 12662.17182 4139.220577 5800.187684 12668.83953 7376.913027 plasmenyl-PC 18:0; [M+Na]+@1.65 33312.98227 34023.73991 43300.90033 44933.99431 60834.0276 60834.13061 68582.77905 44404.63438 39210.3336 108502.7393 17055.1002 26047.19477 52270.95107 87524.48866 72617.53473 15222.86305 58962.2288 31322.72237 plasmenyl-PE 32:0; [M+H]+@7.05 18008.39338 27876.08933 12707.33015 5746.643664 16623.08679 7065.343751 21420.12364 7508.739576 9866.679112 17432.63713 3986.350045 2507.887842 18388.73081 15241.18689 20507.31674 18286.97813 85719.89382 33044.84975 plasmenyl-PE 36:0; [M+H]+@8.10 19198.2099 10638.62694 10705.36642 22307.18535 19192.13937 19620.5054 27767.23418 8435.211512 8048.138009 26104.06301 5529.376461 3360.210711 15733.44457 30366.24937 14439.70019 9484.835146 99248.93051 51042.17313 plasmenyl-PE 36:3; [M+H]+@7.07 1346566.743 680575.2696 71000.0909 787850.2725 656094.4535 1247119.901 546342.3445 353671.4821 294147.8779 285148.3373 67055.49097 90073.75227 248273.3814 222182.4714 59418.92513 41024.64918 247275.8585 234848.7333 plasmenyl-PE 38:3; [M+H]+@7.62 1734467.224 1111926.38 85030.7268 569085.4566 552989.6766 1224780.749 525379.9663 309261.1135 306687.3249 264832.962 59791.86272 72872.0956 215345.0152 229722.551 57358.36545 46291.01451 286580.1105 262328.044 plasmenyl-PE 38:6; [M+H]+@6.53 131548.6056 46739.97507 28745.04653 47057.41491 60881.86136 51345.27975 41017.65075 50164.02326 47951.06681 51333.40487 18960.70492 11537.6261 45747.17102 65176.29165 32969.51048 20074.65831 58345.45027 55605.56239 plasmenyl-PE 40:3; [M+H]+@8.14 904510.5147 708303.0375 68902.08726 339672.2266 432357.634 857683.2462 390942.1839 219442.2264 254007.5171 237603.6094 43643.43103 58213.76815 197649.9655 214122.7987 56240.88468 32836.35103 205783.9893 194062.8794 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name moverz_quant ri ri_type pubchem_id inchi_key kegg_id other_id other_id_type CE(16:0); [M+NH4]+@10.96 10.96 246520 LMST01020005 LipidMaps CE(16:1); [M+NH4]+@10.68 10.68 CE(16:1) LipidMaps Bulk ID CE(17:1); [M+NH4]+@10.77 10.77 24779603 LMST01020023 LipidMaps CE(18:0); [M+NH4]+@11.33 11.33 118246 LMST01020007 LipidMaps CE(18:1); [M+NH4]+@10.89 10.89 5283632 LMST01020003 LipidMaps CE(18:2); [M+NH4]+@10.75 10.75 5287939 LMST01020008 LipidMaps CE(20:1); [M+NH4]+@11.27 11.27 16061337 LMST01020011 LipidMaps CE(20:2); [M+NH4]+@10.98 10.98 16061338 LMST01020012 LipidMaps CE(20:3); [M+NH4]+@10.80 10.8 14274976 LMST01020013 LipidMaps CE(22:1); [M+NH4]+@11.62 11.62 16219158 LMST01020025 LipidMaps CE(22:2); [M+NH4]+@11.32 11.32 16061340 LMST01020017 LipidMaps CE(22:4); [M+NH4]+@10.86 10.86 16061341 LMST01020018 LipidMaps CE(22:5); [M+NH4]+@10.69 10.69 42608400 LMST01020031 LipidMaps CE(22:6); [M+NH4]+@10.48 10.48 14274978 LMST01020019 LipidMaps CE(24:1); [M+NH4]+@11.93 11.93 16061342 LMST01020020 LipidMaps DG 28:0; [M+NH4]+@6.77 6.77 DG(28:0) LipidMaps Bulk ID DG 28:1; [M+NH4]+@6.26 6.26 56936297 LMGL02010322 LipidMaps DG 29:0; [M+NH4]+@7.01 7.01 DG(29:0) LipidMaps Bulk ID DG 29:1; [M+NH4]+@6.51 6.51 DG(29:1) LipidMaps Bulk ID DG 30:0; [M+NH4]+@7.34 7.34 DG(30:0) LipidMaps Bulk ID DG 30:1; [M+NH4]+@6.85 6.85 DG(30:1) LipidMaps Bulk ID DG 30:2; [M+NH4]+@6.42 6.42 DG(30:2) LipidMaps Bulk ID DG 31:0; [M+NH4]+@7.52 7.52 DG(31:0) LipidMaps Bulk ID DG 31:1; [M+NH4]+@7.10 7.1 DG(31:1) LipidMaps Bulk ID DG 32:0; [M+NH4]+@7.85 7.85 DG(32:0) LipidMaps Bulk ID DG 32:1; [M+NH4]+@7.44 7.44 DG(32:1) LipidMaps Bulk ID DG 32:2; [M+NH4]+@7.05 7.05 DG(32:2) LipidMaps Bulk ID DG 33:0; [M+NH4]+@8.04 8.04 DG(33:0) LipidMaps Bulk ID DG 33:1; [M+NH4]+@7.67 7.67 DG(33:1) LipidMaps Bulk ID DG 33:2; [M+NH4]+@7.30 7.3 DG(33:2) LipidMaps Bulk ID DG 33:3; [M+NH4]+@6.93 6.93 DG(33:3) LipidMaps Bulk ID DG 34:0; [M+NH4]+@8.38 8.38 DG(34:0) LipidMaps Bulk ID DG 34:2; [M+NH4]+@7.58 7.58 DG(34:2) LipidMaps Bulk ID DG 34:3; [M+NH4]+@7.18 7.18 DG(34:3) LipidMaps Bulk ID DG 34:4; [M+NH4]+@6.86 6.86 DG(34:4) LipidMaps Bulk ID DG 35:0; [M+NH4]+@8.56 8.56 DG(35:0) LipidMaps Bulk ID DG 35:1; [M+NH4]+@8.15 8.15 DG(35:1) LipidMaps Bulk ID DG 35:2; [M+NH4]+@7.85 7.85 DG(35:2) LipidMaps Bulk ID DG 35:3; [M+NH4]+@7.49 7.49 DG(35:3) LipidMaps Bulk ID DG 36:0; [M+NH4]+@8.87 8.87 DG(36:0) LipidMaps Bulk ID DG 36:1; [M+NH4]+@8.43 8.43 DG(36:1) LipidMaps Bulk ID DG 36:2; [M+NH4]+@8.05 8.05 DG(36:2) LipidMaps Bulk ID DG 36:3; [M+NH4]+@7.75 7.75 DG(36:3) LipidMaps Bulk ID DG 36:4; [M+NH4]+@7.45 7.45 DG(36:4) LipidMaps Bulk ID DG 36:5; [M+NH4]+@7.05 7.05 DG(36:5) LipidMaps Bulk ID DG 36:6; [M+NH4]+@6.88 6.88 DG(36:6) LipidMaps Bulk ID DG 37:1; [M+NH4]+@8.61 8.61 DG(37:1) LipidMaps Bulk ID DG 37:3; [M+NH4]+@8.15 8.15 DG(37:3) LipidMaps Bulk ID DG 37:4; [M+NH4]+@7.80 7.8 DG(37:4) LipidMaps Bulk ID DG 37:6; [M+NH4]+@7.15 7.15 DG(37:6) LipidMaps Bulk ID DG 38:0; [M+NH4]+@9.28 9.28 DG(38:0) LipidMaps Bulk ID DG 38:1; [M+NH4]+@8.88 8.88 DG(38:1) LipidMaps Bulk ID DG 38:2; [M+NH4]+@8.50 8.5 DG(38:2) LipidMaps Bulk ID DG 38:3; [M+NH4]+@8.27 8.27 DG(38:3) LipidMaps Bulk ID DG 38:4; [M+NH4]+@7.95 7.95 DG(38:4) LipidMaps Bulk ID DG 38:5; [M+NH4]+@7.63 7.63 DG(38:5) LipidMaps Bulk ID DG 38:6; [M+NH4]+@7.42 7.42 DG(38:6) LipidMaps Bulk ID DG 38:7; [M+NH4]+@7.02 7.02 DG(38:7) LipidMaps Bulk ID DG 39:3; [M+NH4]+@8.57 8.57 DG(39:3) LipidMaps Bulk ID DG 39:6; [M+NH4]+@7.62 7.62 DG(39:6) LipidMaps Bulk ID DG 39:7; [M+NH4]+@7.28 7.28 DG(39:7) LipidMaps Bulk ID DG 40:0; [M+NH4]+@9.62 9.62 DG(40:0) LipidMaps Bulk ID DG 40:1; [M+NH4]+@9.28 9.28 DG(40:1) LipidMaps Bulk ID DG 40:2; [M+NH4]+@8.94 8.94 DG(40:2) LipidMaps Bulk ID DG 40:3; [M+NH4]+@8.62 8.62 DG(40:3) LipidMaps Bulk ID DG 40:4; [M+NH4]+@8.45 8.45 DG(40:4) LipidMaps Bulk ID DG 40:5; [M+NH4]+@8.09 8.09 DG(40:5) LipidMaps Bulk ID DG 40:6; [M+NH4]+@7.92 7.92 DG(40:6) LipidMaps Bulk ID DG 40:7; [M+NH4]+@7.55 7.55 DG(40:7) LipidMaps Bulk ID DG 40:8; [M+NH4]+@7.17 7.17 DG(40:8) LipidMaps Bulk ID DG 41:1; [M+NH4]+@9.45 9.45 DG(41:1) LipidMaps Bulk ID DG 41:6; [M+NH4]+@8.06 8.06 DG(41:6) LipidMaps Bulk ID DG 42:1; [M+NH4]+@9.63 9.63 DG(42:1) LipidMaps Bulk ID DG 42:2; [M+NH4]+@9.33 9.33 DG(42:2) LipidMaps Bulk ID DG 42:5; [M+NH4]+@8.49 8.49 DG(42:5) LipidMaps Bulk ID DG 42:8; [M+NH4]+@7.72 7.72 DG(42:8) LipidMaps Bulk ID DG 42:9; [M+NH4]+@7.47 7.47 DG(42:9) LipidMaps Bulk ID DG 44:1; [M+NH4]+@9.97 9.97 9543930 LMGL02010265 LipidMaps DG 44:2; [M+NH4]+@9.64 9.64 DG(44:2) LipidMaps Bulk ID DG 44:3; [M+NH4]+@9.37 9.37 DG(44:3) LipidMaps Bulk ID MG 17:0; [M+Li]+@3.21 3.21 107036 LMGL01010002 LipidMaps MG 18:1; [M+NH4]+@2.98 2.98 MG(18:1) LipidMaps Bulk ID MG 20:2; [M+NH4]+@3.14 3.14 MG 20:2 LipidBLAST PC 32:0; [M+H]+@6.46 6.46 PC(32:0) LipidMaps Bulk ID PC 32:4; [M+H]+@5.13 5.13 PC(32:4) LipidMaps Bulk ID PC 34:6; [M+H]+@5.34 5.34 PC(34:6) LipidMaps Bulk ID PC 35:5; [M+H]+@5.48 5.48 PC(35:5) LipidMaps Bulk ID PC 36:2; [M+H]+@6.84 6.84 PC(36:2) LipidMaps Bulk ID PC 36:3; [M+H]+@7.13 7.13 PC(36:3) LipidMaps Bulk ID PC 38:6; [M+H]+@6.33 6.33 PC(38:6) LipidMaps Bulk ID PC 40:8; [M+H]+@6.32 6.32 PC(40:8) LipidMaps Bulk ID PC 42:10; [M+H]+@5.70 5.7 PC(42:10) LipidMaps Bulk ID PC 44:4; [M+H]+@8.24 8.24 PC(44:4) LipidMaps Bulk ID PC 44:6; [M+H]+@7.53 7.53 PC(44:6) LipidMaps Bulk ID PC 46:4; [M+H]+@8.66 8.66 PC 46:4 LipidBLAST PE 30:1; [M+H]+@5.54 5.54 PE(30:1) LipidMaps Bulk ID PE 32:2; [M+H]+@5.67 5.67 PE(32:2) LipidMaps Bulk ID PE 33:2; [M+H]+@6.01 6.01 PE(33:2) LipidMaps Bulk ID PE 34:2; [M+H]+@6.32 6.32 PE(34:2) LipidMaps Bulk ID PE 35:2; [M+H]+@6.65 6.65 PE(35:2) LipidMaps Bulk ID PE 36:1; [M+H]+@7.40 7.4 PE(36:1) LipidMaps Bulk ID PE 36:2; [M+H]+@6.93 6.93 PE(36:2) LipidMaps Bulk ID PE 36:4; [M+H]+@6.29 6.29 PE(36:4) LipidMaps Bulk ID PE 36:5; [M+H]+@5.86 5.86 PE(36:5) LipidMaps Bulk ID PE 36:6; [M+H]+@5.48 5.48 PE(36:6) LipidMaps Bulk ID PE 37:2; [M+H]+@7.33 7.33 PE(37:2) LipidMaps Bulk ID PE 38:2; [M+H]+@7.46 7.46 PE(38:2) LipidMaps Bulk ID PE 38:3; [M+H]+@7.27 7.27 PE(38:3) LipidMaps Bulk ID PE 38:4; [M+H]+@6.86 6.86 PE(38:4) LipidMaps Bulk ID PE 38:5; [M+H]+@6.44 6.44 PE(38:5) LipidMaps Bulk ID PE 38:6; [M+H]+@6.23 6.23 PE(38:6) LipidMaps Bulk ID PE 38:7; [M+H]+@5.72 5.72 PE(38:7) LipidMaps Bulk ID PE 39:3; [M+H]+@7.52 7.52 PE(39:3) LipidMaps Bulk ID PE 40:2; [M+H]+@7.94 7.94 PE(40:2) LipidMaps Bulk ID PE 40:5; [M+H]+@7.07 7.07 PE(40:5) LipidMaps Bulk ID PE 40:7; [M+H]+@6.34 6.34 PE(40:7) LipidMaps Bulk ID PE 40:8; [M+H]+@5.96 5.96 PE(40:8) LipidMaps Bulk ID PE 42:1; [M+H]+@8.80 8.8 PE(42:1) LipidMaps Bulk ID PE 42:2; [M+H]+@8.37 8.37 PE(42:2) LipidMaps Bulk ID PE 42:5; [M+H]+@7.58 7.58 PE(42:5) LipidMaps Bulk ID PE 42:6; [M+H]+@7.21 7.21 PE(42:6) LipidMaps Bulk ID PE 42:7; [M+H]+@6.90 6.9 PE(42:7) LipidMaps Bulk ID PE 44:4; [M+H]+@8.51 8.51 PE(44:4) LipidMaps Bulk ID PE 44:5; [M+H]+@8.04 8.04 PE(44:5) LipidMaps Bulk ID SM 30:0; [M]+@4.63 4.63 46891775 SM 31:0; [M]+@5.02 5.02 SM 31:0 LipidBLAST SM 31:1; [M]+@4.75 4.75 SM 31:1 LipidBLAST SM 32:0; [M+Na]+@5.37 5.37 44260138 SM 32:1; [M+Na]+@5.06 5.06 11433862 SM 32:2; [M]+@4.53 4.53 SM 32:2 LipidBLAST SM 33:1; [M]+@5.38 5.38 52931139 SM 33:2; [M]+@4.98 4.98 SM 33:2 LipidBLAST SM 34:1; [M]+@5.79 5.79 SM 34:1 LipidBLAST SM 34:2; [M]+@5.32 5.32 SM 34:2 LipidBLAST SM 35:0; [M]+@6.32 6.32 SM 35:0 LipidBLAST SM 35:2; [M]+@5.63 5.63 SM 35:2 LipidBLAST SM 36:2; [M]+@6.21 6.21 SM 36:2 LipidBLAST SM 37:0; [M]+@6.91 6.91 SM 37:0 LipidBLAST SM 37:1; [M]+@6.70 6.7 SM 37:1 LipidBLAST SM 37:2; [M]+@6.32 6.32 SM 37:2 LipidBLAST SM 38:0; [M]+@7.38 7.38 44260131 SM 38:1; [M]+@7.00 7 SM 38:1 LipidBLAST SM 38:2; [M]+@6.41 6.41 SM 38:2 LipidBLAST SM 39:2; [M]+@6.97 6.97 SM 39:2 LipidBLAST SM 40:1; [M+Na]+@7.65 7.65 SM 40:1 LipidBLAST SM 40:2; [M]+@6.96 6.96 SM 40:2 LipidBLAST SM 41:0; [M]+@8.15 8.15 SM 41:0 LipidBLAST SM 41:1; [M]+@7.83 7.83 SM 41:1 LipidBLAST SM 41:2; [M]+@7.38 7.38 SM 41:2 LipidBLAST SM 42:1; [M+Na]+@8.04 8.04 44260133 SM 42:1; [M]+@7.88 7.88 44260133 SM 42:2; [M]+@7.65 7.65 SM 42:2 LipidBLAST SM 42:4; [M]+@6.28 6.28 SM 42:4 LipidBLAST SM 43:1; [M]+@8.33 8.33 SM 43:1 LipidBLAST SM 43:2; [M]+@7.97 7.97 SM 43:2 LipidBLAST SM 44:0; [M]+@8.80 8.8 44260136 SM 44:1; [M]+@8.47 8.47 SM 44:1 LipidBLAST SM 44:2; [M]+@8.32 8.32 SM 44:2 LipidBLAST SM 45:2; [M]+@8.35 8.35 SM 45:2 LipidBLAST TG 40:0; [M+NH4]+@9.47 9.47 TG(40:0) LipidMaps Bulk ID TG 42:0; [M+NH4]+@9.78 9.78 TG(42:0) LipidMaps Bulk ID TG 42:1; [M+NH4]+@9.53 9.53 TG(42:1) LipidMaps Bulk ID TG 44:1; [M+NH4]+@9.81 9.81 TG(44:1) LipidMaps Bulk ID TG 44:2; [M+NH4]+@9.57 9.57 TG(44:2) LipidMaps Bulk ID TG 46:0; [M+NH4]+@10.31 10.31 TG(46:0) LipidMaps Bulk ID TG 46:1; [M+NH4]+@10.05 10.05 TG(46:1) LipidMaps Bulk ID TG 46:2; [M+NH4]+@9.81 9.81 TG(46:2) LipidMaps Bulk ID TG 46:3; [M+NH4]+@9.63 9.63 TG(46:3) LipidMaps Bulk ID TG 48:0; [M+NH4]+@10.55 10.55 TG(48:0) LipidMaps Bulk ID TG 48:1; [M+NH4]+@10.31 10.31 TG(48:1) LipidMaps Bulk ID TG 48:2; [M+NH4]+@10.09 10.09 TG(48:2) LipidMaps Bulk ID TG 48:3; [M+NH4]+@9.86 9.86 TG(48:3) LipidMaps Bulk ID TG 49:0; [M+NH4]+@10.66 10.66 TG(49:0) LipidMaps Bulk ID TG 49:1; [M+NH4]+@10.45 10.45 TG(49:1) LipidMaps Bulk ID TG 49:2; [M+NH4]+@10.26 10.26 TG(49:2) LipidMaps Bulk ID TG 49:3; [M+NH4]+@10.05 10.05 TG(49:3) LipidMaps Bulk ID TG 50:1; [M+NH4]+@10.56 10.56 TG(50:1) LipidMaps Bulk ID TG 50:2; [M+NH4]+@10.32 10.32 TG(50:2) LipidMaps Bulk ID TG 50:3; [M+NH4]+@10.14 10.14 TG(50:3) LipidMaps Bulk ID TG 50:4; [M+NH4]+@9.95 9.95 TG(50:4) LipidMaps Bulk ID TG 51:1; [M+NH4]+@10.71 10.71 TG(51:1) LipidMaps Bulk ID TG 51:2; [M+NH4]+@10.49 10.49 TG(51:2) LipidMaps Bulk ID TG 51:3; [M+NH4]+@10.31 10.31 TG(51:3) LipidMaps Bulk ID TG 51:4; [M+NH4]+@10.11 10.11 TG(51:4) LipidMaps Bulk ID TG 52:0; [M+NH4]+@11.04 11.04 TG(52:0) LipidMaps Bulk ID TG 52:1; [M+NH4]+@10.81 10.81 TG(52:1) LipidMaps Bulk ID TG 52:3; [M+NH4]+@10.38 10.38 TG(52:3) LipidMaps Bulk ID TG 52:4; [M+NH4]+@10.20 10.2 TG(52:4) LipidMaps Bulk ID TG 52:5; [M+NH4]+@10.01 10.01 TG(52:5) LipidMaps Bulk ID TG 52:6; [M+NH4]+@9.83 9.83 TG(52:6) LipidMaps Bulk ID TG 53:0; [M+NH4]+@11.16 11.16 TG(53:0) LipidMaps Bulk ID TG 53:1; [M+NH4]+@10.92 10.92 TG(53:1) LipidMaps Bulk ID TG 53:2; [M+NH4]+@10.73 10.73 TG(53:2) LipidMaps Bulk ID TG 53:3; [M+NH4]+@10.53 10.53 TG(53:3) LipidMaps Bulk ID TG 53:4; [M+NH4]+@10.36 10.36 TG(53:4) LipidMaps Bulk ID TG 53:5; [M+NH4]+@10.16 10.16 TG(53:5) LipidMaps Bulk ID TG 54:0; [M+NH4]+@11.28 11.28 TG(54:0) LipidMaps Bulk ID TG 54:1; [M+NH4]+@11.05 11.05 TG(54:1) LipidMaps Bulk ID TG 54:2; [M+NH4]+@10.83 10.83 TG(54:2) LipidMaps Bulk ID TG 54:3; [M+NH4]+@10.62 10.62 TG(54:3) LipidMaps Bulk ID TG 54:4; [M+NH4]+@10.44 10.44 TG(54:4) LipidMaps Bulk ID TG 54:5; [M+NH4]+@10.28 10.28 TG(54:5) LipidMaps Bulk ID TG 54:6; [M+NH4]+@10.10 10.1 TG(54:6) LipidMaps Bulk ID TG 54:7; [M+NH4]+@10.00 10 TG(54:7) LipidMaps Bulk ID TG 54:8; [M+NH4]+@9.71 9.71 TG(54:8) LipidMaps Bulk ID TG 55:1; [M+NH4]+@11.12 11.12 TG(55:1) LipidMaps Bulk ID TG 55:2; [M+NH4]+@10.93 10.93 TG(55:2) LipidMaps Bulk ID TG 55:3; [M+NH4]+@10.75 10.75 TG(55:3) LipidMaps Bulk ID TG 55:4; [M+NH4]+@10.61 10.61 TG(55:4) LipidMaps Bulk ID TG 55:5; [M+NH4]+@10.47 10.47 TG(55:5) LipidMaps Bulk ID TG 56:1; [M+NH4]+@11.29 11.29 TG(56:1) LipidMaps Bulk ID TG 56:2; [M+NH4]+@11.07 11.07 TG(56:2) LipidMaps Bulk ID TG 56:3; [M+NH4]+@10.87 10.87 TG(56:3) LipidMaps Bulk ID TG 56:4; [M+NH4]+@10.68 10.68 TG(56:4) LipidMaps Bulk ID TG 56:5; [M+NH4]+@10.53 10.53 TG(56:5) LipidMaps Bulk ID TG 56:6; [M+NH4]+@10.41 10.41 TG(56:6) LipidMaps Bulk ID TG 56:7; [M+NH4]+@10.28 10.28 TG(56:7) LipidMaps Bulk ID TG 56:8; [M+NH4]+@10.09 10.09 TG(56:8) LipidMaps Bulk ID TG 56:9; [M+NH4]+@9.83 9.83 TG(56:9) LipidMaps Bulk ID TG 57:7; [M+NH4]+@10.38 10.38 TG(57:7) LipidMaps Bulk ID TG 57:8; [M+NH4]+@10.23 10.23 TG(57:8) LipidMaps Bulk ID TG 58:1; [M+NH4]+@11.57 11.57 TG(58:1) LipidMaps Bulk ID TG 58:10; [M+NH4]+@10.00 10 TG(58:10) LipidMaps Bulk ID TG 58:11; [M+NH4]+@9.80 9.8 TG(58:11) LipidMaps Bulk ID TG 58:2; [M+NH4]+@11.31 11.31 TG(58:2) LipidMaps Bulk ID TG 58:3; [M+NH4]+@11.08 11.08 TG(58:3) LipidMaps Bulk ID TG 58:4; [M+NH4]+@10.92 10.92 TG(58:4) LipidMaps Bulk ID TG 58:5; [M+NH4]+@10.74 10.74 TG(58:5) LipidMaps Bulk ID TG 58:6; [M+NH4]+@10.58 10.58 TG(58:6) LipidMaps Bulk ID TG 58:7; [M+NH4]+@10.52 10.52 TG(58:7) LipidMaps Bulk ID TG 58:8; [M+NH4]+@10.31 10.31 TG(58:8) LipidMaps Bulk ID TG 58:9; [M+NH4]+@10.19 10.19 TG(58:9) LipidMaps Bulk ID TG 60:10; [M+NH4]+@10.28 10.28 TG(60:10) LipidMaps Bulk ID TG 60:11; [M+NH4]+@10.14 10.14 TG(60:11) LipidMaps Bulk ID TG 60:3; [M+NH4]+@11.29 11.29 TG(60:3) LipidMaps Bulk ID TG 60:4; [M+NH4]+@11.12 11.12 TG(60:4) LipidMaps Bulk ID TG 60:5; [M+NH4]+@10.97 10.97 TG(60:5) LipidMaps Bulk ID TG 60:6; [M+NH4]+@10.79 10.79 TG(60:6) LipidMaps Bulk ID TG 60:8; [M+NH4]+@10.50 10.5 TG(60:8) LipidMaps Bulk ID TG 62:12; [M+NH4]+@10.22 10.22 TG(62:12) LipidMaps Bulk ID lysoPC 16:0; [M+H]+@1.61 1.61 LPC(16:0) LipidMaps Bulk ID lysoPC 16:1; [M+H]+@1.28 1.28 LPC(16:1) LipidMaps Bulk ID lysoPC 17:1; [M+H]+@1.46 1.46 LPC(17:1) LipidMaps Bulk ID lysoPC 18:0; [M+H]+@2.39 2.39 LPC(18:0) LipidMaps Bulk ID lysoPC 18:1; [M+H]+@1.79 1.79 LPC(18:1) LipidMaps Bulk ID lysoPC 18:2; [M+H]+@1.37 1.37 LPC(18:2) LipidMaps Bulk ID lysoPC 19:0; [M+H]+@2.60 2.6 24779472 LMGP01050041 LipidMaps lysoPC 20:1; [M+H]+@2.52 2.52 LPC(20:1) LipidMaps Bulk ID lysoPC 20:2; [M+H]+@1.96 1.96 52924053 LMGP01050132 LipidMaps lysoPC 22:6; [M+H]+@1.26 1.26 10415542 LMGP01050056 LipidMaps lysoPC 24:1; [M+H]+@4.25 4.25 53480477 LMGP01050144 LipidMaps lysoPE 18:2; [M+H]+@1.34 1.34 LPE(18:2) LipidMaps Bulk ID plasmenyl-PC 18:0; [M+Na]+@1.65 1.65 PC(P-18:0) LipidMaps Bulk ID plasmenyl-PE 32:0; [M+H]+@7.05 7.05 PE(P-32:0) LipidMaps Bulk ID plasmenyl-PE 36:0; [M+H]+@8.10 8.1 PE(P-36:0) LipidMaps Bulk ID plasmenyl-PE 36:3; [M+H]+@7.07 7.07 PE(P-36:3) LipidMaps Bulk ID plasmenyl-PE 38:3; [M+H]+@7.62 7.62 PE(P-38:3) LipidMaps Bulk ID plasmenyl-PE 38:6; [M+H]+@6.53 6.53 PE(P-38:6) LipidMaps Bulk ID plasmenyl-PE 40:3; [M+H]+@8.14 8.14 PE(P-40:3) LipidMaps Bulk ID METABOLITES_END #END