#METABOLOMICS WORKBENCH araskind_20170605_134841 DATATRACK_ID:961 STUDY_ID:ST000679 ANALYSIS_ID:AN001044 PROJECT_ID:PR000480 VERSION 1 CREATED_ON June 30, 2017, 11:09 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) - part II 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 8 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 SU0016279 S00026052 Construct:Vector-25-9-16 SUBJECT_SAMPLE_FACTORS SU0016279 S00026053 Construct:Vector-25-9-16 SUBJECT_SAMPLE_FACTORS SU0016279 S00026054 Construct:Vector-25-9-16 SUBJECT_SAMPLE_FACTORS SU0016279 S00026055 Construct:PNPLA3(WT) SUBJECT_SAMPLE_FACTORS SU0016279 S00026056 Construct:PNPLA3(WT) SUBJECT_SAMPLE_FACTORS SU0016279 S00026057 Construct:PNPLA3(WT) SUBJECT_SAMPLE_FACTORS SU0016279 S00026058 Construct:PNPLA3(I148M) SUBJECT_SAMPLE_FACTORS SU0016279 S00026059 Construct:PNPLA3(I148M) SUBJECT_SAMPLE_FACTORS SU0016279 S00026060 Construct:PNPLA3(I148M) SUBJECT_SAMPLE_FACTORS SU0016279 S00026061 Construct:GCKR_52621 SUBJECT_SAMPLE_FACTORS SU0016279 S00026062 Construct:GCKR_52621 SUBJECT_SAMPLE_FACTORS SU0016279 S00026063 Construct:GCKR_52621 SUBJECT_SAMPLE_FACTORS SU0016279 S00026064 Construct:NT-25-9-16 SUBJECT_SAMPLE_FACTORS SU0016279 S00026065 Construct:NT-25-9-16 SUBJECT_SAMPLE_FACTORS SU0016279 S00026066 Construct:NT-25-9-16 SUBJECT_SAMPLE_FACTORS SU0016279 S00026067 Construct:PPP1R3B_2640-25-9-16 SUBJECT_SAMPLE_FACTORS SU0016279 S00026068 Construct:PPP1R3B_2640-25-9-16 SUBJECT_SAMPLE_FACTORS SU0016279 S00026069 Construct:PPP1R3B_2640-25-9-16 SUBJECT_SAMPLE_FACTORS SU0016279 S00026070 Construct:PNPLA3_50053 SUBJECT_SAMPLE_FACTORS SU0016279 S00026071 Construct:PNPLA3_50053 SUBJECT_SAMPLE_FACTORS SU0016279 S00026072 Construct:PNPLA3_50053 SUBJECT_SAMPLE_FACTORS SU0016279 S00026073 Construct:TM6SF2_382426 SUBJECT_SAMPLE_FACTORS SU0016279 S00026074 Construct:TM6SF2_382426 SUBJECT_SAMPLE_FACTORS SU0016279 S00026075 Construct:TM6SF2_382426 #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 NEGATIVE #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS peak area normalized MS_METABOLITE_DATA_START Samples S00026052 S00026053 S00026054 S00026055 S00026056 S00026057 S00026058 S00026059 S00026060 S00026061 S00026062 S00026063 S00026064 S00026065 S00026066 S00026067 S00026068 S00026069 S00026070 S00026071 S00026072 S00026073 S00026074 S00026075 Factors Construct:Vector-25-9-16 Construct:Vector-25-9-16 Construct:Vector-25-9-16 Construct:PNPLA3(WT) Construct:PNPLA3(WT) Construct:PNPLA3(WT) Construct:PNPLA3(I148M) Construct:PNPLA3(I148M) Construct:PNPLA3(I148M) Construct:GCKR_52621 Construct:GCKR_52621 Construct:GCKR_52621 Construct:NT-25-9-16 Construct:NT-25-9-16 Construct:NT-25-9-16 Construct:PPP1R3B_2640-25-9-16 Construct:PPP1R3B_2640-25-9-16 Construct:PPP1R3B_2640-25-9-16 Construct:PNPLA3_50053 Construct:PNPLA3_50053 Construct:PNPLA3_50053 Construct:TM6SF2_382426 Construct:TM6SF2_382426 Construct:TM6SF2_382426 CL 64:4; [M-2H](2-)@8.72 3691.091303 8765.895926 67.81346765 27974.70783 20822.53166 13514.23313 13287.07876 9049.418627 7959.705576 2740.503193 113.1961687 972.6824929 10792.82797 3555.738333 4780.27858 9174.084348 2352.130819 2773.85665 1354.928721 2466.994554 5564.709262 8678.367031 3105.891727 612.5990024 CL 66:3; [M-2H](2-)@6.03 674881.2249 1175910.565 688317.7621 433677.568 422826.3334 413158.706 259573.4909 186526.9484 216569.0777 147794.2273 247953.7949 230186.4923 187086.4518 61115.05385 236625.8933 265442.9341 102867.4592 207090.3688 227393.1305 233067.8317 537138.8188 460364.3847 291299.3395 104409.7056 CL 66:4; [M-2H](2-)@9.00 35373.58297 52602.09985 36353.10043 61645.51106 42135.01363 80413.8334 53828.52465 36646.03153 37245.87575 13837.97654 8614.266355 7918.530608 62318.10886 31322.65571 63386.5429 39605.35776 15253.55235 10724.14277 15518.31279 25835.16446 37399.61528 75407.28133 42305.2292 24722.41613 CL 66:5; [M-2H](2-)@5.47 35280.19041 140835.2714 59222.08143 21986.27679 16583.24001 24089.03653 8806.203187 15768.2449 20901.62321 19826.91324 24265.42008 16125.39886 20600.57906 11166.96904 15022.51483 17850.52985 9733.018879 20655.10115 22913.233 16509.65262 41374.6972 54809.51009 32635.99894 18011.56622 CL 68:2; [M-2H](2-)@9.63 8821.952805 25828.1527 15109.92206 28072.24119 12633.61806 50879.33919 14374.52225 24458.68507 20452.53352 14269.84889 11660.33985 12808.82823 41370.66132 25605.4478 23370.86508 51927.61979 18796.61166 32906.95988 19808.55904 21309.38552 23272.02651 85268.78911 41841.01679 15383.93517 CL 68:3; [M-2H](2-)@9.45 16161.40192 100062.2506 23935.72998 14400.24878 25473.69516 45331.34215 14396.38305 32852.81452 33687.53737 22767.42255 16196.35293 14170.33881 69348.40154 39812.73472 56488.65649 34833.69578 17511.22773 38069.63196 24108.04425 28968.46892 52844.15477 129470.3521 40687.4108 27169.57481 CL 68:4; [M-2H](2-)@9.26 75222.36458 218424.7815 90925.92694 93691.95071 51911.52717 116169.3843 37291.97416 23674.90357 56781.82759 62695.13415 92835.66471 69325.6017 343831.4299 122888.4877 72663.95541 179702.5813 38852.17288 41058.78029 92567.58293 95678.2912 209758.8902 229605.9266 116515.2544 35145.72386 CL 68:5; [M-2H](2-)@9.04 9089.328934 54620.7954 29912.69602 111137.2433 74230.63369 97788.32544 60677.93546 65202.10227 39871.83466 17015.46183 19699.32447 9931.002843 40303.22767 21549.80636 88434.08528 34764.24836 13085.94667 18843.65179 23586.06465 21669.33978 65028.09923 74594.53835 29811.86701 22011.23754 CL 70:2; [M-2H](2-)@5.95 54828.76158 287154.0096 121857.9374 37779.19306 129963.8652 45572.49437 63817.33512 35670.11249 33482.17413 19809.85057 23127.52778 11817.39518 35157.55223 13118.93317 67484.09066 117333.8075 26044.43561 26525.03233 23906.31683 24249.80605 53136.10566 137105.1174 43675.7297 18556.61076 CL 70:3; [M-2H](2-)@9.68 35860.7393 133394.0972 54460.15166 60061.97203 56226.17171 59052.10337 25788.68557 55597.02414 49979.15625 37397.1897 40465.38033 38169.5108 118855.6172 82872.11711 63134.45903 97041.61122 33327.63071 58124.6341 58097.69024 57830.70243 93450.0422 244035.924 70228.55348 53648.62807 CL 70:4; [M-2H](2-)@9.49 66498.40238 207328.3417 84549.13769 48018.64759 36643.30759 84266.30905 22641.76899 71115.90828 38017.51512 54010.58187 63322.82601 36182.27874 140250.1431 110273.213 107791.4402 97032.35579 59423.80694 74776.28676 80099.20326 82092.29167 133034.0908 303474.7573 111202.2129 81545.73376 CL 70:5; [M-2H](2-)@6.14 2740948.53 8990724.377 5842802.138 1845780.908 1734973.629 1907322.37 1233515.758 700100.1242 1362498.113 1422297.022 2678689.569 2267510.335 3445539.165 1006648.042 1943660.594 3737032.834 1138367.045 2129066.198 2519220.413 1068814.487 4602752.695 5807909.308 3640473.985 1160611.856 CL 70:5; [M-2H](2-)@9.32 13130.05921 72123.68138 23074.55704 43703.38839 34055.8282 94736.30055 28277.81173 39213.07021 44585.81253 34802.19554 38911.56217 25818.38319 99321.24164 60644.96273 45478.72548 58977.54435 16422.71833 18710.63131 56713.07744 47732.76749 60517.45839 152164.4969 46960.81455 20099.75717 CL 70:7; [M-2H](2-)@5.87 95655.22975 422599.2021 184553.0628 170375.4551 153843.5965 194485.5041 90426.81849 85950.7589 131580.6492 64360.02407 75033.44229 65523.84982 147227.6186 57853.84028 129961.3293 109680.2439 43858.01861 87592.10451 90041.61751 60489.33339 168599.177 279398.5975 158378.9996 56085.24702 CL 72:3; [M-2H](2-)@7.55 31244.79346 31859.71543 15891.24058 12875.30902 11127.8702 10684.25745 13879.02378 13559.73718 17499.80311 13868.26199 20516.60983 11840.03802 14917.60105 5528.882008 9387.327865 26289.5884 13429.83904 25537.44458 15531.31253 11745.14273 18593.66624 28535.16698 24310.94987 15870.1912 CL 72:4; [M-2H](2-)@9.70 51407.64063 89405.46134 51761.20598 44422.48262 41753.77516 68815.64336 31828.54857 51056.43351 65635.01977 40190.83802 52238.93994 36227.86944 71911.44903 65329.8618 60446.14802 100474.9064 42884.77504 65671.6015 46963.94624 63067.48912 80570.46599 160208.4384 67652.39988 43674.57481 CL 72:5; [M-2H](2-)@9.55 15399.65395 32821.25609 15405.05112 36445.46591 19199.70487 36048.88368 13528.57032 24556.33868 30743.33934 24620.10273 27864.16166 17051.69329 76005.3101 23652.47273 21028.71737 32902.04937 11159.3026 15649.58807 25416.61561 35477.69544 51119.00328 91944.32569 28336.60694 12286.861 CL 72:6; [M-2H](2-)@9.37 13159.89646 22473.49326 13054.29289 54539.88737 97266.87822 69397.54658 64155.08642 44113.27973 12419.90438 10948.03155 13857.16487 11306.54531 19948.26829 7758.844241 17986.67664 15531.3202 5402.914834 9256.359878 13190.313 13341.77307 30071.14858 41296.55606 11202.65808 9875.105644 CL 74:11; [M-2H](2-)@5.63 66024.21183 216210.3164 108567.5379 295683.4636 206371.8044 313887.7314 169216.6912 85996.93336 199557.7421 44625.9869 62190.48915 45871.72453 84464.19747 38882.78226 63604.39486 89696.37399 40475.01002 54861.16413 78720.90809 59348.7197 127551.3325 209430.0215 118751.056 47565.35628 CL 74:3; [M-2H](2-)@6.22 89794.74265 88976.47238 74751.43166 37793.26027 29403.68879 33423.07404 37016.52887 27638.48362 34858.41001 36076.70566 46570.88759 7699.165274 71902.45311 24650.70928 28957.45685 65226.34936 26557.36581 36302.78607 30291.97053 16977.58501 45005.19689 89896.72216 34858.26838 26833.17636 CL 74:6; [M-2H](2-)@9.59 3677.098899 12271.4329 5782.598412 13477.66253 8008.849915 17047.60537 4202.317136 7762.07045 12806.52209 12307.25757 7880.92609 3606.615704 12758.20918 14024.55489 10920.93364 12420.95414 2905.397017 6374.241767 8449.369273 9478.563803 18086.71007 29304.214 11000.79869 5964.870138 CL 78:5; [M-2H](2-)@6.91 4574888.395 10145381.69 4802368.973 3414580.718 3923440.859 4749795.506 2284724.738 3021616.096 3409686.17 2355691.975 2848700.444 2412512.881 5060072.71 2600424.344 4773069.716 4478346.653 2145672.956 2616291.648 3502691.048 3745886.878 5779226.012 10730545.56 4887062.681 2425433.629 CL 80:5; [M-2H](2-)@7.30 479804.4437 916564.4563 557689.7903 125142.0718 115037.0381 150124.1947 44074.33986 62383.50839 59781.13644 174228.9602 324946.6935 168889.7313 546800.3128 336421.7076 504317.7832 436927.6072 251017.8154 272398.0918 357509.2901 167265.4494 654479.7754 1485894.29 724798.4721 289677.6005 CerP 34:0; [M-H]-@6.05 22941.4304 49808.99246 24002.83638 5916.57969 7007.90276 3232.208541 4838.893106 2160.312506 6636.850177 3192.145851 4568.846102 8868.077791 8724.662626 1605.373024 3330.706823 4854.163991 379.0288017 7800.403885 3306.500906 1355.922006 3355.752864 2423.62865 1745.617489 1594.550432 FFA(16:0) 76477708.63 127075569.9 51440320.56 45981414.96 43133757.61 57667994.09 30977889.58 54427992.88 55752202.54 30172512.23 30947151.09 27990797.32 53627961.49 37039480.32 71852920.97 68084626.25 26041177.13 34735462.73 35997575.95 29445265.36 61051161.49 112955763.8 63358797.87 32259540.37 FFA(18:0) 88055090.11 156117749 73836520.22 54542520.15 49074081.34 65274730.06 36850522.42 70040367.5 64401667.11 31772602.78 33167884.94 30850580.44 60566744.23 37763393.56 66415801.37 72884435.38 26856379.92 38430374.38 39005068.02 32156899.97 60373464.89 124134847.1 72884308.76 33503990.35 FFA(18:1) 82342822.74 134681225.9 37935216.12 70479681.94 62124326.43 75653951.66 40692037.82 59681071.15 71740690.27 49083261.53 50574569.35 38861376.46 93345411.41 57722501.81 144754172 107492809.2 48024569.54 76073638.84 69868963.59 45555874.64 107954020.5 182050993.4 97947358.16 60005420.65 FFA(18:2) 7904779.813 14806723.38 3111390.187 2133003.323 1653167.937 2617767.941 1223990.642 1451574.912 1984830.668 6298170.191 5846227.757 3316659.912 8091732.287 5773966.621 16663694.63 8377737.117 3318603.291 5052301.983 8384049.47 3886327.81 13634528.1 18285543.06 10272333.62 5054380.343 FFA(20:0) 6638064.809 10372317.51 4579403.271 3669213.578 2571970.216 3589959.69 2440051.796 1578323.253 3101969.058 3081807.105 3738802.101 3265878.707 5609087.087 2188224.599 1826230.095 6921972.01 1019610.745 808346.4666 2861526.147 2258669.709 6906634.813 5847932.478 4098967.729 599711.409 FFA(20:1) 8113504.739 12437121.5 2747023.187 7330118.286 4435829.305 7558427.701 4177640.516 4906026.965 7212312.302 9122267.547 8980325.932 5187370.675 13430151.88 8574751.043 24886284.12 12752512.3 4848013.473 7136636.731 13705040.44 5395803.539 18964293.24 23885679.65 12000166.92 6374008.076 FFA(20:2) 10977463.34 15574307.43 3558629.089 2752557.808 2181105.474 3170564.245 1831801.202 2270078.293 2685705.022 7795477.179 8341863.532 4617130.931 9989417.037 6311979.079 18681317.69 9833442.059 3849522.82 5532222.832 11439360.84 4765249.14 18070621.12 18473212.83 10131887.09 5640223.972 FFA(20:4) Arachidonic acid 1596705.134 4771751.33 1046000.494 3497863.814 2900002.501 4588974.089 1893297.132 2519086.49 2940957.995 2591633.997 2740668.943 1466294.63 2940539.936 1776597.977 5493702.195 6325730.088 2241836.123 3314270.998 4874802.138 2241484.539 6618635.848 7286359.925 4121778.547 2255608.662 FFA(22:0) 1675437.773 2756356.479 1369725.382 879882.5954 931967.3325 992791.5095 635175.1595 455557.75 807398.0909 810120.6102 865261.9436 885849.3138 1426103.31 648359.031 600324.0032 1854533.939 289442.9179 255951.4882 806656.0193 563154.5852 1811808.543 1663540.579 1054314.275 206057.3117 FFA(22:1) 1352946.585 2595975.657 724110.8364 1105116.884 635372.3507 1152105.577 505643.0541 726805.364 904768.7592 1482776.925 1435769.304 872320.5621 2483318.89 1757857.568 4532723.946 2273708.422 762389.465 1191684.002 2356520.156 979399.3426 3406148.774 3845883.509 2193978.694 1126933.688 FFA(22:2) 1449154.855 2621207.58 572654.7489 418801.5233 247027.2634 450251.9063 216861.7974 255257.3479 316849.1939 1385865.19 1335940.673 753109.0589 1893750.363 1253913.328 3547994.586 1816123.602 651614.1028 1014091.338 1795535.013 744971.8492 2706679.401 3129937.418 1611378.808 833786.7771 FFA(22:3) 5850397.829 9622735.953 2598589.729 456139.9902 341735.5207 568206.2477 329112.3121 417764.9766 441212.5362 6489207.775 6017679.946 3665881.117 5666917.743 3736014.898 11210711.82 6848934.236 2773422.147 4205847.832 6502336.641 2563505.265 9382673.375 9460607.519 5387186.418 3003672.423 FFA(24:0) 340358.7407 1405101.774 705262.229 235876.4631 348470.0093 209853.0767 107496.8645 167231.4316 157168.8693 248243.2205 258451.5537 202344.6501 535104.2072 325957.0593 1178885.626 425552.3527 209936.3242 281163.5888 392729.6717 183603.1803 515144.2582 783584.5812 483545.7533 276846.3834 FFA(24:1) 1680097.368 5342397.897 1770061.706 1218989.809 928184.2728 1387317.958 594553.662 753942.726 952126.3976 2024563.239 2019187.227 1426040.525 3809031.018 2605174.435 6829080.05 3044537.877 1140456.227 1823284.144 3401412.6 1507419.848 4728693.775 5820832.467 3376945.801 1800394.921 FFA(24:2) 530803.5211 1169813.115 289681.1735 186657.927 103789.4214 212268.216 74733.74555 93465.54093 117657.9204 786345.3336 745235.3512 453796.7723 1554375.863 1041814.833 2787308.664 1443560.828 589550.4388 795363.0293 913648.0347 405184.9913 1550477.038 2177495.28 1068728.854 591255.1291 FFA(24:3) 858469.0746 1381369.145 368569.224 291020.0819 184583.0096 340313.5082 116396.034 154896.5065 229370.7329 1133459.602 1031076.857 640160.2072 2228492.374 1408455.42 4105116.917 1555655.978 578957.1158 844301.5788 1547685.743 604278.5104 2112183.916 2339475.652 1243748.31 617112.5786 N-(15Z-tetracosenoyl)-sphing-4-enine; [M-H]-@8.43 303775.9265 785762.8018 426092.8146 330924.9078 420571.0133 404043.9078 218650.0171 100273.4868 252248.5482 294114.436 338809.7356 318237.6434 529960.1724 203391.5499 148890.4726 763768.9903 127182.4859 112767.0947 211870.8638 214025.969 492413.9233 596470.7634 385745.3694 83308.64081 N-(15Z-tetracosenoyl)-sphinganine; [M-H]-@8.65 242516.439 257229.8327 167175.6321 70767.77635 56444.82063 140102.9774 55326.4324 46802.00491 68855.49588 92959.83484 147856.5758 123469.9271 272185.6954 110914.2077 149953.8467 153052.5284 73627.84078 164781.5545 93801.23318 65756.83552 200590.8373 341317.8821 163034.3334 109080.6244 N-(17Z-hexacosenoyl)-sphing-4-enine; [M-H]-@8.92 31241.83081 59915.85192 47539.70382 7104.97795 2329.470823 11710.95894 5516.770634 5861.044483 15123.00601 32837.66664 39879.16135 20875.83221 24075.95426 13155.13137 22466.84198 26436.20292 11512.97744 15087.87846 18149.3653 17814.066 24808.53172 51198.26462 26463.96736 10445.75363 N-(docosanoyl)-sphing-4-enine; [M-H]-@8.48 110793.4241 131943.2866 134875.9201 59818.9897 40906.55566 67590.12598 39889.91466 33180.80697 52497.81509 35323.27969 57152.32066 34244.43331 157163.6452 71075.05878 77216.37539 86922.76623 40322.83796 47277.05238 49539.80383 32551.77706 84382.0772 150728.9121 66198.44219 61553.17265 N-(docosanoyl)-sphinganine; [M-H]-@8.63 61199.78895 80597.10618 56960.22181 69104.35002 145607.1637 97855.3915 121206.3983 32187.64835 44205.20647 12514.53523 14022.98747 6167.340549 22358.05934 11165.59345 38897.62472 61296.40633 11454.53598 13327.87223 13111.01992 11080.05161 12237.65613 54341.85253 31272.31211 8266.080256 N-(eicosanoyl)-sphing-4-enine; [M-H]-@7.99 28459.8482 171489.208 63560.74713 65224.58875 61541.7698 110269.0656 42589.10647 39940.55256 41430.11899 19394.88852 21148.92329 21092.66182 66719.87037 64330.95858 103018.71 69468.05461 23903.72541 48199.95871 30311.7123 20841.3024 41542.4784 97952.81504 73002.11863 37572.80477 N-(eicosanoyl)-sphinganine; [M-H]-@8.16 12923.75363 42035.84385 21455.15597 34186.18515 26425.79009 45860.41163 21904.01175 12106.87343 15083.74863 3843.282644 5316.348601 3588.323556 15289.97672 16117.66864 18136.67182 14967.76187 4977.68451 4748.699177 7466.25551 3725.09557 6310.697506 26438.34112 15874.85712 4672.933029 N-(hexadecanoyl)-sphing-4-enine; [M-H]-@6.82 421913.1256 1414283.251 807780.1547 317333.0091 404860.1921 330651.0871 190748.4342 102188.7801 185856.9368 280624.5193 355703.5191 372294.2338 851726.9491 338946.8401 321007.2944 987655.0146 238640.3736 199094.3793 210932.2501 187125.9467 466961.6056 597460.3576 446584.8957 109319.7793 N-(hexadecanoyl)-sphinganine; [M-H]-@7.08 327176.0749 264706.073 209629.5645 98719.56836 79856.19143 107273.8208 87938.01349 67440.41133 102483.735 57648.33419 89472.41624 57622.32806 134058.3598 68341.6141 87436.10565 75946.67758 39324.74004 72920.27718 56075.23522 43177.8325 77130.11326 154557.3219 99158.24047 59856.51754 N-(octadecanoyl)-sphing-4-enine; [M-H]-@7.45 35876.49124 198974.9859 101189.608 83383.46757 123673.5625 102361.7279 60466.18622 22515.87526 58891.38467 38016.55916 60500.58567 68586.47663 150630.5876 72061.74879 55697.87703 267137.4696 55247.78838 45606.57292 39184.22067 31437.34885 117363.3434 102485.1766 84358.26424 18095.4134 N-(octadecanoyl)-sphinganine; [M-H]-@7.65 15430.45374 61922.16189 17505.98794 42206.15711 37156.28179 59479.94437 32181.59227 23377.00552 25134.94309 5297.526282 6185.696714 3076.14328 20115.05425 14467.12518 13109.69452 21616.53107 8431.999912 21024.34631 6500.364207 7553.40303 10963.02748 36855.85309 16154.25796 8477.545382 N-(tetracosanoyl)-sphing-4-enine; [M-H]-@8.92 242516.439 257229.8327 167175.6321 70767.77635 56444.82063 140102.9774 55326.4324 46802.00491 68855.49588 92959.83484 147856.5758 123469.9271 272185.6954 110914.2077 149953.8467 153052.5284 73627.84078 164781.5545 93801.23318 65756.83552 200590.8373 341317.8821 163034.3334 109080.6244 N-(tetracosanoyl)-sphinganine; [M-H]-@9.07 52770.27788 119261.7212 61259.18267 34761.53068 31462.90427 58326.96041 24483.30555 20341.50581 20889.01669 10632.75298 18633.11484 18378.05466 66377.61493 36021.99374 59662.2205 61623.7427 22794.55219 23701.31457 12371.24418 23952.44513 38570.3436 159578.4351 73341.29852 30073.9645 N-(tetradecanoyl)-sphing-4-enine; [M-H]-@6.22 57034.7734 157506.6902 77604.94349 38101.94687 43763.52385 59564.71212 18251.48988 28647.46485 37049.37839 25483.03955 29582.54907 25052.7025 67018.77458 45128.4351 70414.04191 90243.39736 29396.31283 52941.15392 26734.47101 27105.50282 41531.82584 113136.9183 56855.14587 38260.02068 N-(tetradecanoyl)-sphinganine; [M-H]-@6.45 16626.52653 48120.17773 26182.11885 4964.326332 17196.59675 9572.479642 6314.952 5658.664497 7752.0858 10067.53178 4405.911207 6294.531394 20395.37156 11398.0968 10702.55983 9205.971064 5696.154629 7866.489336 12278.03195 8330.673748 10063.36734 22854.05278 10830.74573 6624.120306 PA 32:1; [M-H]-@6.06 10103.37013 39891.86716 31277.24506 14563.97696 24255.84383 12563.40984 9236.016555 7982.281095 11694.02479 7238.711122 15643.3187 18962.40838 27019.69856 10908.47598 17416.10024 30419.78497 11705.72127 18178.96072 12712.19204 8546.548921 14450.16795 112676.5866 25297.94576 11044.62642 PA 34:1; [M-H]-@5.80 40288.56441 222540.4963 113501.5436 22431.30757 26519.21392 47930.34146 7741.16309 6478.05064 4712.875237 7541.738192 8286.099078 13591.7588 29950.57816 8421.427959 23762.14742 13308.2751 11330.20707 7948.210995 9146.831984 4896.488359 11784.75774 145678.26 8801.008078 10574.55915 PC 26:0; [M-Ac-H]-@4.45 15652.35721 31214.07609 9000.193924 17693.76856 18444.26867 27715.67611 8905.915231 10336.91853 11717.37575 4095.133494 12023.84963 2847.173287 9837.104492 11177.02549 6959.994377 20221.32726 2664.667517 4322.713793 3042.032224 7040.875916 18169.64353 22543.89331 11441.11802 3053.186153 PC 28:0; [M-Ac-H]-@5.18 359086.4811 720858.2293 319684.6423 950329.9846 971800.2718 1315477.144 590962.781 786986.6299 948222.6869 95984.50842 103434.3838 84055.62841 322605.8612 168827.9143 238758.7386 294471.1132 124417.1233 169110.3827 166548.9361 169034.8802 309817.5787 526461.9096 288847.084 115397.4539 PC 29:0; [M-Ac-H]-@5.49 187404.2746 446007.1195 196323.0688 203973.2691 288272.1035 291144.6685 106598.2342 121229.6096 145974.7202 53593.28135 69267.81151 52506.05831 281687.9025 157991.0746 228642.7326 214474.9901 89440.08485 125427.9924 114741.198 103691.0082 164200.056 448756.0479 217857.0428 113367.4199 PC 30:0; [M-Ac-H]-@5.90 1315336.992 3456513.751 1717485.245 2601383.297 3245026.509 3115218.843 1617198.972 2042584.797 2258940.722 484466.0321 581253.1267 514832.1476 1748140.725 984258.8168 1383691.645 2006775.593 700014.5089 1186227.569 870450.9132 776101.7259 1637858.78 3040776.783 1660158.6 769528.9595 PC 30:1; [M-Ac-H]-@5.39 1401833.394 3706955.935 1799257.086 1752477.516 2138382.18 2262622.781 1191778.845 1336464.087 1686757.066 411514.5495 487776.6313 416513.112 1151710.263 711458.3134 1116428.379 1143613.194 466691.6812 725447.7264 656381.1346 580252.2695 1101966.885 2212928.53 1202548.563 536199.9107 PC 30:2; [M-Ac-H]-@4.93 365240.1666 517623.669 373279.4301 98193.46232 64461.06051 85395.10291 70008.46609 66664.37139 78621.81739 83160.88655 156222.3597 74543.66463 181419.8282 66998.36516 52308.24152 69078.35867 49544.27538 76937.42481 73907.69706 97315.34164 156562.171 174386.9489 89948.94352 50563.61418 PC 31:0; [M-Ac-H]-@6.15 705326.3431 1778305.487 1092728.027 570504.5017 715964.2073 560021.4929 248588.3006 118270.27 222121.3112 324366.8314 472856.4833 448605.1352 1796137.258 622437.6751 624958.2799 2085952.437 352485.194 293550.5875 701071.2692 529257.8372 1448201.179 1869121.88 1166436.788 210829.4957 PC 31:1; [M-Ac-H]-@5.67 351689.6603 1023595.878 590270.6993 378693.4468 376796.4233 453508.1684 454366.2567 179462.6044 220919.2863 191550.0425 290679.7338 314318.5517 1246666.788 546325.3861 488076.2447 717882.0317 234351.6351 311292.453 569411.5587 680336.6886 643288.341 1318917.677 656472.0012 325215.3732 PC 32:0; [M-Ac-H]-@6.50 2734154.728 5759485.715 2839897.613 3041900.723 2905198.62 3269657.035 1725963.376 2311471.86 2369728.591 1469587.016 1829799.16 1440166.709 2965598.912 1945535.489 2919327.501 4078896.732 1711254.243 2538488.644 2386072.051 1866720.654 3696744.162 6578531.249 3918255.467 1741624.659 PC 32:1; [M-Ac-H]-@6.00 8436593.382 24072881.46 10096961.44 8810729.158 7684513.818 10951254.58 5198435.473 5494163.464 6279088.114 3247374.298 4148375.42 3719528.284 11024983.28 6453244.929 9705662.221 11578448.21 4282491.497 5826380.734 5477639.558 4423113.057 10632811.52 21654273.69 11189041.23 4322094.18 PC 32:2; [M-Ac-H]-@5.63 3420832.845 9031435.656 4507117.27 1567720.443 2140063.996 2032287.553 1190174.161 1283386.706 1681071.094 1173637.497 1387464.031 1201947.928 2645724.732 1693837.247 2628374.966 2597514.878 1201238.2 1709838.242 1638558.894 1517417.667 3005744.546 5652042.167 3125147.363 1514171.399 PC 32:3; [M-Ac-H]-@5.29 585422.1402 1284407.474 589322.8159 99849.46412 153398.905 134510.9383 59743.04394 62805.09478 93613.34366 181657.1291 205445.7571 194370.8742 227372.1251 145915.574 222770.4345 269036.864 107691.5051 155415.0857 209517.2522 220145.9633 406373.9932 629874.1494 321825.1862 158619.3051 PC 33:0; [M-Ac-H]-@6.74 217276.0374 647931.8201 380354.8788 168475.9757 222835.9406 208054.7499 75609.85243 106417.7907 93206.42748 176881.0781 245487.6536 239656.7692 822469.2428 330404.1222 506265.4746 555323.976 226040.5687 306751.3545 421032.8359 329166.9774 506807.2138 1070579.729 581229.6163 305449.6051 PC 33:1; [M-Ac-H]-@6.29 968849.2406 3116615.861 1145038.517 724222.5467 563744.9772 763545.3676 265118.0339 307462.8045 359924.7639 497129.803 631774.1397 401690.2629 2179883.175 1313440.999 1897401.946 1478504.189 504833.0379 930699.8066 1031348.515 947473.8067 1635075.518 4067240.434 2044647.872 921033.1321 PC 33:2; [M-Ac-H]-@5.92 382910.6956 642138.5394 487864.9948 326630.3509 129206.4082 246847.2662 246557.7806 127862.6744 307784.2304 149071.6777 380199.711 257624.8902 612242.5427 215988.4859 256146.8489 281879.94 132936.9494 322093.4528 370175.1739 180213.6216 595751.7048 714024.649 365230.0925 219178.3607 PC 34:1; [M-Ac-H]-@6.59 9454657.325 17219248.84 12304220.8 11497557.62 14379788.92 14629032.55 7405112.844 9667040.584 10194872.78 6248002.736 9189627.767 7836976.594 18924046.6 8213407.253 9619352.608 13711979.88 5314791.436 7844232.953 12519514.65 8449615.55 15830563.55 20934103.45 11606349.77 6316403.194 PC 34:2; [M-Ac-H]-@6.29 5556086.182 13263213.51 5820459.473 4171596.457 4160292.099 5644461.647 2670936.46 3332410.794 3800293.681 2379472.404 3099495.839 2445915.102 5561963.112 3439557.78 5116199.318 5871053.956 2319403.248 3191074.957 3428800.973 2913241.416 6215120.99 11739801.62 6434222.531 2623295.483 PC 34:3; [M-Ac-H]-@5.86 2264270.467 3875863.443 2600568.323 466930.4133 499067.7995 452500.2541 295696.2245 217175.6455 542413.5067 1338173.199 1965865.527 1658715.032 1336310.934 720485.2221 440194.477 2609634.616 321084.2077 336310.8334 1220710.973 957436.1283 2353371.543 2621182.303 1698737.292 206319.8621 PC 34:4; [M-Ac-H]-@5.49 137800.5862 387877.4715 211642.9175 148059.0205 167383.1883 226619.1606 93201.6368 93233.66758 113874.3444 133906.3441 235543.2538 195977.6929 202590.0716 160230.5651 147319.8269 176219.9445 55528.67882 76144.21708 171628.0385 141052.654 280147.0476 334295.3763 190122.3673 77416.73771 PC 35:0; [M-Ac-H]-@7.32 144449.7556 231665.3456 138336.1934 82759.46149 279579.7937 80574.95408 121417.124 70686.77505 73900.84786 60425.9711 108883.561 75758.94768 112291.5716 48979.97635 128877.3877 230547.8014 67249.3916 58961.77952 62347.56992 69192.66471 178979.2703 226357.5967 126828.8534 47971.07858 PC 35:1; [M-Ac-H]-@7.01 1383385.859 1302161.873 1054421.574 405223.7738 242299.4026 331937.3567 309398.3093 153383.6463 252821.0295 443378.4459 783125.464 407920.3255 1668071.239 661404.0633 981158.578 916007.3588 518830.4425 627913.2301 803186.5017 566982.9764 1304371.989 2369567.87 1005026.691 677980.4432 PC 35:2; [M-Ac-H]-@6.47 786811.3104 1132738.007 655176.1358 285093.2259 276744.8287 275580.3177 152463.3275 94803.49952 186911.4779 373508.6089 521245.7619 604882.094 1394256.839 549768.6362 463433.4693 1527707.414 256201.3838 183207.8414 741155.4297 461235.9719 1398200.124 1581479.156 1034442.934 202099.861 PC 35:3; [M-Ac-H]-@6.26 329551.756 883142.3819 390166.0646 126615.2894 174185.2013 190296.0059 62167.94684 99691.37905 88477.83872 171771.7973 203746.5085 171984.0075 385684.959 187942.8203 327914.4011 377308.6516 156651.2366 206832.8422 217918.5842 157313.8053 356803.168 787399.4701 468297.299 220877.5352 PC 35:4; [M-Ac-H]-@5.83 187635.6754 643192.8451 296564.5044 85563.45633 106777.3528 111296.2745 23587.75587 61564.59852 62538.92054 105476.5578 142100.4701 134222.1965 338947.9338 174409.2412 332667.5403 317605.8952 124281.6306 193638.0722 136549.2851 103723.9878 233301.8878 549330.2671 260943.7746 133118.7712 PC 36:0; [M-Ac-H]-@7.69 72085.73069 341194.7896 109179.7752 74668.84299 76469.12711 123026.3148 48291.96054 66718.40732 71203.90062 42622.4226 39926.66012 41728.95164 226803.7602 214252.3198 209547.6386 203523.0584 52479.62368 116740.4617 124273.6197 142449.4241 215320.1062 316793.8222 204907.6053 83790.6111 PC 36:1; [M-Ac-H]-@7.19 5516938.033 11556200.06 5035023.319 2317350.544 2166775.455 2995276.827 1413936.046 1575775.99 1846025.825 3218947.642 3623799.886 3035439.667 6963260.823 3961086.612 6397552.581 5965124.186 2441320.155 3522943.752 3765589.88 3250361.422 6832363.85 13648570.87 7041417.33 3161868.713 PC 36:2; [M-Ac-H]-@6.75 10454264.4 17924213.52 8399228.565 7853631.704 8805774.838 9523161.813 5573311.388 9119928.876 9605711.125 4120980.479 4906273.843 4596775.412 8641182.389 4447980.506 9297761.56 8898202.102 4354970.65 6786580.152 6362960.745 4872572.901 8913600.056 17218184.52 8819506.905 5135049.262 PC 36:3; [M-Ac-H]-@6.43 3893406.237 9571699.729 4640610.494 2050720.346 2174204.694 2898101.959 1169060.343 1360490.198 1513599.455 2362631.136 2653025.371 2364752.164 3185747.668 2106884.693 2261955.236 3681656.737 1632355.8 2278440.081 1957160.516 1687427.527 3475040.784 7599323.085 2458774.528 2038644.861 PC 36:4; [M-Ac-H]-@6.11 1128440.914 2873611.409 1410378.224 1359831.394 1178947.226 1736775.292 632393.6724 737839.6962 731940.8288 1129561.818 1389376.801 1136705.011 1471635.847 990148.1173 1381583.762 1669883.76 647951.9874 903945.037 893236.6747 794333.4219 1550128.149 2830250.849 1609623.332 676862.4103 PC 36:5; [M-Ac-H]-@5.72 434431.0279 714287.1163 566764.0444 518363.913 1225611.786 580362.4123 586919.7924 295985.952 306701.6113 283710.0639 311656.8786 316348.2731 207217.226 54930.65986 251501.9909 534379.966 140596.2659 160660.4095 298496.5871 252601.2133 381377.0652 452773.5976 259501.0863 111203.4334 PC 36:6; [M-Ac-H]-@5.38 59542.47274 135096.1407 45831.61851 110390.9942 125895.4505 91093.74675 52079.03292 23624.37867 43768.89662 71550.93007 104310.7777 95191.90677 83590.60655 37092.28696 23238.15975 133699.6106 18905.13923 29340.71455 59061.95206 50875.51714 116702.8734 86638.39916 70306.00664 12834.38414 PC 37:1; [M-Ac-H]-@7.41 251897.9415 597176.7209 260351.858 76055.84749 63777.22346 76740.76017 45375.96246 74513.70276 63069.53011 162667.0839 185313.7336 140785.6256 375646.731 243380.1608 278992.5012 295690.756 102222.0021 234880.3855 225094.4501 202841.6235 335368.3593 829226.6851 488220.4223 199649.5539 PC 37:3; [M-Ac-H]-@6.83 412890.6487 1049686.802 659191.1176 104882.9694 144839.4245 123096.9594 62292.43185 16203.7561 31926.02478 379565.549 521253.1963 433649.1394 659227.8955 196343.4859 242530.1233 660190.738 93710.24437 115066.3826 224391.0864 213951.9925 536458.9716 743976.7316 486224.5636 82856.09177 PC 37:4; [M-Ac-H]-@6.47 175172.1358 376113.2545 243505.4531 71706.18466 87613.58538 81714.51802 22086.60653 50852.86156 34467.63428 165775.9293 188854.2935 158999.0282 258348.054 159964.2404 279557.9962 266860.7324 101842.2618 163734.3565 146151.3308 124313.1832 234401.1532 608458.7131 309193.2427 137736.1892 PC 37:5; [M-Ac-H]-@6.04 24400.38301 108013.7524 34857.11122 42730.40091 45930.96404 66483.98546 13210.34776 24752.84842 30060.94297 39499.61946 63288.80564 73447.51957 95010.04966 37284.02822 42571.04782 73776.92139 25065.64272 32218.59399 100899.1495 42707.77122 137585.0654 117132.8326 57917.77532 22728.79349 PC 38:1; [M-Ac-H]-@7.75 252825.953 577786.8095 274210.8319 179725.6072 198661.4457 215504.2001 111468.5547 109877.5557 188531.8643 189630.6177 261558.7901 171770.0457 372757.3818 206770.3952 333906.7131 340733.2277 128347.6164 192183.1182 196995.9671 172781.5825 368657.1587 854878.6114 301179.015 190195.2677 PC 38:2; [M-Ac-H]-@7.29 1147913.27 2602357.551 1107941.463 860836.2411 899567.363 1020189.452 604892.9871 716026.9672 881961.9081 812997.9274 940204.3507 864020.9204 1302850.009 814504.8024 1212678.48 1346375.271 527484.8021 803694.0983 701617.1833 748603.982 1359243.579 2674657.452 1366351.751 627190.5531 PC 38:3; [M-Ac-H]-@7.02 2691305.77 4148635.145 2823645.822 818579.5144 836568.098 1058666.599 494191.0156 602030.2547 695963.935 1496685.077 2795492.708 2324512.879 2442868.173 1454250.474 1419109.285 2683214.432 1043761.635 1522242.202 1346149.802 729725.5769 2477461.131 5332164.133 1682062.729 832589.5755 PC 38:4; [M-Ac-H]-@6.65 1661231.549 3845465.54 2175267.23 1013952.011 1049568.407 1402377.479 521102.5058 715312.6415 779456.9119 2476092.971 3334348.706 3026863.729 2285133.345 1023574.355 1325000.011 2636772.922 891807.8296 1300161.919 1780340.14 1207817.124 2426990.129 3920948.023 2074777.977 938346.6138 PC 38:5; [M-Ac-H]-@6.31 808097.6443 2174883.27 1000563.598 1331880.083 1445144.484 1288016.616 734340.7503 422250.6802 816647.174 1664400.558 2195742.905 1965754.948 1743243.543 645752.927 471189.9727 2677474.439 452817.6709 435466.6951 964045.3729 811525.9926 2044395.929 1794104.602 1074667.056 206370.4274 PC 38:6; [M-Ac-H]-@6.02 224300.0966 621398.8184 284361.9499 472604.4962 414508.5167 552053.5262 235773.695 293197.1989 321473.8399 366725.3601 457540.1209 417713.8896 481902.0779 317597.3416 446653.4676 577684.0611 235610.7812 348477.2616 370544.9254 267213.7646 545660.2474 1022057.907 518134.1482 226481.9019 PC 38:7; [M-Ac-H]-@5.58 63570.11268 184266.6892 88307.33771 92943.98006 118592.2554 108900.1271 52918.04732 51668.84571 93189.86749 82756.71425 103500.7724 90301.90667 95642.58975 59698.85536 101179.9296 111422.0559 44152.59636 73339.80486 75023.71021 51473.41476 110995.3318 172183.8099 136603.9524 69307.17555 PC 39:1; [M-Ac-H]-@8.06 59936.59219 161025.4688 99222.32168 31617.55158 87874.82162 34750.95021 22722.38926 13174.49078 30026.08094 52166.47478 85611.26024 57423.41447 160828.306 49708.00331 40062.1847 138628.4702 24002.86494 25342.17966 46019.21248 28822.07527 84049.02089 87072.0973 75663.55547 20832.40441 PC 39:3; [M-Ac-H]-@7.34 63291.12905 215272.0681 102455.2636 20623.37584 38468.90869 25367.452 5424.898703 16839.00047 15723.60554 79536.10137 88450.15384 78856.05473 103535.5687 68597.66107 104021.0438 89214.4767 41667.2375 66274.65271 47967.85203 40663.87924 106882.5843 200688.3264 119676.9424 35289.96276 PC 39:4; [M-Ac-H]-@7.08 42824.98648 109368.2219 101285.1469 14406.83695 32272.49627 11920.78669 15041.58533 9858.858017 17288.54399 50405.83229 66033.62336 54794.36113 77449.51414 50965.19199 68810.07775 76406.37591 31809.93639 47149.52816 38461.16508 40709.63241 59549.39677 144015.8328 88822.45434 45229.73166 PC 39:5; [M-Ac-H]-@6.63 27878.13357 80347.13931 69195.0097 32616.8368 22277.32038 29635.44559 13277.93167 8458.774514 17129.91202 34394.69035 43412.32852 52102.01302 84921.09265 17859.8516 19916.7256 60982.67965 16507.41418 13244.46893 27996.09984 17226.74801 59319.5192 55787.99463 35237.14997 9435.785065 PC 39:6; [M-Ac-H]-@6.31 26756.4221 39703.29731 35960.82647 20900.1269 21931.99049 18016.4274 12853.88708 15861.86486 14040.83246 28842.20728 36354.38544 51754.55162 70121.79037 30508.46872 33969.72142 70003.3198 12072.14565 25408.97062 40751.82435 26405.14023 44596.45638 107947.4079 43515.97717 17200.77882 PC 39:7; [M-Ac-H]-@5.91 27022.53298 73515.34996 31968.91812 24299.16174 19270.4288 38742.44824 11673.41229 28929.27925 42550.71345 38638.5802 40670.24124 67755.49588 96612.88287 54860.25896 40809.99756 74506.72259 21963.95161 32868.8191 52581.99494 30906.64538 68874.75445 107471.5135 41962.89419 29104.60184 PC 40:1; [M-Ac-H]-@8.22 71074.95181 182738.0979 82148.00826 38443.85476 47382.57774 45053.07416 22600.1594 31742.97181 36467.89569 55707.50829 85814.7213 51553.44814 130879.5776 75990.51875 93892.77732 126973.8519 45859.56555 80504.90371 54896.03552 42522.22949 116471.1867 231577.618 126427.4594 75233.53783 PC 40:2; [M-Ac-H]-@7.83 270248.1183 563604.3988 285619.9302 184544.5707 171528.668 156810.9021 130809.4199 56546.01005 127576.5674 231580.1991 277813.5804 247284.5097 479860.5239 161355.2086 130780.2724 561274.9921 103950.9742 91233.87031 163786.0513 129235.9334 390965.7426 374094.7072 232708.2644 61611.45899 PC 40:3; [M-Ac-H]-@7.50 218986.7413 531435.3132 231606.6465 95034.47484 127354.6808 103642.5371 55232.79189 89789.50418 87382.31411 164195.8702 195769.4634 153618.8927 220533.6369 148585.889 203946.3078 285978.4106 114613.3031 163643.0397 97900.78634 100106.9682 177962.1903 348214.4975 245610.0631 98792.26129 PC 40:4; [M-Ac-H]-@7.24 306066.4896 661675.7739 283653.5995 104561.8816 146196.5312 151347.5348 73096.53552 111930.9763 121600.1473 254237.3649 275792.3007 255134.6784 297319.3847 161246.8061 247968.6278 351136.2593 153292.0987 175170.3105 157524.1919 131011.0763 274169.0116 549462.9128 282587.9222 152881.5891 PC 40:5; [M-Ac-H]-@6.94 242942.9967 651021.8764 297366.0105 177734.0784 238737.2295 163597.759 111029.1269 56129.68537 127023.2291 408672.6094 588388.9264 528725.4283 408688.174 127521.4584 115628.7503 493667.794 104781.052 104693.0333 163331.621 152885.5312 424114.0295 335646.0025 232940.7996 52265.6128 PC 40:6; [M-Ac-H]-@6.58 147514.0228 355921.3235 191220.6542 107584.5473 172735.1763 160285.5807 87668.18388 101730.5765 131753.5379 209653.7203 253458.7045 226788.0881 213900.0066 118736.3969 235097.6892 244265.1011 88090.26669 166755.229 147020.1628 100165.5491 198335.7313 323667.7625 215521.1236 122159.1097 PC 40:7; [M-Ac-H]-@6.19 149151.4103 335658.935 140079.4013 301841.5052 207216.8977 354363.5743 121037.5689 241309.0789 217833.9022 338917.335 456111.1749 402649.0777 537763.9604 312785.5179 233020.6763 470761.1327 110977.6933 165920.1764 408109.8519 259310.5343 445358.38 676221.7989 365404.1747 159954.0178 PC 40:8; [M-Ac-H]-@5.77 77652.25028 139613.8329 67217.04824 170461.1094 111148.0111 331200.9558 67309.00669 296579.7562 216264.26 88296.96646 68948.76513 59773.33289 229589.7668 238410.6016 230751.0965 130626.2213 54908.35083 84460.88304 132393.1424 145293.9532 124571.8189 345841.8667 159778.2886 133944.479 PC 41:1; [M-Ac-H]-@8.34 15901.9929 93671.37493 33229.01479 14912.22442 9449.831024 15367.55364 5775.30597 11247.90166 9000.855416 25019.51538 26380.10124 12462.05778 33113.46633 43008.04877 30232.82161 35374.73235 8788.221738 19067.25253 17980.21035 30083.2616 40727.14177 74329.46651 35895.21138 31621.95415 PC 41:2; [M-Ac-H]-@8.10 29908.85524 114131.625 62015.15855 28203.74708 25203.719 21787.01035 11689.83748 11390.25614 7708.269235 24649.86601 30328.19445 15865.34687 64469.03928 22552.01746 66424.90357 41231.14253 24955.36074 44434.33562 23686.59002 24972.27061 49872.67836 107379.773 30115.4412 23407.48807 PC 42:1; [M-Ac-H]-@8.69 67853.91061 216294.3543 111187.8484 28476.59263 14906.18384 26779.62889 10611.91762 3976.111394 5304.500163 67796.16163 80184.58475 53272.29207 186618.2485 105763.1775 128894.2844 133911.3434 50275.45664 73127.13211 75823.57298 59110.79123 154420.6426 263647.3573 147032.4279 70847.12568 PC 42:10; [M-Ac-H]-@5.69 51942.9772 105879.0086 50770.66106 64062.27216 78358.82185 93987.27149 22333.80739 44354.63521 64657.05449 76654.15575 60819.16912 76039.5494 159354.2997 106149.9779 51213.53646 66405.9879 28688.98648 27528.46396 69443.29014 67660.35211 137742.7016 125781.2727 112581.5135 30084.98892 PC 42:2; [M-Ac-H]-@8.30 218921.8327 472910.6897 248963.921 72793.86373 67693.00534 49481.50147 37596.14453 17687.94817 48961.20922 157697.1528 201296.0454 168319.8549 462160.3041 141518.9908 79606.91163 451003.7281 69935.29185 85494.65305 133502.1703 115840.1569 407881.3797 430539.84 240673.9462 53008.96318 PC 42:3; [M-Ac-H]-@7.95 82823.38608 232013.4908 123444.6917 29698.26019 35285.41935 35984.08799 14725.43973 26921.34356 18458.25096 53127.72371 61090.70836 56079.18458 144183.2874 76600.46311 122439.747 133089.7277 60152.62922 83673.06571 63143.32425 49315.84982 94914.29747 254395.7147 106027.2956 64782.70132 PC 42:4; [M-Ac-H]-@7.73 111322.8479 260851.6462 130885.4003 42850.94094 46754.89982 56847.69392 28041.38635 21549.06935 42651.25493 62890.96357 86710.53237 71524.48801 122867.3653 76389.93659 124323.6329 127756.2479 51789.62198 79694.5685 53782.171 46433.34825 107873.7427 180057.4288 120561.1048 53810.13812 PC 42:5; [M-Ac-H]-@7.37 81666.09583 84355.48582 77714.43883 40111.81779 27853.03719 18757.96006 21075.64254 19990.88923 26012.01065 43683.92776 76294.78289 42927.61688 59657.01427 17485.25544 21292.39938 46838.38261 23461.05018 48601.27419 33173.26133 18185.30864 53184.016 62525.31196 34175.47338 27011.56086 PC 42:6; [M-Ac-H]-@7.13 44663.67504 114553.6854 68732.06294 25006.35788 19095.94744 43382.37973 12966.07234 23684.82192 17767.35351 58894.92109 88074.52674 91671.83392 84119.85439 38676.47593 36806.5335 65629.67256 26529.89189 38851.28021 41861.76533 27954.12612 60585.07967 100301.2689 54845.344 19114.89031 PC 42:7; [M-Ac-H]-@6.79 18803.63058 48920.73682 29038.82805 35657.19254 26043.18941 40319.28621 25116.88946 15686.93722 29028.45391 42435.0613 71647.07703 51208.22213 43959.69261 19366.15176 15512.60511 50009.21813 15938.45881 12169.87075 26858.60043 21944.59378 46203.81853 43298.98331 23799.37035 6538.513264 PC 42:8; [M-Ac-H]-@6.45 19708.7678 58687.95016 30820.53493 42004.6228 48171.51838 35525.30381 36546.69976 68554.35896 28649.21968 26476.95083 32141.803 21542.63794 30871.03405 20747.65077 46139.84513 48661.66532 22344.00843 13667.72625 12512.34962 19028.49461 27680.55013 61076.11615 21209.71288 15839.35808 PC 42:9; [M-Ac-H]-@6.14 55181.08376 75891.87914 33192.86678 25847.59415 41969.61256 64811.25286 11099.21505 21073.31337 21569.01779 90027.06975 67551.15929 118310.5737 74930.09718 51500.11444 43996.03563 85390.43815 37176.03841 16221.50983 37399.46623 40629.3829 130147.9384 77819.21742 92311.36706 26431.40145 PC 43:1; [M-Ac-H]-@9.02 9627.799439 35930.16506 20818.78472 3006.724291 1226.605161 1032.318274 260.3287451 2104.712925 997.6530967 5034.273258 14481.84968 11279.40947 41197.91752 19851.82969 44780.51876 36190.46145 13117.1669 9751.362946 16004.94232 17292.89378 33753.77569 67062.03169 22317.2317 13864.59507 PC 43:2; [M-Ac-H]-@8.48 20277.15538 66810.65829 32194.47129 8125.094127 14263.8265 8192.440941 5512.288091 6241.32424 7674.179025 8453.053282 26995.7609 19265.92567 52413.37854 16474.03689 49708.23347 46417.49456 22720.16957 9074.894273 25078.79445 10992.92036 56163.17521 91865.50158 37663.33 20409.55231 PC 44:1; [M-Ac-H]-@9.14 46650.78801 95571.1279 36743.05223 3139.361865 21899.93587 10515.00487 4837.780601 6569.07755 6693.672697 22073.10881 27646.44225 24755.85397 46523.25241 13068.54791 48267.17251 88338.20567 19750.99878 22517.52021 23134.83308 27268.37355 73671.21567 111681.1781 60298.09151 25693.38077 PC 44:2; [M-Ac-H]-@8.73 123713.8922 298972.0229 91486.48051 30968.49032 78063.03935 23041.85644 65987.35631 13158.68329 19742.59982 63011.18979 62536.16169 57485.57343 77948.94987 31474.27492 107546.9186 207309.4167 49827.96748 51274.14074 47687.32029 60402.93547 171072.8359 286247.2031 127339.145 41849.2544 PC 44:3; [M-Ac-H]-@8.47 59737.30941 200248.8825 92019.67975 29412.20439 11264.62857 30691.35216 15253.88107 31612.91473 998.089148 25493.05876 50531.82525 41894.93819 118532.0973 80979.74007 82454.78711 125099.6054 61596.10551 69783.85519 30000.75981 43321.44651 118291.9946 148654.0388 103914.0567 56629.73165 PC 44:4; [M-Ac-H]-@8.30 145676.7127 364212.1546 195536.2053 54585.24525 132675.7425 49555.27043 64505.81616 26611.47603 31517.96855 66196.24932 89304.34578 90697.06955 71566.34806 26347.43844 102464.2757 217153.4059 55899.26765 79558.5914 50625.90176 44088.76973 134802.8999 158649.0276 100910.8235 50209.15684 PC 44:5; [M-Ac-H]-@7.94 50082.02871 137728.1183 77069.04873 13726.77766 23714.43441 33091.34162 9043.752384 10562.33524 19085.25876 31057.31719 43017.62183 41673.02665 57867.33747 37840.81171 56376.38097 72933.24937 36945.04153 61854.78593 32392.36326 25877.55448 55442.44341 116599.8421 51453.79732 36989.59142 PC 44:6; [M-Ac-H]-@7.58 21898.31704 72116.33996 35412.66485 12094.4035 7056.144492 13828.90486 7195.13764 9307.255168 8403.957721 24476.33652 33225.82358 20480.01227 24608.09082 14173.0888 23766.56886 44491.9795 16804.7364 31334.17367 8669.601965 10954.45888 24382.6189 64091.52779 32907.99804 9886.904178 PC 46:4; [M-Ac-H]-@8.70 39677.51693 94972.70526 41135.42461 1143.54485 2813.38258 5132.879478 3343.636406 8209.366742 5184.317423 25849.52804 68395.29035 28020.63504 56689.53475 25291.00731 28333.20117 36096.86492 19078.95426 36867.37473 25835.35151 17347.17431 58891.43181 100068.9202 41369.77864 24669.55498 PC 46:5; [M-Ac-H]-@8.32 44983.83375 125227.6573 58964.51445 11464.81357 7607.757608 12728.66784 7499.849779 299.6167973 9050.179387 54423.22593 71236.90707 71299.34596 97148.13506 26580.43159 19240.17154 109832.7839 22685.91273 21044.51693 26768.92369 24195.68284 61687.57675 81122.71498 51874.55502 14548.2967 PC 46:6; [M-Ac-H]-@7.99 20777.82972 38868.74474 21719.64976 4795.375788 6073.610585 7232.228265 5863.058013 4708.300133 1832.861693 10275.675 26000.30594 14406.07356 16886.62001 9261.823171 13719.50429 16001.42094 12613.33937 15544.76258 11587.49647 5280.160387 16492.38389 23497.17747 13207.62997 10068.77017 PE 31:0; [M-H]-@6.29 21498.54594 89527.05758 46927.6033 18575.55343 30997.8584 26905.84859 8208.684184 13370.77936 15529.9573 12093.21346 15350.1154 10728.88471 32124.8453 20299.73843 43195.82566 27633.31235 11516.9519 17824.94322 13764.56344 21517.03379 39273.53298 83679.58774 35911.29314 7367.887587 PE 31:1; [M-H]-@5.95 193544.5323 935456.1478 371981.1935 123898.5638 187798.438 120386.5653 66398.35433 16409.46846 36562.73763 132647.2127 172485.6671 177516.6053 300267.867 77719.93384 123931.8729 352532.2572 60821.40104 77834.69249 144012.2235 118453.2926 486721.2674 494554.8927 298644.7107 34369.03023 PE 32:1; [M-H]-@6.20 2116635.851 3430450.659 2889394.195 2479714.974 1708934.596 2167621.835 1690117.384 1518298.802 2250211.63 685223.9631 1210348.832 683419.593 2142356.84 787365.1399 1267887.681 1649599.135 819289.278 1131086.922 1077666.5 693897.7611 2096921.512 2970017.631 1469792.075 909614.6607 PE 32:2; [M-H]-@5.98 719650.026 1668376.425 736233.3271 312236.872 535884.0854 570625.831 313151.8596 208492.1088 379681.5056 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128394.3288 493117.7224 230869.5645 114585.3584 92093.92587 159982.7742 62704.29951 78871.55929 65177.63154 71139.08043 126757.369 80798.17718 415961.2539 359491.763 457062.7516 236421.5866 127726.5725 207477.3318 184742.5381 181538.1321 246668.6379 989097.1549 401958.3282 257234.3963 PG 36:2; [M-H]-@5.99 1806650.601 4474730.7 1737611.692 2336562.416 2014557.266 3220363.099 1786903.959 2776733.88 2707763.282 448329.2926 726192.0657 563754.1419 6111451.362 3273487.41 4298104.797 7290897.936 1954802.282 3151276.611 2032397.256 2086292.806 3216618.262 9049871.784 5087025.832 1873125.388 PG 36:3; [M-H]-@5.36 419216.6482 1409096.553 462856.5095 202735.5027 176293.6556 368281.4558 139975.4139 184942.8878 212599.0812 105667.0993 146199.8857 101024.401 1096506.845 798216.9126 825024.5186 811445.5831 311637.4146 476017.3367 390540.1551 472519.8901 684879.465 2104819.033 727402.7983 347327.391 PG 36:4; [M-H]-@5.03 87944.49215 327358.9048 114402.8418 27678.94377 16615.33901 50037.10946 12627.53594 22278.68122 29983.34813 19209.06673 37833.35726 25002.22406 176405.6861 147995.494 166265.7438 157905.6423 47122.23332 85806.04269 77293.28212 90768.03585 128177.3576 361080.2435 114508.7659 58302.33751 PG 36:5; [M-H]-@4.76 33955.46304 55460.52445 28034.68956 9776.304599 1104.861009 6192.941981 3380.712071 2295.800167 1187.296159 10564.76722 17967.81414 12592.14882 58359.1488 23202.68847 21331.96119 30945.69813 13126.08099 28085.03866 21876.27007 27196.47791 53416.29781 55537.4376 28435.94271 16878.80566 PG 38:2; [M-H]-@6.30 145264.4137 406881.8622 140857.5575 149198.943 218193.9585 212249.3115 108965.3444 80226.58914 110217.1805 60331.87394 74103.75189 103522.0381 701114.8971 264815.7347 211796.1716 584406.3552 102316.0492 81786.53841 178602.3025 200525.847 365551.5226 564116.1352 243322.995 55607.89136 PG 38:3; [M-H]-@5.91 1172193.225 3310296.038 1397489.867 554518.3622 611982.2568 626249.1535 435437.3537 187593.3793 409866.9751 450685.3082 723980.9362 620851.5043 4524478.061 1429485.253 1181657.701 3995722.01 640811.4147 675413.5926 1128598.411 911806.1255 2494199.056 3448230.445 1763940.416 324720.8522 PG 38:4; [M-H]-@6.07 95184.16271 368530.2761 84717.30566 42961.97616 37114.25217 62127.60562 24154.09346 34940.30009 33123.80382 41447.597 56645.47642 46011.21217 140451.2916 79746.9915 127980.914 8519.721569 50205.28987 82911.57722 68129.39719 61489.36781 139702.7025 367005.1361 131477.0287 90236.50605 PG 38:5; [M-H]-@5.32 211510.8398 867660.5649 312333.2336 104525.0644 79275.67682 145031.9435 55647.25993 115797.6572 109833.452 123167.771 187537.2943 130093.4082 781468.2504 574424.1531 553314.5395 602564.4942 205066.6268 343497.2329 300804.7312 334276.9164 457211.0136 1137725.834 383257.9244 222575.7299 PG 38:6; [M-H]-@5.00 96008.75344 293312.0119 75367.10107 76934.49526 47290.19999 66559.47072 21827.6767 8175.649404 14648.89468 69259.19914 110985.4488 62030.4382 403045.3438 187315.3235 80718.90519 562681.5242 88508.66905 73705.28834 157620.559 135250.3605 299684.2329 403009.4324 198053.4349 37608.18828 PG 38:7; [M-H]-@4.55 24269.29796 133900.686 22376.98068 17260.31449 19657.09355 50062.92669 4899.754075 5934.780527 6524.477362 35130.43287 41827.16765 32740.85043 147296.8939 92293.91903 58506.91858 284623.5204 62179.4092 100521.2711 101794.0081 107260.971 186537.8757 349237.2304 117438.9141 41648.21465 PG 39:6; [M-H]-@5.30 17455.93438 120824.7783 28155.42782 17323.60221 24782.00133 25155.04622 9807.639812 15936.29857 5451.070935 27107.76461 19224.46702 16869.15398 121618.5364 94202.46079 101317.8166 97085.0966 39062.15197 57143.5562 44865.73639 48505.94327 71113.03585 227512.4203 76025.06426 46558.63143 PG 39:7; [M-H]-@4.90 4971.281252 16676.54003 10416.2527 7959.831171 2132.927732 11892.35569 3837.362307 7582.782392 4764.925553 9530.826579 16096.35566 7506.957446 75189.96477 38984.71681 17562.9616 67007.63281 8221.778509 20046.83447 41838.31547 31815.26279 34863.78856 110008.4991 28397.85853 19699.72743 PG 40:5; [M-H]-@5.94 529435.6394 2106708.377 772124.9438 134071.722 195094.6384 166231.3581 88604.87276 87610.60944 87985.01584 269362.6756 391231.8773 362412.2478 1473933.039 888439.7441 1229467.759 1173301.999 332026.0275 766453.715 347828.9715 370531.5084 675252.673 2282815.704 752596.4476 429224.4431 PG 40:6; [M-H]-@5.56 265714.9504 972091.6944 301558.3241 348495.8164 272898.6897 494015.6916 166159.28 125719.9877 228157.4341 212696.4113 392935.1445 260601.0819 1348642.809 999946.1725 957288.1007 1264993.298 527610.2891 755774.4412 444250.4131 485707.7312 713864.2498 1979751.059 691386.3264 291792.9051 PG 40:7; [M-H]-@5.18 557923.2879 1909671.968 618099.254 881780.6264 615273.2489 1301302.484 354690.7569 346631.9734 349993.36 459166.5945 756666.0076 443107.0158 2689633.18 1563086.961 1867145.662 4654611.337 1668282.366 2679615.081 1463414.824 1631935.038 2238419.983 5046485.758 2466158.358 1065463.146 PG 40:8; [M-H]-@4.79 30395.01624 156781.2687 55612.79942 20498.85463 17298.89732 36379.05997 2838.200443 7435.672117 4179.924223 42654.33827 49725.78508 28878.92839 142327.3521 110365.0322 97051.52687 236359.1461 54582.49234 110635.5365 81773.45263 99489.46974 145709.3738 329687.7405 132240.9835 61664.55138 PG 42:10; [M-H]-@4.76 7827.312137 78690.48341 21855.11513 7473.870043 3678.685361 14641.11939 10549.78447 6456.559515 3037.884253 38156.48138 48621.51535 36949.35959 64832.05197 68922.2355 50673.89413 132467.6582 30820.0496 48192.66842 72377.24564 68759.91828 78081.45385 132085.8192 49062.96258 28666.73907 PG 42:5; [M-H]-@6.35 65054.90587 69027.3947 79200.05582 9680.222881 9466.82784 28282.20325 18444.80622 7631.801788 13377.61321 25586.27285 37092.49336 27410.69091 110928.3041 60501.89907 58285.97706 27884.18702 19478.05513 41488.33301 36195.50251 16510.46658 55879.81073 120000.1694 50660.08101 32089.86291 PG 42:6; [M-H]-@6.08 132552.6203 277329.8371 218500.2903 55368.20967 27251.13372 63830.23263 18520.0258 28910.92815 44976.77775 79878.00633 145877.5183 95857.54023 320232.0352 173801.8823 168733.8337 165130.4441 89026.22852 114457.7635 102541.0983 84052.08695 142413.3125 338282.4217 140242.2644 97296.23626 PG 42:7; [M-H]-@5.81 77096.26489 329400.1974 123710.6529 43815.3918 53297.69052 77881.29641 24208.10923 37301.98785 48024.43885 100661.7734 123629.2407 110233.3662 323988.8966 164427.9554 247958.4772 239089.0287 97695.5828 139593.7345 89737.76367 94563.98768 145101.7536 407698.8268 190160.4476 98786.85562 PG 42:8; [M-H]-@5.36 73880.37589 345790.3474 129754.8178 90786.97961 66801.41657 150118.6981 31703.86295 32874.45832 27861.72073 165250.2815 268147.9483 185680.4034 631701.8668 345241.7592 210961.1059 648569.7103 144005.3577 219342.0269 315794.677 286884.4546 388787.9143 767165.3201 293993.2477 136090.2416 PG 42:9; [M-H]-@5.02 122622.5311 369431.8328 163043.9159 98585.66202 61298.89538 78671.02777 14405.66163 4675.534966 20867.1253 183877.7597 325016.1152 220302.5512 526459.0529 218886.5996 139081.9774 810744.7441 141133.2316 131764.8382 183242.2807 263816.5038 469447.6142 560382.8962 215407.7554 55968.45859 PG 44:10; [M-H]-@5.43 38671.97637 158177.8828 49598.08284 36393.15286 35872.97585 65059.17163 12322.13848 11139.56183 5537.193559 79234.48032 137185.0329 99669.52363 168377.8019 125763.3105 119311.9047 323909.6465 131256.281 121571.356 68901.20724 65350.70606 106534.5338 348772.7999 150695.2596 54307.35725 PG 44:11; [M-H]-@5.02 45107.39579 172234.3764 58028.45949 95483.41219 70659.75423 99831.46772 19773.30202 4539.89355 12752.40223 170570.6644 314594.7054 203651.3634 573051.525 220299.9897 113365.5364 1094752.852 207609.3463 161963.3635 228506.1588 212440.8396 430644.6056 471550.3193 183372.546 36978.00998 PG 44:8; [M-H]-@5.95 173179.7655 235147.5791 191574.3156 55017.35408 40134.3612 56174.4847 23722.44021 41636.52197 49347.62628 151957.2242 192529.1408 128931.9428 585138.2299 381307.9847 328474.5859 290392.7695 137464.0644 214847.3589 208526.9291 227226.6126 230178.5773 563341.0598 242177.1893 289780.5486 PG 44:9; [M-H]-@5.68 88992.00217 244997.1828 111816.0467 65403.9863 124245.5241 76543.18561 62845.50136 71212.29223 62577.19167 98619.09823 107377.8905 114037.5003 126850.8245 64817.21159 151705.7353 283887.4784 98750.75943 102602.8654 45302.49821 78326.9392 127028.3712 239372.7091 116428.7735 58047.54831 PI 34:1; [M-H]-@5.82 366810.5885 670005.5315 177994.0613 1492860.354 899283.1724 1793633.614 982749.255 1176632.908 906748.5688 419603.5134 447482.1754 430914.057 2007410.571 1418899.987 2120559.41 683913.4952 132560.3833 219967.7199 1062218.996 1253997.457 2321966.668 2077260.034 818740.2239 503719.5493 PI 34:2; [M-H]-@5.30 120397.7864 76557.80228 60128.24671 116807.7653 44318.37167 175031.0933 64301.18362 117228.1834 115317.3592 43392.66568 73246.72372 35201.00136 185952.896 97102.43785 58708.05781 50893.55002 31301.5291 62490.7317 76039.81826 87114.9191 111523.0196 185072.1196 105156.1001 83408.47914 PI 36:1; [M-H]-@6.43 55036.18938 48809.42447 55633.56841 83854.2676 43540.43168 101461.2868 36264.60702 51286.33041 67739.61652 39330.59689 30591.06356 34283.33006 91829.35413 50629.30007 14280.19809 49417.5004 13432.75304 15764.58886 37216.90742 40994.99977 66998.98428 56904.55798 34324.50984 9949.403018 PI 36:2; [M-H]-@5.93 569745.5063 553538.132 185004.9824 694183.3821 262093.2557 1071963.863 263592.0135 1124193.248 834420.1474 211415.8635 180063.7692 152654.9174 776670.002 639398.5419 598196.7111 349884.9506 139016.7705 283139.7426 489895.4508 504988.8994 640371.4187 1265071.183 727569.8541 516446.8647 PI 36:3; [M-H]-@5.75 278307.7918 478418.4593 262807.3526 200086.7657 69403.61062 266835.6599 69994.05255 223898.3883 145437.4178 165464.6915 173962.689 134763.7431 618468.6714 567368.6848 536163.2534 188417.875 95840.33249 214041.3105 248163.6046 308398.4214 391030.8311 947850.5805 548568.0237 491034.4023 PI 36:4; [M-H]-@5.36 55818.16978 102888.7904 76485.71607 109992.921 53436.91334 201069.9557 31355.56607 108947.9235 73010.64364 56591.26505 70428.40689 38521.54437 227036.7194 218306.8202 145945.049 99252.47178 47709.56101 92294.7647 114690.8948 134559.3091 164664.5356 279453.7492 175451.7231 115414.4122 PI 37:3; [M-H]-@6.04 254103.928 379401.2518 267914.4537 74122.92081 37837.02886 113443.0565 23700.48304 75906.2349 74960.51263 158320.1218 150936.8578 149067.5588 805899.0451 667743.5051 716258.7408 228111.8229 111397.3405 291027.4552 356600.8209 332756.9174 402433.4806 976576.7262 566947.5208 547999.175 PI 38:3; [M-H]-@6.35 2215950.136 1932633.903 1034073.25 1037862.424 507304.2888 2450221.349 339263.6819 1033873.649 693142.8018 2146200.087 2493592.268 1760636.246 7888011.196 6317136.493 3311299.918 2114534.255 568779.8371 1102025.507 4389050.661 3679722.69 4265545.731 7678508.004 3812093.228 2814674.823 PI 38:4; [M-H]-@5.89 3913940.701 5975408.988 3054739.376 11198932 4242524.401 14838064.87 3514945.475 3988076.544 5796392.065 6817645.466 7414340.614 6838868.074 22168819.58 11588089.78 6179573.126 8319260.869 1773925.513 2869020.386 15934988.17 8911254.071 19826374.17 14524760.43 9605749.026 2908348.767 PI 38:5; [M-H]-@5.46 100338.952 199717.2693 54228.90426 630344.5507 229478.355 1030909.431 203077.1549 786049.6671 535270.48 150474.4146 130921.5952 96017.37056 404058.6361 470389.9273 267641.4618 157989.8799 83905.74376 176777.4916 290841.5927 306870.8775 324558.7774 725859.9361 324481.2279 279604.5102 PI 38:6; [M-H]-@5.17 10103.51601 20420.27586 4072.609893 32838.30227 18299.28857 60322.77262 8040.849667 38680.04906 19498.67496 10195.50257 7048.59119 7553.873145 53235.73977 34583.99647 20838.88079 16022.66759 4980.633543 10670.8242 22722.78675 26785.98165 24619.92892 50874.58551 21157.97474 20411.25264 PI 40:3; [M-H]-@6.87 71354.75337 18142.72871 31422.33687 31771.15091 13516.0778 31672.48825 9725.393653 26607.13276 35464.87079 22156.42598 32850.2767 25525.73816 97759.84142 37285.66444 39082.28647 9991.665394 12533.98125 34825.90191 32629.85724 25738.80873 41016.68169 146254.6576 40855.12283 42493.1339 PI 40:4; [M-H]-@6.37 43778.07104 46131.7052 37728.43425 34050.53759 28943.74122 94960.19018 20575.37825 61882.26547 41173.75775 40952.77126 30591.28141 24706.70148 95690.38286 119435.7159 95681.97839 54645.88796 19043.69332 47123.88725 58643.56383 47454.15001 76173.01268 146994.4625 81810.91972 56520.77156 PI 40:5; [M-H]-@6.13 116175.2129 109127.2497 99850.89044 126432.6856 59214.104 164082.4592 41890.08922 179525.9093 112738.5248 73698.73553 88865.24808 72434.09069 197257.8417 105244.0238 147135.1978 109996.9603 53980.44972 113038.5417 103047.9394 94014.2538 130448.1016 256810.8673 160708.623 137252.5498 PI 40:6; [M-H]-@5.89 31324.71572 45158.44605 31670.40521 77622.88323 35413.46428 122750.24 26343.15341 58028.19992 54215.707 34233.49724 36244.33085 31204.25946 70281.85092 51053.95852 60042.08885 37340.38795 23098.78778 40469.94897 42658.3221 41021.58767 69433.16531 128608.2699 65728.63136 54340.38729 PI 40:7; [M-H]-@5.38 4492.257494 87879.90787 2668.95845 72438.6919 66766.53595 90362.07263 51751.07249 57570.31215 48598.80999 10383.39953 10288.50035 11464.06433 14568.12695 4605.778907 19959.07896 24756.16921 6364.056406 8506.009133 9176.97477 8446.36516 22219.12823 24127.28805 20886.77506 16480.41636 PS 32:1; [M-H]-@5.29 80611.66012 116129.9864 45206.02226 77038.52595 61697.09638 131735.9763 32989.65547 50788.2658 50806.23277 24930.86946 11226.28348 15449.73472 110462.7829 91309.87617 31864.85831 93206.57549 24706.90436 22805.08705 29870.24935 41365.09763 72014.39688 119704.8899 52832.86351 26483.12983 PS 34:1; [M-H]-@5.94 536035.2714 1091145.124 314772.0548 902798.8589 351786.0082 1227876.451 343612.7578 439029.6929 578372.2879 427241.5265 451841.6824 405101.1779 2782279.657 1397956.602 611979.8484 1293233.571 178930.0439 292745.3058 1118908.546 1076628.091 1938097.143 2789584.806 1424754.38 428700.8427 PS 34:2; [M-H]-@5.43 134696.9635 211961.6068 43838.07923 116728.8273 177392.8994 166925.0712 164504.6441 108500.7566 111589.2648 21076.90566 18498.71803 24550.96271 46764.28975 46281.91665 67297.42135 82466.93946 25559.93551 24608.73865 36266.94698 58681.29999 71704.52383 134306.0055 78298.05841 36179.27452 PS 36:1; [M-H]-@6.56 610933.1142 1635048.488 473624.4948 788394.6657 1094776.784 1618426.022 471421.3264 1256414.469 1023465.572 390215.2781 374928.8346 363388.6214 1260135.236 1196525.753 1278191.67 1202179.71 370324.5532 553614.3155 794697.7145 891671.8897 1121101.761 2659440.249 1438335.388 715363.0601 PS 36:2; [M-H]-@6.02 578775.9873 1696775.843 418559.5053 670169.1154 467202.6205 1245226.29 306409.0205 1056048.79 752929.8234 363176.9447 335295.6126 418331.5941 1516310.646 1360147.48 1075385.504 905833.3916 299765.9585 571616.1544 787891.2417 863924.4689 1166604.551 3093758.437 1445809.767 843161.246 PS 36:3; [M-H]-@5.82 190210.0228 161191.4903 144155.6517 78792.78656 28006.51566 116899.033 56575.66257 107303.4892 119668.3779 59877.92822 108010.3047 61684.74406 357162.7105 236080.4442 128174.3254 156509.7594 87755.5159 104596.9829 136721.5195 134935.6968 216909.9391 494176.2076 266120.3077 185088.0178 PS 36:4; [M-H]-@5.44 57037.76698 40662.96616 46067.65841 63076.92506 28821.50408 55847.97025 16516.71288 41197.08797 36069.4877 17180.11957 36741.70194 12894.31734 89932.72905 68234.13267 28922.14738 53861.22236 33739.82056 43915.22241 32885.31744 45029.49414 55359.01995 144164.8409 44379.17295 51760.3813 PS 38:3; [M-H]-@6.39 1036683.056 1778924.037 924157.5769 413624.5718 814923.6029 775754.3251 638622.8635 422948.956 406815.3331 871454.978 713223.6853 611369.8845 953872.7832 561735.7872 1286710.323 1238876.745 421177.5649 453751.1702 555970.4313 677160.4435 1115902.031 2858540.721 1789480.584 637739.9209 PS 38:4; [M-H]-@6.00 796931.2756 1673382.885 448133.52 974619.9825 276189.9094 1690793.185 314007.1383 991390.3209 592989.5322 1606794.441 2124978.812 1617073.852 6298769.358 6079322.961 2759857.439 2747530.489 971233.7099 2800478.087 4843121.335 4290916.192 6496556.485 15178619.61 5805510.222 4318122.382 PS 38:5; [M-H]-@5.60 191760.8338 130482.3095 58295.86142 131202.7286 56421.70424 147908.4099 61718.12747 117437.8918 185235.0271 76567.76932 146800.1521 60822.38597 221319.418 162394.7679 70973.3207 130475.3699 63952.2401 148382.5177 146315.5595 153887.6286 241777.3028 587228.8655 214923.1715 175500.3196 PS 38:6; [M-H]-@5.37 15274.46563 22736.28398 18546.39478 53989.66919 20179.41256 51117.80747 25053.76727 15113.53333 28533.96069 12239.60632 19316.22465 17025.87404 80109.01336 48940.1272 18099.93273 69451.36397 13894.50048 14242.2781 18845.07269 32018.44467 55417.31468 128804.7127 46305.21748 15896.55233 PS 39:3; [M-H]-@6.65 35649.76391 121447.2081 38015.58922 15725.23794 7120.599973 21214.79563 5761.80999 9559.324676 9863.935654 23081.74976 32458.76154 13057.00581 109284.2402 111128.0424 86489.2487 42187.12276 28785.13486 35228.88787 41728.00467 38828.24531 83753.11788 151947.6633 85365.11398 40602.50187 PS 39:4; [M-H]-@6.30 241635.6652 690816.4481 327323.9499 22795.3151 1928.208486 192843.9794 3841.730574 64415.81204 71781.38336 132579.6346 195405.3292 133335.2327 515410.4764 414632.5139 469144.2832 432343.3276 189059.7282 380132.0618 255505.3561 238438.023 422477.3274 1256649.309 469387.6038 245386.9075 PS 40:4; [M-H]-@6.52 59341.80416 186767.3033 76728.8878 40606.17179 26518.90509 68461.21461 22425.17091 105980.3142 28523.8926 63551.63421 63829.39596 47961.5139 252463.3201 157551.3826 203433.1188 132173.3234 35576.42104 72641.81336 73344.59057 69691.00231 103067.5011 308530.3328 119113.613 111257.2749 PS 40:6; [M-H]-@5.98 380726.9222 1068211.133 325960.8168 1843719.485 438906.7173 2526342.11 676410.3297 526704.1977 730601.8244 1117553.368 1487961.485 1242377.133 9806548.479 3830896.033 1844645.267 1482750.66 191488.3748 321134.5532 3175253.834 2990151.054 6653747.98 4280368.096 2068270.013 544678.8668 PS 40:7; [M-H]-@5.44 28953.03797 50142.32078 29928.04057 108383.634 67586.08967 172187.7183 39907.31556 123798.318 80325.32275 29816.45938 41883.26677 20504.73692 162426.3717 151234.232 89702.94323 79931.23937 28083.24122 50291.48101 47826.59676 69937.0017 89709.88605 167202.1056 70487.29722 31812.77381 lysoPE 22:5; [M-H]-@1.56 8534.00473 8903.334105 2561.259765 18233.35245 21712.58188 19984.66723 14340.10294 25819.22625 32121.02223 4069.670048 7090.321319 6073.883455 5734.063587 2319.984093 10490.82262 17046.09049 5050.605941 4539.329293 9484.053598 6768.93054 13794.86884 16087.74552 4536.233402 1763.072767 lysoPE 24:1; [M-H]-@4.42 3896.921751 2824.654353 9011.264024 3338.375357 2226.929704 8802.459419 11099.49831 7512.9556 9368.979835 2156.699234 4777.679758 734.1802375 7404.262577 3303.463002 4119.534839 2812.7013 1345.098409 1984.87804 5338.030301 5197.465426 8625.967473 16814.70138 4067.581615 756.8865027 plasmenyl-PE 34:1; [M-H]-@7.16 513511.1641 766082.2658 588308.6569 181551.5474 127582.4372 296549.0628 127063.0937 60347.37276 95672.58182 285428.3866 672425.2968 394544.9446 254080.968 124900.0224 257319.1104 680092.4334 358807.2814 474283.2432 189146.6018 180840.9597 290978.0906 790974.2902 416841.5438 292345.6722 plasmenyl-PE 34:2; [M-H]-@6.71 301670.4547 719006.9169 276969.6838 54121.95016 115217.3827 79358.15625 62166.50879 41623.43349 31333.51821 149311.9712 134330.2642 184919.3401 54449.74307 22947.10203 90774.73848 589667.0668 194157.7285 173460.537 56433.29201 78568.33803 196314.4032 270988.7667 197723.8542 82837.55597 plasmenyl-PE 34:3; [M-H]-@6.54 18322.43695 81894.88001 26845.18619 6085.344559 3766.546189 6428.723191 3819.92531 9360.097962 7515.927274 20646.77598 11550.75503 16456.58773 22066.87057 17929.72187 32681.63703 44018.86052 18074.5608 17614.49312 16099.04882 21356.21389 17480.6201 108229.6705 37116.46329 19485.35232 plasmenyl-PE 36:0; [M-H]-@7.70 29285.2586 42313.25576 22334.39184 34510.07731 18469.89778 35323.10918 14835.54588 13675.78856 23642.41767 14507.72835 23079.2386 872.3988626 36349.35909 16604.80592 19769.12878 43219.95456 19616.43486 21337.7077 20591.01852 16431.99895 39299.71194 66881.12856 30623.56566 21789.1575 plasmenyl-PE 36:4; [M-H]-@6.67 190907.4222 418465.3803 190167.6702 216463.4144 315838.2071 336310.8671 118002.6117 248955.3369 224595.6804 259099.8636 351562.6454 313504.2553 873474.9961 379390.3653 405430.8989 810180.7634 251441.2702 372553.0857 795779.3821 518077.8752 751419.9052 1042835.241 522566.5674 237484.3408 plasmenyl-PE 36:5; [M-H]-@6.24 49532.31023 43287.32452 20613.55103 26601.67511 19988.99173 26077.41605 14771.56638 12321.40166 35707.8601 22264.39988 27578.58399 18397.13372 47057.70242 12674.10038 30947.99135 46773.67348 20983.9937 33304.90995 37640.60662 25606.48967 58935.86883 65136.37926 33812.57429 17501.12542 plasmenyl-PE 38:1; [M-H]-@8.20 364043.0416 412976.1587 188650.2238 111405.2168 74807.64401 91537.84854 79483.1058 67601.07204 116722.9804 143255.9448 273942.7124 166887.2893 386782.5936 181688.6646 149496.0396 315404.0284 129639.5276 179025.1886 214386.1366 174377.6936 355060.8401 480617.2632 270993.7761 132348.4504 plasmenyl-PE 38:3; [M-H]-@7.59 602278.7963 1472123.299 479480.3479 61356.75145 84941.49483 95446.33234 44268.43152 37333.1932 51114.28981 273550.545 379332.9211 273055.6013 922079.1623 468050.6289 692030.9391 910748.3547 385819.6336 506125.3263 427214.7795 310306.6455 737716.7457 2027868.424 1141969.278 466503.8919 plasmenyl-PE 38:4; [M-H]-@7.21 244530.3147 748182.6149 348799.1929 219378.5813 217513.6562 299125.2842 126105.8725 160047.3595 163024.8554 265953.5503 292102.477 274613.328 625863.7374 373595.4162 541122.8898 681300.0409 266726.1851 369660.4358 354100.9812 392702.517 647228.1254 1218549.666 632164.1291 261498.1507 plasmenyl-PE 38:5; [M-H]-@7.02 164434.052 217829.968 110699.0288 328284.4173 305092.9631 334256.3428 168478.8507 100376.1043 239256.7301 138723.1696 237200.5101 215962.2669 428446.7052 122073.4766 116437.7079 440933.1416 87605.96011 114291.4855 314298.7671 206783.3688 427991.2831 350119.1633 234434.8897 46968.15213 plasmenyl-PE 38:6; [M-H]-@6.61 84969.42991 102748.9127 63166.72217 171476.9204 144216.4635 185213.4207 91713.35637 154120.3394 164412.983 57453.74223 71123.32571 37257.64032 161020.6338 93114.04921 166903.538 152094.1268 89718.61756 100569.4846 170971.4432 140511.9739 196631.727 299821.6717 178580.1997 89543.81579 plasmenyl-PE 40:3; [M-H]-@8.10 567629.7985 2000306.895 608613.3345 230152.4565 238342.3162 201157.1287 106055.0246 30471.15054 95796.77894 470241.9329 868326.7967 760219.3322 1739904.929 675598.7208 463415.6894 1547948.591 270173.0169 265542.1021 758535.4373 663095.2706 1464978.329 1819306.442 872344.3326 190365.0192 plasmenyl-PE 40:6; [M-H]-@7.20 94462.44761 144215.0781 71630.5351 234252.0057 347098.9532 227097.9388 256673.3891 192777.2817 214764.2676 50269.8335 57013.63538 54569.94855 83166.15121 35638.61308 93615.59247 179468.4995 36742.50841 48658.1636 77419.55794 78067.0193 181003.8031 147279.6008 70422.03488 37802.34863 plasmenyl-PE 42:5; [M-H]-@7.99 36728.09506 138206.8992 42783.78575 97200.32529 91990.56314 126479.9873 41900.65597 51865.74018 67816.80772 56563.24532 50301.65385 66539.46305 197605.4789 139122.4881 109764.9652 155652.108 39086.51141 56671.67101 133657.1339 95257.71525 173877.3521 187506.6474 106814.7586 37119.46531 plasmenyl-PE 42:6; [M-H]-@7.72 73968.43386 97676.8636 45523.7019 173767.982 185499.2008 246541.8217 105911.6082 128093.9792 151531.3874 20600.57326 56211.18587 35914.69914 118430.2022 63659.51269 89496.14225 89309.64402 39822.01878 49249.06357 63162.8442 71494.39102 144174.3881 183575.8141 81789.14793 35294.32175 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 CL 64:4; [M-2H](2-)@8.72 8.72 CL 64:4 LipidBLAST CL 66:3; [M-2H](2-)@6.03 6.03 CL 66:4; [M-2H](2-)@9.00 9 CL 66:5; [M-2H](2-)@5.47 5.47 CL 66:5 LipidBLAST CL 68:2; [M-2H](2-)@9.63 9.63 CL(68:2) LipidMaps Bulk ID CL 68:3; [M-2H](2-)@9.45 9.45 CL(68:3) LipidMaps Bulk ID CL 68:4; [M-2H](2-)@9.26 9.26 CL(68:4) LipidMaps Bulk ID CL 68:5; [M-2H](2-)@9.04 9.04 CL 70:2; [M-2H](2-)@5.95 5.95 CL(70:2) LipidMaps Bulk ID CL 70:3; [M-2H](2-)@9.68 9.68 CL(70:3) LipidMaps Bulk ID CL 70:4; [M-2H](2-)@9.49 9.49 CL(70:4) LipidMaps Bulk ID CL 70:5; [M-2H](2-)@6.14 9.32 CL(70:5) LipidMaps Bulk ID CL 70:5; [M-2H](2-)@9.32 9.32 CL(70:5) LipidMaps Bulk ID CL 70:7; [M-2H](2-)@5.87 5.87 CL 70:7 LipidBLAST CL 72:3; [M-2H](2-)@7.55 7.55 CL(72:3) LipidMaps Bulk ID CL 72:4; [M-2H](2-)@9.70 9.7 CL(72:4) LipidMaps Bulk ID CL 72:5; [M-2H](2-)@9.55 9.55 CL(72:5) LipidMaps Bulk ID CL 72:6; [M-2H](2-)@9.37 9.37 CL(72:6) LipidMaps Bulk ID CL 74:11; [M-2H](2-)@5.63 5.63 CL 74:11 LipidBLAST CL 74:3; [M-2H](2-)@6.22 6.22 CL(74:3) LipidMaps Bulk ID CL 74:6; [M-2H](2-)@9.59 9.59 CL(74:6) LipidMaps Bulk ID CL 78:5; [M-2H](2-)@6.91 6.91 CL(78:5) LipidMaps Bulk ID CL 80:5; [M-2H](2-)@7.30 7.3 CL 80:5 LipidBLAST CerP 34:0; [M-H]-@6.05 6.05 5283582 FFA(16:0) FA(16:0) LipidMaps Bulk ID FFA(18:0) 5281 LMFA01010018 LipidMaps FFA(18:1) FA(18:1) LipidMaps Bulk ID FFA(18:2) FA(18:2) LipidMaps Bulk ID FFA(20:0) 10467 LMFA01010020 LipidMaps FFA(20:1) FA(20:1) LipidMaps Bulk ID FFA(20:2) FA(20:2) LipidMaps Bulk ID FFA(20:4) Arachidonic acid FA(20:4) LipidMaps Bulk ID FFA(22:0) 8215 LMFA01010022 LipidMaps FFA(22:1) FA(22:1) LipidMaps Bulk ID FFA(22:2) FA(22:2) LipidMaps Bulk ID FFA(22:3) FA(22:3) LipidMaps Bulk ID FFA(24:0) 11197 LMFA01010024 LipidMaps FFA(24:1) FA(24:1) LipidMaps Bulk ID FFA(24:2) FA(24:2) LipidMaps Bulk ID FFA(24:3) 52921854 LMFA01030902 LipidMaps N-(15Z-tetracosenoyl)-sphing-4-enine; [M-H]-@8.43 8.43 5283568 N-(15Z-tetracosenoyl)-sphinganine; [M-H]-@8.65 8.65 5283576 N-(17Z-hexacosenoyl)-sphing-4-enine; [M-H]-@8.92 8.92 5283569 N-(docosanoyl)-sphing-4-enine; [M-H]-@8.48 8.48 5283567 N-(docosanoyl)-sphinganine; [M-H]-@8.63 8.63 5283575 N-(eicosanoyl)-sphing-4-enine; [M-H]-@7.99 7.99 5283566 N-(eicosanoyl)-sphinganine; [M-H]-@8.16 8.16 5283574 N-(hexadecanoyl)-sphing-4-enine; [M-H]-@6.82 6.82 5283564 N-(hexadecanoyl)-sphinganine; [M-H]-@7.08 7.08 5283572 N-(octadecanoyl)-sphing-4-enine; [M-H]-@7.45 7.45 5283565 N-(octadecanoyl)-sphinganine; [M-H]-@7.65 7.65 5283573 N-(tetracosanoyl)-sphing-4-enine; [M-H]-@8.92 8.92 5283571 N-(tetracosanoyl)-sphinganine; [M-H]-@9.07 9.07 5283577 N-(tetradecanoyl)-sphing-4-enine; [M-H]-@6.22 6.22 5282310 N-(tetradecanoyl)-sphinganine; [M-H]-@6.45 6.45 10255824 PA 32:1; [M-H]-@6.06 6.06 PA(32:1) LipidMaps Bulk ID PA 34:1; [M-H]-@5.80 5.8 PA(34:1) LipidMaps Bulk ID PC 26:0; [M-Ac-H]-@4.45 4.45 PC(26:0) LipidMaps Bulk ID PC 28:0; [M-Ac-H]-@5.18 5.18 PC(28:0) LipidMaps Bulk ID PC 29:0; [M-Ac-H]-@5.49 5.49 PC(29:0) LipidMaps Bulk ID PC 30:0; [M-Ac-H]-@5.90 5.9 PC(30:0) LipidMaps Bulk ID PC 30:1; [M-Ac-H]-@5.39 5.39 PC(30:1) LipidMaps Bulk ID PC 30:2; [M-Ac-H]-@4.93 4.93 PC(30:2) LipidMaps Bulk ID PC 31:0; [M-Ac-H]-@6.15 6.15 PC(31:0) LipidMaps Bulk ID PC 31:1; [M-Ac-H]-@5.67 5.67 PC(31:1) LipidMaps Bulk ID PC 32:0; [M-Ac-H]-@6.50 6.5 PC(32:0) LipidMaps Bulk ID PC 32:1; [M-Ac-H]-@6.00 6 PC(32:1) LipidMaps Bulk ID PC 32:2; [M-Ac-H]-@5.63 5.63 PC(32:2) LipidMaps Bulk ID PC 32:3; [M-Ac-H]-@5.29 5.29 PC(32:3) LipidMaps Bulk ID PC 33:0; [M-Ac-H]-@6.74 6.74 PC(33:0) LipidMaps Bulk ID PC 33:1; [M-Ac-H]-@6.29 6.29 PC(33:1) LipidMaps Bulk ID PC 33:2; [M-Ac-H]-@5.92 5.92 PC(33:2) LipidMaps Bulk ID PC 34:1; [M-Ac-H]-@6.59 6.59 PC(34:1) LipidMaps Bulk ID PC 34:2; [M-Ac-H]-@6.29 6.29 PC(34:2) LipidMaps Bulk ID PC 34:3; [M-Ac-H]-@5.86 5.86 PC(34:3) LipidMaps Bulk ID PC 34:4; [M-Ac-H]-@5.49 5.49 PC(34:4) LipidMaps Bulk ID PC 35:0; [M-Ac-H]-@7.32 7.32 PC(35:0) LipidMaps Bulk ID PC 35:1; [M-Ac-H]-@7.01 7.01 PC(35:1) LipidMaps Bulk ID PC 35:2; [M-Ac-H]-@6.47 6.47 PC(35:2) LipidMaps Bulk ID PC 35:3; [M-Ac-H]-@6.26 6.26 PC(35:3) LipidMaps Bulk ID PC 35:4; [M-Ac-H]-@5.83 5.83 PC(35:4) LipidMaps Bulk ID PC 36:0; [M-Ac-H]-@7.69 7.69 PC(36:0) LipidMaps Bulk ID PC 36:1; [M-Ac-H]-@7.19 7.19 PC(36:1) LipidMaps Bulk ID PC 36:2; [M-Ac-H]-@6.75 6.75 PC(36:2) LipidMaps Bulk ID PC 36:3; [M-Ac-H]-@6.43 6.43 PC(36:3) LipidMaps Bulk ID PC 36:4; [M-Ac-H]-@6.11 6.11 PC(36:4) LipidMaps Bulk ID PC 36:5; [M-Ac-H]-@5.72 5.72 PC(36:5) LipidMaps Bulk ID PC 36:6; [M-Ac-H]-@5.38 5.38 PC(36:6) LipidMaps Bulk ID PC 37:1; [M-Ac-H]-@7.41 7.41 PC(37:1) LipidMaps Bulk ID PC 37:3; [M-Ac-H]-@6.83 6.83 PC(37:3) LipidMaps Bulk ID PC 37:4; [M-Ac-H]-@6.47 6.47 PC(37:4) LipidMaps Bulk ID PC 37:5; [M-Ac-H]-@6.04 6.04 PC(37:5) LipidMaps Bulk ID PC 38:1; [M-Ac-H]-@7.75 7.75 PC(38:1) LipidMaps Bulk ID PC 38:2; [M-Ac-H]-@7.29 7.29 PC(38:2) LipidMaps Bulk ID PC 38:3; [M-Ac-H]-@7.02 7.02 PC(38:3) LipidMaps Bulk ID PC 38:4; [M-Ac-H]-@6.65 6.65 PC(38:4) LipidMaps Bulk ID PC 38:5; [M-Ac-H]-@6.31 6.31 PC(38:5) LipidMaps Bulk ID PC 38:6; [M-Ac-H]-@6.02 6.02 PC(38:6) LipidMaps Bulk ID PC 38:7; [M-Ac-H]-@5.58 5.58 PC(38:7) LipidMaps Bulk ID PC 39:1; [M-Ac-H]-@8.06 8.06 PC(39:1) LipidMaps Bulk ID PC 39:3; [M-Ac-H]-@7.34 7.34 PC(39:3) LipidMaps Bulk ID PC 39:4; [M-Ac-H]-@7.08 7.08 PC(39:4) LipidMaps Bulk ID PC 39:5; [M-Ac-H]-@6.63 6.63 PC(39:5) LipidMaps Bulk ID PC 39:6; [M-Ac-H]-@6.31 6.31 PC(39:6) LipidMaps Bulk ID PC 39:7; [M-Ac-H]-@5.91 5.91 PC(39:7) LipidMaps Bulk ID PC 40:1; [M-Ac-H]-@8.22 8.22 PC(40:1) LipidMaps Bulk ID PC 40:2; [M-Ac-H]-@7.83 7.83 PC(40:2) LipidMaps Bulk ID PC 40:3; [M-Ac-H]-@7.50 7.5 PC(40:3) LipidMaps Bulk ID PC 40:4; [M-Ac-H]-@7.24 7.24 PC(40:4) LipidMaps Bulk ID PC 40:5; [M-Ac-H]-@6.94 6.94 PC(40:5) LipidMaps Bulk ID PC 40:6; [M-Ac-H]-@6.58 6.58 PC(40:6) LipidMaps Bulk ID PC 40:7; [M-Ac-H]-@6.19 6.19 PC(40:7) LipidMaps Bulk ID PC 40:8; [M-Ac-H]-@5.77 5.77 PC(40:8) LipidMaps Bulk ID PC 41:1; [M-Ac-H]-@8.34 8.34 PC(41:1) LipidMaps Bulk ID PC 41:2; [M-Ac-H]-@8.10 8.1 PC(41:2) LipidMaps Bulk ID PC 42:1; [M-Ac-H]-@8.69 8.69 PC(42:1) LipidMaps Bulk ID PC 42:10; [M-Ac-H]-@5.69 5.69 PC(42:10) LipidMaps Bulk ID PC 42:2; [M-Ac-H]-@8.30 8.3 PC(42:2) LipidMaps Bulk ID PC 42:3; [M-Ac-H]-@7.95 7.95 PC(42:3) LipidMaps Bulk ID PC 42:4; [M-Ac-H]-@7.73 7.73 PC(42:4) LipidMaps Bulk ID PC 42:5; [M-Ac-H]-@7.37 7.37 PC(42:5) LipidMaps Bulk ID PC 42:6; [M-Ac-H]-@7.13 7.13 PC(42:6) LipidMaps Bulk ID PC 42:7; [M-Ac-H]-@6.79 6.79 PC(42:7) LipidMaps Bulk ID PC 42:8; [M-Ac-H]-@6.45 6.45 PC(42:8) LipidMaps Bulk ID PC 42:9; [M-Ac-H]-@6.14 6.14 PC(42:9) LipidMaps Bulk ID PC 43:1; [M-Ac-H]-@9.02 9.02 PC(43:1) LipidMaps Bulk ID PC 43:2; [M-Ac-H]-@8.48 8.48 PC(43:2) LipidMaps Bulk ID PC 44:1; [M-Ac-H]-@9.14 9.14 PC(44:1) LipidMaps Bulk ID PC 44:2; [M-Ac-H]-@8.73 8.73 PC(44:2) LipidMaps Bulk ID PC 44:3; [M-Ac-H]-@8.47 8.47 PC(44:3) LipidMaps Bulk ID PC 44:4; [M-Ac-H]-@8.30 8.3 PC(44:4) LipidMaps Bulk ID PC 44:5; [M-Ac-H]-@7.94 7.94 PC(44:5) LipidMaps Bulk ID PC 44:6; [M-Ac-H]-@7.58 7.58 PC(44:6) LipidMaps Bulk ID PC 46:4; [M-Ac-H]-@8.70 8.7 PC 46:4 LipidBLAST PC 46:5; [M-Ac-H]-@8.32 8.32 PC 46:5 LipidBLAST PC 46:6; [M-Ac-H]-@7.99 7.99 PC 46:6 LipidBLAST PE 31:0; [M-H]-@6.29 6.29 PE(31:0) LipidMaps Bulk ID PE 31:1; [M-H]-@5.95 5.95 PE(31:1) LipidMaps Bulk ID PE 32:1; [M-H]-@6.20 6.2 PE(32:1) LipidMaps Bulk ID PE 32:2; [M-H]-@5.98 5.98 PE(32:2) LipidMaps Bulk ID PE 33:0; [M-H]-@6.91 6.91 PE(33:0) LipidMaps Bulk ID PE 33:1; [M-H]-@6.49 6.49 PE(33:1) LipidMaps Bulk ID PE 33:2; [M-H]-@5.99 5.99 PE(33:2) LipidMaps Bulk ID PE 34:3; [M-H]-@6.01 6.01 PE(34:3) LipidMaps Bulk ID PE 35:1; [M-H]-@7.03 7.03 PE(35:1) LipidMaps Bulk ID PE 35:4; [M-H]-@5.99 5.99 PE(35:4) LipidMaps Bulk ID PE 36:0; [M-H]-@7.83 7.83 PE(36:0) LipidMaps Bulk ID PE 36:6; [M-H]-@5.53 5.53 PE(36:6) LipidMaps Bulk ID PE 37:0; [M-H]-@7.98 7.98 PE(37:0) LipidMaps Bulk ID PE 37:1; [M-H]-@7.57 7.57 PE(37:1) LipidMaps Bulk ID PE 37:2; [M-H]-@7.24 7.24 PE(37:2) LipidMaps Bulk ID PE 37:3; [M-H]-@7.00 7 PE(37:3) LipidMaps Bulk ID PE 37:4; [M-H]-@6.64 6.64 PE(37:4) LipidMaps Bulk ID PE 38:0; [M-H]-@7.88 7.88 PE(38:0) LipidMaps Bulk ID PE 38:1; [M-H]-@7.87 7.87 PE(38:1) LipidMaps Bulk ID PE 38:4; [M-H]-@6.73 6.73 PE(38:4) LipidMaps Bulk ID PE 38:6; [M-H]-@6.12 6.12 PE(38:6) LipidMaps Bulk ID PE 39:1; [M-H]-@8.03 8.03 PE(39:1) LipidMaps Bulk ID PE 39:2; [M-H]-@7.69 7.69 PE(39:2) LipidMaps Bulk ID PE 39:3; [M-H]-@7.52 7.52 PE(39:3) LipidMaps Bulk ID PE 39:4; [M-H]-@7.14 7.14 PE(39:4) LipidMaps Bulk ID PE 39:6; [M-H]-@6.57 6.57 PE(39:6) LipidMaps Bulk ID PE 40:2; [M-H]-@7.94 7.94 PE(40:2) LipidMaps Bulk ID PE 40:4; [M-H]-@7.47 7.47 PE(40:4) LipidMaps Bulk ID PE 40:7; [M-H]-@6.40 6.4 PE(40:7) LipidMaps Bulk ID PE 40:8; [M-H]-@5.98 5.98 PE(40:8) LipidMaps Bulk ID PE 41:4; [M-H]-@7.73 7.73 PE(41:4) LipidMaps Bulk ID PE 41:6; [M-H]-@7.07 7.07 PE(41:6) LipidMaps Bulk ID PE 42:3; [M-H]-@8.25 8.25 PE(42:3) LipidMaps Bulk ID PE 42:4; [M-H]-@7.93 7.93 PE(42:4) LipidMaps Bulk ID PE 42:6; [M-H]-@7.24 7.24 PE(42:6) LipidMaps Bulk ID PE 42:8; [M-H]-@6.61 6.61 PE(42:8) LipidMaps Bulk ID PE 42:9; [M-H]-@6.29 6.29 PE(42:9) LipidMaps Bulk ID PE 44:1; [M-H]-@9.21 9.21 PE(44:1) LipidMaps Bulk ID PE 44:3; [M-H]-@8.69 8.69 PE(44:3) LipidMaps Bulk ID PE 44:4; [M-H]-@8.50 8.5 PE(44:4) LipidMaps Bulk ID PE 46:4; [M-H]-@8.83 8.83 PE 46:4 LipidBLAST PG 30:0; [M-H]-@5.24 5.24 PG(30:0) LipidMaps Bulk ID PG 32:0; [M-H]-@5.91 5.91 PG(32:0) LipidMaps Bulk ID PG 32:1; [M-H]-@5.25 5.25 PG(32:1) LipidMaps Bulk ID PG 32:2; [M-H]-@4.80 4.8 PG(32:2) LipidMaps Bulk ID PG 33:2; [M-H]-@4.82 4.82 PG(33:2) LipidMaps Bulk ID PG 34:1; [M-H]-@5.83 5.83 PG(34:1) LipidMaps Bulk ID PG 34:2; [M-H]-@5.29 5.29 PG(34:2) LipidMaps Bulk ID PG 34:3; [M-H]-@4.74 4.74 PG(34:3) LipidMaps Bulk ID PG 35:1; [M-H]-@6.27 6.27 PG(35:1) LipidMaps Bulk ID PG 35:2; [M-H]-@5.45 5.45 PG(35:2) LipidMaps Bulk ID PG 35:3; [M-H]-@5.08 5.08 PG(35:3) LipidMaps Bulk ID PG 36:1; [M-H]-@6.56 6.56 PG(36:1) LipidMaps Bulk ID PG 36:2; [M-H]-@5.99 5.99 PG(36:2) LipidMaps Bulk ID PG 36:3; [M-H]-@5.36 5.36 PG(36:3) LipidMaps Bulk ID PG 36:4; [M-H]-@5.03 5.03 PG(36:4) LipidMaps Bulk ID PG 36:5; [M-H]-@4.76 4.76 PG(36:5) LipidMaps Bulk ID PG 38:2; [M-H]-@6.30 6.3 PG(38:2) LipidMaps Bulk ID PG 38:3; [M-H]-@5.91 5.91 PG(38:3) LipidMaps Bulk ID PG 38:4; [M-H]-@6.07 6.07 PG(38:4) LipidMaps Bulk ID PG 38:5; [M-H]-@5.32 5.32 PG(38:5) LipidMaps Bulk ID PG 38:6; [M-H]-@5.00 5 PG(38:6) LipidMaps Bulk ID PG 38:7; [M-H]-@4.55 4.55 PG(38:7) LipidMaps Bulk ID PG 39:6; [M-H]-@5.30 5.3 PG(39:6) LipidMaps Bulk ID PG 39:7; [M-H]-@4.90 4.9 PG(39:7) LipidMaps Bulk ID PG 40:5; [M-H]-@5.94 5.94 PG(40:5) LipidMaps Bulk ID PG 40:6; [M-H]-@5.56 5.56 PG(40:6) LipidMaps Bulk ID PG 40:7; [M-H]-@5.18 5.18 PG(40:7) LipidMaps Bulk ID PG 40:8; [M-H]-@4.79 4.79 PG(40:8) LipidMaps Bulk ID PG 42:10; [M-H]-@4.76 4.76 PG(42:10) LipidMaps Bulk ID PG 42:5; [M-H]-@6.35 6.35 PG(42:5) LipidMaps Bulk ID PG 42:6; [M-H]-@6.08 6.08 PG(42:6) LipidMaps Bulk ID PG 42:7; [M-H]-@5.81 5.81 PG(42:7) LipidMaps Bulk ID PG 42:8; [M-H]-@5.36 5.36 PG(42:8) LipidMaps Bulk ID PG 42:9; [M-H]-@5.02 5.02 PG(42:9) LipidMaps Bulk ID PG 44:10; [M-H]-@5.43 5.43 PG(44:10) LipidMaps Bulk ID PG 44:11; [M-H]-@5.02 5.02 PG 44:11 LipidBLAST PG 44:8; [M-H]-@5.95 5.95 PG(44:8) LipidMaps Bulk ID PG 44:9; [M-H]-@5.68 5.68 PG 44:9 LipidBLAST PI 34:1; [M-H]-@5.82 5.82 PI(34:1) LipidMaps Bulk ID PI 34:2; [M-H]-@5.30 5.3 PI(34:2) LipidMaps Bulk ID PI 36:1; [M-H]-@6.43 6.43 PI(36:1) LipidMaps Bulk ID PI 36:2; [M-H]-@5.93 5.93 PI(36:2) LipidMaps Bulk ID PI 36:3; [M-H]-@5.75 5.75 PI(36:3) LipidMaps Bulk ID PI 36:4; [M-H]-@5.36 5.36 PI(36:4) LipidMaps Bulk ID PI 37:3; [M-H]-@6.04 6.04 PI(37:3) LipidMaps Bulk ID PI 38:3; [M-H]-@6.35 6.35 PI(38:3) LipidMaps Bulk ID PI 38:4; [M-H]-@5.89 5.89 PI(38:4) LipidMaps Bulk ID PI 38:5; [M-H]-@5.46 5.46 PI(38:5) LipidMaps Bulk ID PI 38:6; [M-H]-@5.17 5.17 PI(38:6) LipidMaps Bulk ID PI 40:3; [M-H]-@6.87 6.87 PI(40:3) LipidMaps Bulk ID PI 40:4; [M-H]-@6.37 6.37 PI(40:4) LipidMaps Bulk ID PI 40:5; [M-H]-@6.13 6.13 PI(40:5) LipidMaps Bulk ID PI 40:6; [M-H]-@5.89 5.89 PI(40:6) LipidMaps Bulk ID PI 40:7; [M-H]-@5.38 5.38 PI(40:7) LipidMaps Bulk ID PS 32:1; [M-H]-@5.29 5.29 PS(32:1) LipidMaps Bulk ID PS 34:1; [M-H]-@5.94 5.94 PS(34:1) LipidMaps Bulk ID PS 34:2; [M-H]-@5.43 5.43 PS(34:2) LipidMaps Bulk ID PS 36:1; [M-H]-@6.56 6.56 PS(36:1) LipidMaps Bulk ID PS 36:2; [M-H]-@6.02 6.02 PS(36:2) LipidMaps Bulk ID PS 36:3; [M-H]-@5.82 5.82 PS(36:3) LipidMaps Bulk ID PS 36:4; [M-H]-@5.44 5.44 PS(36:4) LipidMaps Bulk ID PS 38:3; [M-H]-@6.39 6.39 PS(38:3) LipidMaps Bulk ID PS 38:4; [M-H]-@6.00 6 PS(38:4) LipidMaps Bulk ID PS 38:5; [M-H]-@5.60 5.6 PS(38:5) LipidMaps Bulk ID PS 38:6; [M-H]-@5.37 5.37 PS(38:6) LipidMaps Bulk ID PS 39:3; [M-H]-@6.65 6.65 PS(39:3) LipidMaps Bulk ID PS 39:4; [M-H]-@6.30 6.3 PS(39:4) LipidMaps Bulk ID PS 40:4; [M-H]-@6.52 6.52 PS(40:4) LipidMaps Bulk ID PS 40:6; [M-H]-@5.98 5.98 PS(40:6) LipidMaps Bulk ID PS 40:7; [M-H]-@5.44 5.44 PS(40:7) LipidMaps Bulk ID lysoPE 22:5; [M-H]-@1.56 1.56 LPE(22:5) LipidMaps Bulk ID lysoPE 24:1; [M-H]-@4.42 4.42 LPE(24:1) LipidMaps Bulk ID plasmenyl-PE 34:1; [M-H]-@7.16 7.16 PE(P-34:1) LipidMaps Bulk ID plasmenyl-PE 34:2; [M-H]-@6.71 6.71 PE(P-34:2) LipidMaps Bulk ID plasmenyl-PE 34:3; [M-H]-@6.54 6.54 PE(P-34:3) LipidMaps Bulk ID plasmenyl-PE 36:0; [M-H]-@7.70 7.7 PE(P-36:0) LipidMaps Bulk ID plasmenyl-PE 36:4; [M-H]-@6.67 6.67 PE(P-36:4) LipidMaps Bulk ID plasmenyl-PE 36:5; [M-H]-@6.24 6.24 PE(P-36:5) LipidMaps Bulk ID plasmenyl-PE 38:1; [M-H]-@8.20 8.2 PE(P-38:1) LipidMaps Bulk ID plasmenyl-PE 38:3; [M-H]-@7.59 7.59 PE(P-38:3) LipidMaps Bulk ID plasmenyl-PE 38:4; [M-H]-@7.21 7.21 PE(P-38:4) LipidMaps Bulk ID plasmenyl-PE 38:5; [M-H]-@7.02 7.02 PE(P-38:5) LipidMaps Bulk ID plasmenyl-PE 38:6; [M-H]-@6.61 6.61 PE(P-38:6) LipidMaps Bulk ID plasmenyl-PE 40:3; [M-H]-@8.10 8.1 PE(P-40:3) LipidMaps Bulk ID plasmenyl-PE 40:6; [M-H]-@7.20 7.2 PE(P-40:6) LipidMaps Bulk ID plasmenyl-PE 42:5; [M-H]-@7.99 7.99 plasmenyl-PE 42:5 LipidBLAST plasmenyl-PE 42:6; [M-H]-@7.72 7.72 PE(P-42:6) LipidMaps Bulk ID METABOLITES_END #END