#METABOLOMICS WORKBENCH araskind_20170619_181749 DATATRACK_ID:1048 STUDY_ID:ST000744 ANALYSIS_ID:AN001165 PROJECT_ID:PR000537 VERSION 1 CREATED_ON July 3, 2017, 2:13 pm #PROJECT PR:PROJECT_TITLE Callaghan IWMC plasma baseline PR:PROJECT_TYPE MS analysis PR:PROJECT_SUMMARY Obesity study with intervention PR:INSTITUTE University of Michigan PR:DEPARTMENT Neurology PR:LABORATORY Feldman Lab PR:LAST_NAME Feldman PR:FIRST_NAME Eva PR:ADDRESS Ann Arbor, MI PR:EMAIL efeldman@umich.edu PR:PHONE 734-763-7274 #STUDY ST:STUDY_TITLE Metabolomics of intensive weight management clinic (IWMC) weight loss ST:STUDY_TYPE MS analysis ST:STUDY_SUMMARY Human patients were enrolled in a weight loss clinic and followed. Patients were ST:STUDY_SUMMARY male and female, normoglycemic,pre-diabetic and diabetic and with and without ST:STUDY_SUMMARY neuropathy. 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 7 ST:TOTAL_SUBJECTS 3 #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 SU0016136 S00025582 Gender:male | Glycemic status:Normoglycemic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016137 S00025583 Gender:female | Glycemic status:Diabetic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016136 S00025584 Gender:male | Glycemic status:Normoglycemic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025585 Gender:female | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025586 Gender:female | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016136 S00025587 Gender:male | Glycemic status:Normoglycemic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016137 S00025588 Gender:male | Glycemic status:Diabetic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016137 S00025589 Gender:male | Glycemic status:Diabetic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025590 Gender:male | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025591 Gender:female | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025592 Gender:female | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016136 S00025593 Gender:male | Glycemic status:Normoglycemic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016137 S00025594 Gender:male | Glycemic status:Diabetic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025595 Gender:female | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025596 Gender:female | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016137 S00025597 Gender:female | Glycemic status:Diabetic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016137 S00025598 Gender:male | Glycemic status:Diabetic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025599 Gender:female | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016137 S00025600 Gender:female | Glycemic status:Diabetic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025601 Gender:female | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016137 S00025602 Gender:male | Glycemic status:Diabetic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016137 S00025603 Gender:female | Glycemic status:Diabetic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016137 S00025604 Gender:male | Glycemic status:Diabetic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025605 Gender:male | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025606 Gender:male | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy SUBJECT_SAMPLE_FACTORS SU0016138 S00025607 Gender:male | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy #COLLECTION CO:COLLECTION_SUMMARY - #TREATMENT TR:TREATMENT_SUMMARY - #SAMPLEPREP SP:SAMPLEPREP_SUMMARY - SP:SAMPLEPREP_PROTOCOL_FILENAME A003 - Untargeted Metabolomics.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 S00025582 S00025583 S00025584 S00025585 S00025586 S00025587 S00025588 S00025589 S00025590 S00025591 S00025592 S00025593 S00025594 S00025595 S00025596 S00025597 S00025598 S00025599 S00025600 S00025601 S00025602 S00025603 S00025604 S00025605 S00025606 S00025607 Factors Gender:male | Glycemic status:Normoglycemic | Neuropathy:Neuropathy Gender:female | Glycemic status:Diabetic | Neuropathy:no neuropathy Gender:male | Glycemic status:Normoglycemic | Neuropathy:no neuropathy Gender:female | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy Gender:female | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy Gender:male | Glycemic status:Normoglycemic | Neuropathy:Neuropathy Gender:male | Glycemic status:Diabetic | Neuropathy:Neuropathy Gender:male | Glycemic status:Diabetic | Neuropathy:no neuropathy Gender:male | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy Gender:female | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy Gender:female | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy Gender:male | Glycemic status:Normoglycemic | Neuropathy:no neuropathy Gender:male | Glycemic status:Diabetic | Neuropathy:no neuropathy Gender:female | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy Gender:female | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy Gender:female | Glycemic status:Diabetic | Neuropathy:Neuropathy Gender:male | Glycemic status:Diabetic | Neuropathy:Neuropathy Gender:female | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy Gender:female | Glycemic status:Diabetic | Neuropathy:no neuropathy Gender:female | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy Gender:male | Glycemic status:Diabetic | Neuropathy:no neuropathy Gender:female | Glycemic status:Diabetic | Neuropathy:Neuropathy Gender:male | Glycemic status:Diabetic | Neuropathy:Neuropathy Gender:male | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy Gender:male | Glycemic status:Pre-diabetic | Neuropathy:no neuropathy Gender:male | Glycemic status:Pre-diabetic | Neuropathy:Neuropathy CerP 32:1; [M-H]-@5.11 7836.617914 9868.285128 14462.91984 12979.70831 10897.54847 6694.720364 10572.98658 7332.069838 8823.402931 8963.767989 21312.27938 8873.965252 15872.17179 9640.497926 11510.34787 4636.885521 12584.34113 15287.48137 8369.675661 11433.24315 6074.096988 12315.17733 16216.66255 8425.112725 7102.82088 5655.589877 CerP 34:1; [M-H]-@5.83 65760.02211 37821.48133 44722.06364 38995.54122 27926.56162 19446.01574 32109.99127 24915.93322 61011.49687 38108.48786 49751.40319 28176.47416 31768.81515 24794.10513 31271.50505 27138.17974 29333.92213 43012.7334 28943.84012 36877.46988 38351.77331 37167.11987 28863.73963 54760.16612 32091.8944 35906.60599 CerP 34:2; [M-H]-@5.29 22303.68372 24186.77201 26760.26036 12797.00138 15219.11673 15149.51414 25086.16742 6594.269759 28909.67357 22003.19115 21311.32708 18052.80581 27312.57052 24990.8457 22304.75677 19665.14835 13761.93251 33920.73304 18344.92967 29486.20268 8104.347323 21164.23237 22079.206 20743.32881 15963.29425 21849.10945 FFA(16:0) 92609890.74 65594617.53 82817214.75 66490098.71 57642707.19 62547477.54 70312312.75 52475107.86 78773770.88 68653574.19 88109110.1 70415024.34 93366141.98 77047326.96 75858421.46 72014189.74 67375375.99 71087926.38 64608452.58 82115729.06 65507583.94 74216674.93 74767452.98 74316521.22 56438887.32 78926286.78 FFA(18:0) 90767170.35 59016090.92 76082651.91 61083355.59 57463980.05 53685945.54 64904722.18 50899537.64 76371324.84 61849354.81 90049912.35 64211882.34 80164558.83 67655076.06 66622103.14 66968818.21 63690724.66 66759663.32 62465302.73 75708545.47 65587474.16 67199055.82 63595977.17 65809557.54 56904870.37 72947186.59 FFA(18:1) 83087119.8 66058071.28 76668274.66 59502885.82 52474637.35 64410287.57 77726131.29 56630808.44 81647749.29 63877940.95 83501472.71 69650214.96 92723770.75 89974142.77 89755442.69 68457332.78 62619328.16 72194022.58 61076433.58 68929515.25 67619230.93 66559717.42 85144751.21 68903941.41 50642268.92 96416713.21 FFA(18:2) 44007815.09 35964086.63 39458245.92 31523590.84 40008049.21 37830462.54 46231127.1 29424375.73 44376298.37 38494982.47 47601349.18 55989105.58 52687814.98 57441412.72 64846601.93 40403265.34 32627335.04 31051489.87 29950694.4 36537740.99 37879101.16 28720595.55 42136163.04 40938280.12 25180170.05 57012248.63 FFA(20:0) 2254875.219 1435088.336 2153205.612 1524562.498 1753314.142 1426226.892 1800531.409 1287059.379 1973226.129 1643206.613 2640374.835 1862722.957 2208571.431 1857516.812 1750936.711 1894379.103 1771683.183 1801689.336 1643600.785 2084595.599 1873669.61 1668335.55 1634510.196 1695472.604 1582305.064 2171818.443 FFA(20:1) 1465219.167 1315992.776 1565851.637 825916.8153 955293.4113 1443144.807 2794806.143 1289219.878 1717689.413 957308.5553 1432560.244 1128831.798 2235990.949 2416186.505 1407677.911 1518660.705 1287320.884 1418602.625 1337645.328 1411371.521 1818957.939 1271111.589 2324579.463 1532676.731 976786.6654 2700857.963 FFA(20:2) 1039901.948 978624.0336 1196813.543 618074.2009 1011708.591 1119052.948 1675063.642 882911.9406 1263047.785 903948.3589 1325201.715 1192788.452 1547603.148 1795424.909 1310017.238 1112447.346 1184667.525 934781.9292 979874.2063 1129963.374 1274611.075 913174.3381 1633492.909 1140404.666 598858.9516 1737122.42 FFA(20:4) Arachidonic acid 2368557.45 1898595.141 2934802.565 2268692.524 1881207.377 2719263.7 4009476.441 1701764.645 5119812.949 2086249.208 3091770.928 4597046.864 3745624.245 4582698.261 2567446.26 2579649.285 4041803.254 2448858.106 1783376.363 1977598.978 2472877.797 2095800.306 3738611.278 2577101.664 1528703.338 3259725.974 FFA(22:0) 440306.8037 420355.4084 537269.4021 425076.8872 452362.1917 377327.0172 725249.4421 370520.655 565398.0008 418137.9181 514804.8663 444416.4873 615987.3891 618198.5703 410528.4021 835698.0129 397584.9069 396012.2802 566860.0122 529580.4246 487603.7368 469951.7421 502901.3237 415111.7097 462400.5079 434383.94 FFA(22:1) 266415.7484 131456.6692 233509.3197 172689.1769 127868.6028 178649.0442 632838.903 178177.4895 372646.5397 126860.1681 262711.6343 187585.9455 292527.1081 371703.7712 225083.335 144093.5914 161892.4263 168457.5745 140261.3557 139733.8563 129665.4772 186028.8674 263003.0502 241967.1862 151125.2313 245211.4682 FFA(22:2) 45068.09921 53230.53179 65901.50857 63051.74217 37163.21307 50593.15003 94441.56607 57424.25222 78592.24187 56634.85626 71536.33736 56319.73356 93550.92472 75251.3641 73410.24328 55941.69449 66928.06073 42724.08352 65066.82193 74141.67238 61041.83609 66372.55379 100103.1681 76730.15352 31353.38509 72707.52327 FFA(22:3) 74562.72458 66165.52073 72302.07716 67433.67051 42995.58298 68271.16296 90445.72188 40071.09604 109358.0464 42513.85618 80406.34247 74052.8865 142563.5731 128018.0087 71816.15579 90375.43451 87223.02397 78026.42583 48602.42582 107965.9451 86808.00011 90621.65546 115275.1158 78486.45899 46966.89223 91172.42909 FFA(24:0) 292785.2833 313321.8197 228475.4487 332930.3933 308034.9367 169781.9494 419166.1388 221011.5163 415370.108 248146.8564 261856.0174 265526.0128 488487.5792 470000.6994 152217.6785 592282.7323 252788.6568 240151.1492 238918.2797 313193.9109 230895.523 403057.9494 366319.4071 337050.7757 238841.9078 274431.6831 FFA(24:1) 465037.8903 242085.8546 359873.2766 183371.6103 197421.4668 281449.4545 512104.4877 248367.3823 392342.214 213996.3774 362767.0924 197673.1389 395018.8599 382835.7214 253271.019 274533.4256 215438.1302 264571.834 190194.2256 322270.6881 219053.4493 274893.4902 448467.1614 319632.5638 188733.6479 379265.1486 FFA(24:2) 381855.1465 109125.7746 133575.3297 37844.25868 72094.56671 52003.61007 101234.6026 53321.39865 131204.0988 51984.19969 94235.36656 65334.48056 159110.335 92735.23212 79605.81987 82376.78806 47818.12075 90990.85819 72761.14257 79035.38201 102115.1013 96709.16347 131750.133 124352.1792 54253.44258 110072.1053 FFA(24:3) 11455.51638 8747.997906 9090.040969 4913.827011 11728.91952 6506.811944 10138.18951 10706.5878 25301.92194 10516.27871 16060.50386 13469.18238 30743.53549 17425.07205 11918.4029 9375.089341 11010.29267 8965.300566 5225.331382 9987.914397 12632.62729 15384.58096 17410.98152 17574.71135 6487.107174 14432.85119 N-(15Z-tetracosenoyl)-sphing-4-enine; [M-H]-@8.46 49115.09529 46196.07522 51178.30091 34551.37158 40160.93517 37792.78306 73945.19756 39741.29721 80216.15978 51305.64448 51642.73663 33103.00048 52375.35333 53212.31083 52291.58176 22198.41102 33291.46507 48148.37506 35984.52203 79877.7596 23225.86088 39386.21559 86450.27488 59436.97565 33224.70592 56369.80195 N-(hexadecanoyl)-sphing-4-enine; [M-H]-@6.83 26883.74603 33332.06146 13515.52336 11934.11429 29017.24935 17647.22582 18542.52701 17910.27787 14459.66234 18770.08892 27874.88005 22997.59723 8526.403832 18062.26349 15264.09102 16056.1609 24951.68817 29409.08863 18053.27023 5799.941754 26135.42703 13861.08907 14888.44952 24473.60321 17470.95539 33636.51973 N-(tetracosanoyl)-sphing-4-enine; [M-H]-@8.90 83564.27847 100485.0323 84109.66618 85610.81483 86237.3851 42459.99982 103626.9033 96682.04183 150215.6382 72532.07411 132189.3884 73161.01358 123165.1553 89771.48912 48798.0099 83557.11508 60479.34321 94179.88404 72960.28326 84830.56609 71077.25473 95243.79593 135099.484 131344.527 78692.61911 113808.9134 PA 34:2; [M-H]-@6.26 25786.21365 36813.30143 17608.72174 13117.94523 26474.837 7363.309449 20664.87433 19258.74932 16539.79312 14462.58198 24537.92284 21737.58244 15032.50741 23186.63191 12150.42771 22323.6601 11235.32956 22418.71089 26711.04797 11047.6553 19937.08485 13498.14619 28471.0032 23402.74884 15614.93734 12750.64444 PC 30:1; [M-Ac-H]-@5.42 31376.63567 44523.3114 49544.73627 21935.97698 25336.10667 15769.17425 25641.04558 15443.33015 43961.89658 60761.88482 65733.6091 32866.48255 48733.29908 47752.8555 19897.75652 44533.39535 28502.5525 43798.91697 58505.42399 91852.73159 21010.10317 44161.49981 65980.06065 26851.80455 26031.48606 20534.15975 PC 32:0; [M-Ac-H]-@6.62 262965.7566 276017.2622 349145.8687 230754.2728 201366.6643 257043.4588 242601.8895 227557.7095 335347.6723 238228.8584 491111.6207 257871.4958 495166.0857 272010.3916 201925.6865 348552.6958 258697.2498 285523.5614 209559.9277 544197.8195 205403.0098 344954.0959 389855.3362 387099.0471 174350.6445 293385.58 PC 32:1; [M-Ac-H]-@6.10 324258.0837 399586.6234 359287.0117 213070.6519 191972.7106 107942.045 217686.294 318037.0616 494779.2521 458216.4557 588346.5256 232016.6653 563419.6918 309507.851 234904.3005 344262.9545 396441.7879 410594.278 399769.9097 892742.8629 218160.2765 588769.2677 627245.8642 344438.1565 142413.3371 222487.3654 PC 32:2; [M-Ac-H]-@5.59 263114.5059 276655.3141 292033.9037 136527.3307 286655.0356 73456.15554 196309.8961 160485.4318 296162.1765 380546.4952 445068.0065 250741.5383 254353.7259 264850.2837 146395.7383 254735.8806 182016.0898 279998.4817 278046.0114 522737.4523 146781.9693 265425.9677 367464.9644 217649.8781 90544.6921 185407.3859 PC 33:1; [M-Ac-H]-@6.43 177185.7366 181397.4274 115048.4116 85517.89378 74194.97589 70862.70114 109863.5336 121061.7281 117737.8385 97711.90315 162440.0849 83158.93746 126725.7552 103949.0958 91473.36481 187947.5508 101730.6337 135940.1178 118372.5108 144831.5978 92142.45408 141979.8463 148330.8524 107628.1778 69426.85084 98949.87458 PC 33:2; [M-Ac-H]-@5.98 394409.0779 484463.9652 303412.9505 157551.742 309610.0738 158361.1672 329872.2929 235618.1142 290996.8981 298207.7719 507617.2613 279150.3577 321864.0752 257640.0081 288971.335 280839.4352 200908.6406 354888.1248 285641.599 216224.5242 263524.8926 325652.3367 350431.1405 413582.6015 211695.4339 363824.5829 PC 34:1; [M-Ac-H]-@6.65 2403116.145 3110147.95 3116618.002 2046948.783 2024896.293 1585685.74 3556584.009 2832213.772 3353861.573 2139505.266 3840517.035 1883362.533 2766894.13 2902548.722 2350505.881 2668189.98 2254363.241 2701936.371 3272499.474 4691884.496 1982830.445 3468587.954 4560280.905 2672819.708 1767794.7 2394304.876 PC 34:2; [M-Ac-H]-@6.21 6900422.619 8610648.602 6220627.933 2886899.852 6443451.892 3086376.401 6707916.291 4710361.99 6466929.714 5937483.741 10112363.59 5641681.647 7158905.725 5001139.82 5878070.625 6395849.342 4238338.533 6525182.872 6124556.18 8006817.946 4454730.556 6754676.673 8215109.041 8084775.84 3991641.629 6104946.988 PC 34:3; [M-Ac-H]-@5.76 728126.8992 630419.3365 691835.9077 456319.7581 643826.2854 214426.8164 557795.2716 396032.4776 763309.4253 709407.2476 1050131.479 530174.5237 638852.8867 582518.7291 563154.1962 535847.8643 402262.39 692891.0264 550853.2239 1009028.467 393921.3932 551618.0884 813508.1028 562936.4834 286618.2799 515930.7995 PC 34:4; [M-Ac-H]-@5.53 70094.14891 88786.21332 137585.9286 97368.19611 98408.66625 38065.51387 112200.1019 61496.75051 134193.5035 149093.4298 156113.5326 125673.3456 118112.8032 153505.9759 54473.68342 120151.1778 120961.7668 175968.6051 82296.29192 269099.8229 72153.25928 104038.1326 156676.6183 88367.6372 62799.81207 77868.23093 PC 34:5; [M-Ac-H]-@5.14 6621.431805 1438.985027 23777.49807 8069.956139 6558.48777 6423.494709 11365.15142 5149.956973 12440.70084 8845.416383 15227.2277 12722.93546 10589.33425 16357.61347 8647.849535 4282.306989 3066.207148 14427.50128 4420.147983 13487.52727 2425.824609 14620.46502 19322.33863 13227.03775 32.04637328 9488.988729 PC 35:1; [M-Ac-H]-@7.04 76297.63271 67443.22534 111942.1747 53545.10506 56097.55664 49741.17253 111040.7027 55307.56304 94171.10578 52620.03906 82252.15558 43494.12045 60081.99902 92901.84777 71712.48358 62303.01211 60940.39653 94300.39966 156941.4871 76512.91545 104721.3594 64193.23872 97250.35839 64871.15838 58628.82848 72235.41558 PC 35:2; [M-Ac-H]-@6.56 240565.4315 208486.8051 243027.8525 104702.195 183045.1334 102546.6767 204929.8253 102028.5463 265376.975 151290.7299 257575.2564 134005.0454 155551.0761 180203.793 191853.3727 141578.8138 112755.7707 208742.6196 172375.8973 169568.2829 161202.7647 159768.6703 195195.6714 173974.5511 138632.842 186554.9759 PC 35:3; [M-Ac-H]-@6.10 110546.5754 188506.1699 52674.92829 114564.918 96655.59559 116656.8133 112989.0327 48023.85671 94576.59617 56025.52846 345714.3912 153935.6986 82205.20328 172315.4378 150373.472 148750.0785 151885.4458 122419.5231 37005.28501 34149.83157 268918.6256 111465.1459 45264.64311 125243.7946 198768.083 121701.2997 PC 35:5; [M-Ac-H]-@5.51 29147.21414 20451.01664 62336.24737 25540.83649 7327.522463 39808.97866 35380.59808 4146.191779 46956.96695 35524.51788 45770.41907 8988.190865 16021.14609 66231.75127 27307.243 17433.32474 32829.41225 38582.5207 24003.48471 52449.81332 20204.71975 46788.06168 38706.92595 26207.93327 20569.72768 20841.07026 PC 36:1; [M-Ac-H]-@7.27 1048666.523 1135970.613 1442099.532 1044792.074 884209.1697 647171.2119 1597556.13 958158.3122 1493825.888 921119.796 1657500.085 848853.3667 1333722.758 1549159.777 1073958.828 990079.7267 863357.5735 1087486.32 1575880.249 1673996.955 683157.3114 1371263.943 1382683.922 820496.388 667586.0523 852258.1539 PC 36:2; [M-Ac-H]-@6.85 3893673.783 3946252.479 3538555.711 2105303.691 3688023.578 1655125.542 3910565.546 2386138.396 3537006.314 3044369.586 5486430.893 2993892.236 3863896.08 3959437.417 2906680.389 2950404.724 2187982.641 3140178.849 3633590.707 3507484.45 2282976.713 3191059.816 3852307.9 3106742.617 2087165.079 2885278.62 PC 36:3; [M-Ac-H]-@6.40 3192538.927 2583831.92 2909736.962 2004184.602 2439673.049 1024289.816 2510988.862 1457216.762 3344190.814 2308068.775 4038035.761 1880408.955 2843200.076 2392204.759 2165100.407 2397916.732 1880255.671 2626432.881 2099745.451 4528493.732 1651755.845 2807300.898 3274594.066 2542344.219 1693043.381 2536531.01 PC 36:4; [M-Ac-H]-@6.09 2137951.552 1617170.497 2754113.209 3016243.937 2153437.974 1820976.891 3372953.174 1625027.895 3837183.534 2934399.158 4735265.168 2353156.251 3901734.526 3479840.297 2151503.607 2386617.639 3137616.475 4044905.343 2183812.782 4542207.241 2464209.256 2198796.322 3280997.828 3853520.024 2280755.857 3288938.282 PC 36:5; [M-Ac-H]-@5.68 326430.9257 273625.5349 1130589.72 396285.1712 344165.7099 766253.6218 531325.7066 329858.0637 598544.167 633580.7899 806102.3803 725213.1935 1152318.267 798928.3631 536712.7057 407488.491 423987.9921 736679.7021 419439.8655 824640.8802 334845.4925 569793.673 692906.2711 555252.1977 287008.8409 384993.9098 PC 36:6; [M-Ac-H]-@5.48 32237.75286 22746.74424 97205.64945 37643.54367 43201.3432 30837.14738 46964.35312 23404.68666 45969.5262 59140.37617 80365.17511 84987.63629 66310.83596 91266.26518 45162.43082 34767.73441 26329.8242 55008.40647 27354.22346 94817.18254 16839.41755 33650.38954 58950.07769 34374.07024 16056.24598 31579.1349 PC 37:2; [M-Ac-H]-@7.22 60644.90701 75534.7855 54634.39753 37811.55069 76236.78261 47028.99392 46062.96746 27984.99191 23959.69916 47925.73062 99113.65945 55906.45385 24387.38061 65681.93541 45284.81805 22171.16825 51155.47504 64245.48201 40860.05196 13680.71206 57624.65631 29077.66266 47435.14474 35630.9362 56362.83183 72724.60803 PC 37:4; [M-Ac-H]-@6.51 82589.92746 192192.8529 124827.9621 206686.642 169757.9919 128005.6008 131754.2824 70966.78245 73155.20847 93904.84947 179748.3837 121447.4746 60509.4723 160402.4475 89050.88705 73077.72465 148142.064 132488.5216 73129.37808 40633.54229 205123.0802 81491.25974 83412.40063 106855.5919 138639.7558 143539.3888 PC 37:6; [M-Ac-H]-@5.79 69386.34139 63555.42227 142449.8742 98952.47731 105865.3551 76102.97918 123020.6026 94824.54346 124911.9616 103100.4961 124296.5459 89905.78108 133323.9616 150767.7029 86839.84337 109559.5909 64380.97783 103168.6574 90986.93238 223333.4192 74354.98206 64820.8904 141449.5507 131373.9853 91513.12173 129583.281 PC 38:2; [M-Ac-H]-@7.45 217664.686 165440.1362 178569.0804 130547.6215 154747.2121 75011.65656 157833.514 119360.1591 179765.7857 126477.2819 276504.19 134239.0686 208987.7132 176928.9607 124613.1735 165797.4331 120810.2923 146772.6903 140117.6633 255522.2117 95427.24424 150592.2222 145115.2544 125467.1287 99570.79085 145187.0052 PC 38:3; [M-Ac-H]-@7.08 1240266.001 1039854.155 1483050.382 1304307.495 824609.1312 425541.9733 1205902.878 499952.6501 1251037.35 805034.5716 1274635.513 742160.3747 1128802.523 908063.7139 775469.5471 969511.7329 717666.807 995868.164 934648.4885 1882798.488 465389.7693 1054615.704 1104103.298 698427.6841 487879.1984 1046365.856 PC 38:4; [M-Ac-H]-@6.73 1373898.809 1188874.393 1745218.301 2376484.753 1519499.203 1316246.357 2326178.674 1124241.486 2223922.887 1922777.685 2703972.897 1489567.413 2329907.601 3316656.16 1538898.091 1520183.753 2003658.189 1719725.242 1301290.77 2377969.703 1487986.311 1459079.531 1668230.256 1677922.584 1418541.028 1643113.678 PC 38:5; [M-Ac-H]-@6.37 912051.1467 569627.5987 1286602.065 907515.7928 697228.2116 734151.9928 932337.4531 579685.8375 1256069.596 981343.3398 1642397.564 869717.1271 1310130.211 1260829.835 856193.118 634977.1494 833923.0583 900002.6036 638096.8725 1154803.717 650481.6192 750581.2308 1062555.958 1016038.101 695293.3189 919722.0959 PC 38:6; [M-Ac-H]-@6.01 1098429.749 745840.5464 1878560.135 1085711.842 1159768.52 1101643.816 1590061.153 889047.2182 1369328.804 1065410.927 1637626.013 1425888.703 2016115.051 1561897.344 1242074.954 979175.9587 1074174.715 945982.8386 816115.9268 1815188.036 987109.9284 862015.6163 1399384.19 1182229.169 1061980.823 1397010.683 PC 38:7; [M-Ac-H]-@5.51 79414.09718 64546.86311 135326.8437 67387.59145 70625.68652 61553.73434 80409.36406 51041.19719 76764.75394 80004.4866 128231.5819 74295.163 113307.2261 98107.53066 83127.93823 67959.8891 51095.43808 73874.26317 67321.96087 103294.7229 37953.54096 59648.7236 84029.8545 71802.12822 31689.99166 74266.25634 PC 39:5; [M-Ac-H]-@6.61 32554.07155 16425.65238 58039.00381 30602.15634 22171.17328 24337.18572 30654.8984 9340.658741 18892.21176 47954.14207 47479.96642 24172.55325 16675.43947 37251.66182 28158.73596 7368.182055 36732.85916 15242.19639 26975.35124 32137.59907 24015.53816 30613.70535 27482.86426 39773.36078 17922.74023 17142.72248 PC 39:6; [M-Ac-H]-@6.40 32006.32897 10754.32252 35948.28861 40052.67324 21474.10476 24842.99761 27209.50508 17417.38607 24636.55288 16449.50855 26385.65352 19662.74522 34416.60603 38683.86674 40141.86364 21222.84375 35179.61141 23203.82463 19986.00842 19506.09321 18973.18282 18732.01772 29442.77671 14364.12266 21740.30572 22037.60504 PC 40:3; [M-Ac-H]-@7.51 30214.03621 12866.62121 25882.23241 37240.51415 28251.76898 14640.38282 41274.85096 23388.41684 34870.64453 22570.89986 25823.74618 19900.82242 25557.52643 12721.54986 11938.94123 25088.71082 17905.56306 15812.18413 13575.81959 59263.93805 14693.72357 15539.71467 18339.27641 26798.04548 26977.5976 36320.33622 PC 40:4; [M-Ac-H]-@7.31 102760.5297 173484.4099 159943.0496 147302.5139 132883.6314 81527.77946 211911.8213 99222.04347 227086.6483 209024.5645 190014.8148 109814.4041 176265.3819 156378.024 97301.21687 125693.0757 174994.9203 167139.6554 136508.4926 210178.1893 84528.91788 181182.7386 195369.3602 139180.49 105750.8443 121033.2034 PC 40:5; [M-Ac-H]-@7.06 131091.7539 186806.0313 225488.8079 204250.8767 147441.2129 130960.6126 310116.6789 186304.6513 237635.4487 211295.9275 235654.0694 158476.0743 257417.0402 204892.5972 160498.2764 165608.9025 195633.866 186206.969 206431.78 281075.7988 125110.0638 210396.6239 262142.7581 195557.8392 161600.903 150391.7937 PC 40:6; [M-Ac-H]-@6.69 196543.7231 140374.8712 526519.6225 380555.3014 271309.8972 297815.0226 458744.3584 227723.5838 350658.9646 263662.7807 302951.5263 357830.5567 517965.5547 544351.2129 332595.6119 280164.2232 263871.9945 173414.4901 236890.3087 435927.7712 188966.7865 175219.2355 344852.8999 299746.6484 227794.8875 326225.5277 PC 40:7; [M-Ac-H]-@6.22 63203.00401 49576.90261 97006.81106 78941.41141 74859.71996 48376.38926 73405.81343 67100.3088 105283.8518 77231.71393 106155.7633 69950.43182 74068.51956 110870.8995 86006.88156 50852.93797 56939.98331 68616.92519 68265.11439 79356.70811 45653.76919 55573.21017 100488.6209 76361.34766 66746.75485 92971.06653 PC 40:8; [M-Ac-H]-@5.79 87836.08848 159189.8622 146959.529 91753.84284 108359.5333 38893.9599 92456.39659 70933.05478 208278.3464 82870.31862 125927.9798 82690.69204 170122.0485 105506.129 76174.40909 71765.71956 66601.46574 115239.3465 103740.3452 92266.99484 85978.32256 154448.0402 116836.9124 172758.6389 85179.04209 136313.1054 PC 42:10; [M-Ac-H]-@5.71 19021.38383 80451.18187 46281.85022 51221.11578 43341.78789 40818.66615 82885.46088 103798.9927 97616.65264 80997.66339 54525.82542 65299.88251 58729.25091 81089.05798 34403.43198 71064.1443 81476.71594 92856.05771 55446.44506 132344.4437 50480.59485 76297.38492 82949.59592 91983.09117 49526.74282 37864.76902 PE 32:1; [M-H]-@6.23 24361.29927 42150.92768 28643.37147 27729.34637 10120.45166 7201.266389 12327.65156 22470.57844 104434.513 54542.82512 70433.98511 13573.43575 52200.54172 15745.26194 16082.44919 58740.74112 24566.26959 54182.65166 53994.02459 295215.1528 8378.73827 107532.1255 91622.70472 33859.92144 17272.99434 15294.76778 PE 33:1; [M-H]-@6.53 3795.703152 5221.230483 4368.667186 8232.067488 1883.883157 2429.881185 5927.354922 5441.148502 18688.11137 4212.992579 8716.551024 4686.359386 3428.080728 2497.887149 4777.007198 6688.027797 3153.106997 10968.06167 7476.492509 46940.17693 3102.701864 14784.53139 11587.24489 2874.377831 2971.863783 2403.602356 PE 33:2; [M-H]-@6.05 13787.01996 10916.68234 8963.274986 1819.879478 10125.90024 2601.119774 4786.872605 9595.372929 15987.98256 9231.103947 27516.62044 5753.571133 10777.28467 12140.74498 6212.815287 14856.37406 706.545882 15718.31336 13978.32209 61546.3455 7890.231674 15176.30189 17932.37568 10259.68571 8613.44597 3797.779233 PE 34:1; [M-H]-@6.84 451240.9801 353736.6427 300308.0673 301762.4532 219381.9016 95550.14277 226175.1449 265687.1139 736541.5408 312193.1579 452152.5089 218876.1547 547556.8188 264847.9476 201936.8455 351844.2849 270794.9115 333269.2622 526048.2054 1291711.361 128861.4698 702448.3427 489038.971 253174.8069 190702.6587 251844.6032 PE 34:3; [M-H]-@5.95 178045.4839 161825.9588 127379.2507 84043.11868 133933.8199 45333.04205 154468.0236 133099.6977 296485.3055 243887.3469 372361.9075 100945.2952 252117.2889 104800.5604 155372.8593 267942.1965 70804.01392 289504.8258 291456.6675 1633488.535 50710.02998 317691.7222 300122.5848 174683.9457 69784.24629 96104.75312 PE 35:1; [M-H]-@7.07 11010.70614 23317.38934 12886.67778 8996.756951 4877.003553 6390.543781 21830.53854 17504.57522 44922.03656 27889.59789 17107.85419 17650.52708 13838.13245 20222.13171 16100.68699 13538.7128 9641.70122 17779.57195 31457.26982 54485.85329 9930.46798 20030.63358 16113.1333 7352.518025 16033.22361 18846.73839 PE 35:2; [M-H]-@6.68 134295.5376 63983.3512 44756.47701 18896.08225 30339.9904 7751.280118 25339.86239 24285.77288 107753.6969 27401.21227 29563.46241 13163.24826 49728.90849 20514.01226 21875.26885 26919.52895 8239.525618 52497.41127 66468.71456 82887.82323 19514.78799 69323.27273 33097.06789 38513.53847 22186.95407 20239.55472 PE 35:4; [M-H]-@6.04 17088.49018 14097.92184 14937.53947 22237.92352 18501.94796 9552.530725 18087.38357 13938.02431 35626.13007 26651.58758 23418.61892 8319.945565 21110.23568 22660.5944 15756.66333 28238.55127 14585.95312 29601.64253 53375.31132 174125.2156 10041.24037 30990.50933 32347.78146 15239.73591 10671.52955 21083.40934 PE 36:0; [M-H]-@7.84 70402.15626 33409.59333 54114.64019 38459.94585 42477.78007 28610.23438 33331.74583 34157.53515 38086.66182 37873.4622 59453.04369 32122.85698 62512.07732 51165.81149 37015.14685 47305.79855 33814.29611 39099.52552 42396.25273 48299.56681 31986.88522 31578.57978 46206.4328 38496.2438 34847.7056 71078.62342 PE 36:1; [M-H]-@7.42 196398.4234 206773.5753 158965.6832 189027.2794 135740.8191 41254.39632 223783.5297 107188.4672 432681.9353 180993.8665 320469.4548 144177.4512 318943.6785 191054.4686 142940.1516 172754.6672 129545.6835 162013.6773 232976.7574 662212.1019 85219.55703 262513.0326 233996.8629 162157.9972 81873.69012 143418.6104 PE 36:2; [M-H]-@6.97 821589.9606 1413785.291 844796.3144 593505.3735 934890.0171 311162.0876 1170953.553 871610.634 1475341.02 976033.8143 1037894.132 581172.0922 1014565.651 681506.6773 688448.9177 1065215.182 474621.7229 834167.177 1588431.993 2396760.811 369999.0186 1270759.362 1424677.56 897430.7764 471027.0823 601159.3451 PE 36:3; [M-H]-@6.53 805315.4292 793508.7038 407777.4533 368676.17 588899.139 112544.303 626659.3163 386843.4077 1222687.693 645819.3004 941393.4917 349460.6956 660891.7679 337475.3065 462607.8083 628997.711 256186.0589 488540.3102 690661.1579 1865840.657 180017.3489 884574.9514 809656.1082 473940.254 278944.5474 428681.9369 PE 36:4; [M-H]-@6.21 660402.3575 472131.8917 496384.0251 355296.8065 349519.5497 122002.1695 414389.3257 294621.7763 1043451.693 445594.6418 812274.8786 267282.9457 757402.9279 327364.4589 272646.0219 561256.6487 344518.4008 570631.9702 563765.1261 2232621.862 190809.8098 829237.4429 897183.6183 515459.3033 244902.6609 397061.5006 PE 36:5; [M-H]-@5.94 239142.4752 179975.6622 471950.365 179096.2034 132728.598 243820.967 149370.2367 226438.6112 396002.0593 387834.7141 490374.7077 248400.6935 763991.6735 304760.528 269350.1643 334863.5638 135576.0351 433762.3923 336281.3544 2429542.576 86840.07194 617937.4682 488199.9953 220644.1539 147555.7998 128635.7193 PE 36:6; [M-H]-@5.60 8804.835876 4134.915473 70.1049714 1639.931485 1193.35888 775.0170473 1279.09637 124.7183931 7287.348034 2133.620356 3622.359278 2106.553251 4569.407488 2687.179137 3998.498051 2126.329458 1434.441289 3623.982567 4082.471595 12316.86648 1446.54391 2596.104374 6666.502771 3355.383049 2894.725228 1276.028124 PE 37:3; [M-H]-@6.86 29944.67098 36489.20618 11535.86038 11298.21548 19843.73001 5840.199645 17542.69682 9808.112554 29504.42255 22804.43921 28216.99124 11093.27168 8550.666148 9326.263361 19472.89206 13948.9073 10488.3909 21837.61719 20796.88286 44132.52931 4429.924025 16546.95993 10795.3459 12628.29171 7342.100636 20346.03059 PE 37:5; [M-H]-@6.14 28332.50545 23631.16718 35550.38643 39255.99173 27117.77321 28556.34669 41963.4769 39087.40691 47879.58594 15242.13498 37107.55537 64131.1673 37060.14339 25327.16976 27564.48932 46924.44767 47486.29536 22911.37357 34812.12749 52185.793 34505.86472 19415.594 30650.0534 22310.80623 14686.83817 34611.60121 PE 37:6; [M-H]-@5.94 15949.62762 9868.228138 29281.57596 11611.89885 13592.51452 8686.151772 6063.641226 12629.32212 38820.85868 22232.46465 25657.10879 6800.321115 30959.29014 33613.49047 30298.20593 28157.14328 10891.80678 25215.12332 24798.86666 199895.6779 7685.513581 26448.57138 24601.55808 21295.2106 13474.0755 12549.35288 PE 38:2; [M-H]-@7.50 22841.17318 34063.71386 21030.48764 24412.8697 42398.37295 12767.30095 15975.16846 21858.36128 21900.45683 23794.15566 56795.93683 39232.27181 16990.59751 23159.84173 17584.46365 24317.66907 15863.36595 26150.47485 18984.46275 20865.66221 25093.72075 17243.03905 24881.5927 20026.28332 28750.23755 34150.03497 PE 38:3; [M-H]-@7.22 242478.7914 293389.9645 225799.0875 310599.8956 253377.5916 108649.7656 272408.3394 274670.9315 750513.7567 313466.9269 287874.157 231559.166 327499.6765 252160.3596 169998.6082 359682.6562 217464.0499 158722.408 352931.8307 1325408.176 99317.7368 431645.1475 490890.0037 305073.972 173326.4337 222578.5589 PE 38:4; [M-H]-@6.93 2347747.61 1269535.674 1576457.751 1928099.583 1425626.47 945404.2481 1584184.241 1296818.277 3517535.459 1838830.508 2848926.6 1703459.533 2931038.355 1678835.884 1230638.657 2461660.333 1640110.613 1996365.449 2092155.771 4623389.491 1033486.498 2281641.669 2724593.517 1833172.817 1095418.708 1700956.333 PE 38:5; [M-H]-@6.51 765042.2491 947696.0601 770230.6082 1320613.229 814896.1799 430273.0226 849658.1698 1075044.242 2735203.531 1173928.274 1550784.817 761858.3552 1387537.735 1047895.108 533511.6245 1305443.258 720882.2625 1080817.694 1210544.828 4564186.495 335555.9343 1503805.594 1902073.356 1053747.554 562559.213 776406.5129 PE 38:6; [M-H]-@6.11 1028945.188 914047.9103 1932841.297 1709819.761 1270774.839 992064.4753 1028267.943 1147071.416 3423057.276 1609986.993 1511832.471 931906.3667 2844610.575 1846169.312 1751686.665 1862361.463 1214911.149 1545325.409 1979334.815 6227912.535 548020.3605 2295757.433 2302994.093 1805476.419 781843.5826 1487378.71 PE 38:7; [M-H]-@5.73 13634.05169 19009.31363 38752.29086 31184.39606 31761.00598 21249.23378 24967.33221 26256.09817 71833.46924 31536.48046 30692.66175 24298.81819 52759.4899 24076.63972 16536.06472 37248.03418 20529.44505 14804.75982 40852.05946 184750.3314 15913.64877 27403.31893 37078.94173 33498.65928 19898.06832 18891.67331 PE 39:4; [M-H]-@7.24 9356.14625 10276.31229 21506.98642 21132.89784 29219.86061 9600.858025 19954.83813 29097.06737 42717.71641 20536.90368 16938.96728 8271.810687 19035.64675 32630.84611 5982.978407 25640.55526 11562.57838 22641.7919 10283.62704 63472.71111 8179.557626 18838.13449 33473.55143 20667.60679 19061.86656 24999.56348 PE 39:6; [M-H]-@6.49 55207.15613 25921.29246 66219.45252 34001.09262 42468.76049 15588.31663 29996.80589 13485.67561 105237.5813 25859.8849 35362.90521 32938.13331 67018.60807 48145.64239 43182.5161 27777.15976 22810.11851 28660.14161 27827.21613 76119.64489 15406.68321 58022.06639 40993.84466 50491.45706 8566.114682 19677.17819 PE 40:4; [M-H]-@7.40 95419.19696 79468.02673 53744.88679 83240.64604 49722.13313 32776.84881 68625.10655 44233.11612 183335.8189 141323.3674 125195.5206 78540.96878 154396.1301 72406.05913 39332.55366 95458.18688 82103.98378 74616.70292 77900.86294 365353.4891 25954.92748 137410.1818 93108.13122 61862.12054 26234.17888 79866.30588 PE 40:5; [M-H]-@7.14 164825.192 224476.7552 350371.5481 231258.8423 152622.8587 114340.9938 293050.4164 162545.6468 441907.5706 268393.4764 225473.4048 224292.149 360103.2615 233141.0188 211644.014 282205.2802 182577.1546 272753.8954 288068.2024 1008141.704 94618.47199 353180.8045 419179.5832 229362.7091 122944.5969 166372.1047 PE 40:6; [M-H]-@6.88 576467.825 432028.4662 1098470.028 827342.6781 598989.2954 491826.1632 941923.8505 592011.9456 1154752.865 763079.335 686472.5052 733978.6592 1518070.098 913682.2081 708030.707 972223.9114 638103.719 762549.4272 1026021.784 2941103.393 351983.6285 955128.4139 1264040.266 865391.9072 332197.5664 611997.8288 PE 40:7; [M-H]-@6.36 113810.8582 77973.61838 125490.7262 141256.5017 108841.8706 59710.61742 69987.4207 76857.35922 250365.3157 110728.4353 168198.4157 99205.54034 220106.3385 126564.8183 110182.5432 117585.4569 67026.45353 117504.3286 100529.6569 389731.674 34960.28186 104496.345 168557.1757 94274.87555 46143.6729 96586.05423 PE 40:8; [M-H]-@5.91 100464.1486 50683.99859 43752.63848 60289.75845 32381.03401 16394.282 30791.26149 26581.10947 185249.5395 57071.52424 105406.5059 90072.67277 93621.85061 56204.42985 31948.86787 58230.26609 39849.06888 45142.24082 35433.04167 245376.0637 19117.53831 33652.83317 52532.87947 58080.98012 31323.23808 32466.85989 PG 33:0; [M-H]-@6.08 13643.73211 13375.83893 21520.25612 17564.06972 20114.57395 18485.1645 10465.80405 13865.65018 31852.82164 18194.95781 16942.58697 15783.06258 23571.64127 20491.72308 20088.53161 36748.33137 24429.96356 22397.15391 19547.26144 31647.59345 21231.99196 20320.80887 10967.16522 25605.73687 13663.61094 15566.98708 PG 36:0; [M-H]-@6.92 57937.8902 64117.04626 67502.34863 60067.88059 56671.50469 60993.10354 79051.18778 57854.63533 48532.72745 61421.69435 82164.61097 51495.20771 46113.2537 83313.7451 51915.36646 54802.08346 61139.24838 64259.90221 76766.7699 44532.81968 71178.4026 52959.14808 60218.89638 53574.41271 54328.32962 49940.97393 PG 36:1; [M-H]-@6.45 20415.09437 18317.85928 26021.14398 20344.8918 12136.18751 13509.32087 20169.05408 26249.08686 27346.47548 26003.16361 32840.95964 25649.47649 23849.97707 30537.76588 15628.78418 12449.61454 19827.04315 24781.0983 22316.95343 35946.22972 2672.756272 31947.27771 32685.73211 37726.81149 13657.46495 15303.66898 PG 36:2; [M-H]-@6.02 35613.97411 53198.24055 41778.33718 35312.39405 54364.62076 38611.49503 62795.93096 89744.96753 115183.1906 93776.63144 75766.71801 82624.07239 55124.96578 51100.43811 26099.07939 57185.60708 42841.86901 46665.19315 65523.59432 170899.3445 26047.43061 81492.70368 102575.587 66392.43272 31401.994 61288.4814 PI 34:2; [M-H]-@5.30 8930.617215 66673.53603 30137.32624 29932.66614 63993.78327 31895.11322 41285.31291 63507.24358 39108.84398 46203.86573 41327.20708 43204.63179 48978.55712 39408.32378 37897.63068 59234.9565 41128.82097 32390.41321 66554.6568 138436.8417 21856.86067 52033.48086 54687.92958 51148.67716 27559.29482 39254.18023 PI 36:1; [M-H]-@6.34 6874.808475 28714.80776 13673.37019 24113.38019 25385.45647 15361.81122 32849.17723 26068.52075 25892.0022 21185.49526 19385.55725 17542.7966 16109.24365 23371.3217 22339.38207 15563.36677 14343.60096 18490.83953 17710.22241 68491.06809 16416.1438 30495.82846 32693.49782 17402.10846 17182.28794 19934.92503 PI 36:2; [M-H]-@5.93 207776.8677 692969.616 313223.3176 227271.8691 802441.4967 335476.4984 456884.8577 658013.3696 539232.949 569817.8005 761061.5889 530197.1117 485556.7434 409885.9819 400907.8047 504045.2787 364135.9576 426182.3921 483377.3992 1298294.571 376243.7288 479400.7492 598659.3421 504950.3866 319211.0418 470080.7747 PI 36:4; [M-H]-@5.27 68002.86463 75194.16472 44649.95369 42831.69395 55460.9578 20632.98758 62850.57975 47269.93237 66684.42629 43245.55675 74466.91304 55098.01478 98101.31087 47871.27069 37025.50284 47164.4693 51086.6336 73462.41318 73822.86444 63424.21545 47943.68312 96793.33425 63494.92878 56637.98239 36011.01199 53210.59217 PI 38:3; [M-H]-@6.15 102216.8227 410976.9518 261618.6647 368511.9016 409682.5109 183289.6937 442218.4324 590148.3643 426913.0578 450480.0529 296499.451 330048.695 246602.7389 321180.7405 219971.8345 303049.2631 364103.3881 325899.6455 377209.1984 492823.8585 180421.6126 424213.3858 443604.015 321965.3031 256821.4167 361910.5225 PI 38:4; [M-H]-@5.91 868755.4195 1778913.146 1640385.863 1685405.764 2022599.151 1300419.251 2083814.432 2680649.209 1952545.848 2331539.465 2908380.335 2013499.796 2315861.435 1836623.142 1526764.969 1726257.104 2195102.653 1860911.44 1994335.745 2464410.416 1640336.277 1978597.018 2278904.74 1760482.731 1337850.545 2030210.393 PI 38:5; [M-H]-@5.38 26701.01037 74780.8222 54068.16102 57744.77263 77359.79819 38964.20334 58378.77703 75391.27834 43588.85952 68866.89144 99807.76478 59002.97149 56179.71 68196.2688 79463.15417 48589.52457 44980.24286 54612.40453 58477.79662 97900.4641 29722.34113 57612.98109 68763.00692 31942.28693 35051.33317 55788.98162 PI 40:5; [M-H]-@5.98 46634.64641 194862.5876 105712.0819 82589.88022 93766.78502 122079.8844 166606.2362 178154.1092 144176.9496 186772.5889 132621.3603 153961.114 181302.0174 93267.2619 98586.73629 157232.2181 152791.8309 191052.0674 108569.2951 227952.8899 90018.0785 170136.8201 157037.3873 150530.8296 95504.41686 92819.40956 PI 40:6; [M-H]-@5.83 6064.300057 22249.85664 19046.04282 16171.71042 26483.80658 22753.65507 36979.3776 34149.71694 19912.69926 16052.2921 14814.5531 38188.62209 30893.95337 22794.40535 25661.76502 28890.54492 30582.06551 21822.75825 17919.22868 65492.96341 17718.59627 26203.32272 24636.30131 34880.52146 11679.36992 30241.51472 PS 38:4; [M-H]-@6.03 68662.49394 33588.42904 25501.03059 81256.96936 38965.58782 22291.62313 18246.98083 42013.23578 160781.6352 25333.18231 58130.81638 121820.1613 100721.3734 40925.91526 33869.77141 151332.2647 78651.5847 55767.04808 48938.72416 231693.8119 16914.51489 33012.72794 47509.94035 31750.57242 25483.64426 32122.51593 lysoPE 16:0; [M-H]-@1.66 98188.26219 43472.27279 61365.42876 55942.72543 40217.87066 33853.50847 45007.54987 43479.07711 185006.0032 64699.47264 83536.55861 102675.9432 55940.0658 76723.64964 56089.4641 41734.16526 47457.34281 41023.85694 55087.22368 66743.30754 50434.10734 103047.1095 127357.3924 83001.78546 71200.55769 47325.26206 lysoPE 18:0; [M-H]-@2.42 217110.5964 109662.8116 146356.9763 149974.309 113545.2535 65720.11042 109858.4046 74250.9224 637984.1726 130196.5515 242582.1566 314878.7015 138315.1095 178262.9277 143833.9148 121332.3493 91557.94406 102725.0437 66276.44552 133632.403 107003.9595 170342.1236 228066.9982 147419.5724 101153.9742 141843.4049 lysoPE 18:1; [M-H]-@1.82 111099.5111 93291.09633 60328.6591 82331.80082 56679.71933 29691.49284 169514.8757 59818.22142 268092.456 84769.84292 98676.48559 85943.83974 81890.20043 170068.2151 88688.64709 70082.72283 68278.10529 66757.54538 106673.7039 83935.55306 81178.72853 114969.7936 194886.4748 116623.3741 124657.336 83056.35946 lysoPE 18:2; [M-H]-@1.37 169549.4928 166854.241 101571.1131 72002.18824 141315.6831 37907.62628 185820.7587 117355.0244 226815.5424 145707.2624 145294.084 122064.1956 97786.25934 174102.3081 130564.3537 112542.9647 75632.64085 99292.44462 172269.0733 81936.82465 103267.6827 209152.1897 293920.2359 186445.2435 177546.2763 141325.8507 lysoPE 20:3; [M-H]-@1.63 23971.32525 20898.65959 23044.1176 28617.5211 17799.85184 4130.539821 40778.06403 9133.988088 65782.98967 26283.03403 25198.23209 29701.19241 25243.31746 43928.53153 15297.47784 28247.11565 21670.78986 15891.47541 32798.20532 50306.8012 16671.7778 48692.62178 68102.66565 30385.59644 19858.12319 28985.39708 lysoPE 20:4; [M-H]-@1.34 209339.4837 91248.01071 105901.6185 140411.7918 122733.4215 52270.70825 169088.9665 90588.95043 284871.5793 164222.2761 195278.6648 141617.0873 131602.5102 179681.0417 124342.6203 93821.37844 134967.608 129268.4537 119005.6457 110870.7884 144220.1203 178657.9575 258207.6389 194554.4283 170274.0439 184329.496 lysoPE 22:5; [M-H]-@1.64 50585.80971 22129.8985 25216.01982 35525.85024 16687.66344 6595.019554 31781.92633 18910.94739 67668.96647 37994.26266 53950.28641 26674.49841 49230.543 42311.143 28590.04736 33980.17578 36181.75884 41923.50291 28878.05097 44060.94254 28780.50267 48332.56283 69569.33362 37397.64866 27633.75042 23936.26007 lysoPE 22:6; [M-H]-@1.28 71249.58106 44924.93317 125975.683 102113.0101 70648.35636 80804.94542 109045.5222 51315.35868 157371.9102 91754.95597 116055.4973 129051.6121 144777.5482 196530.8748 119751.8569 114004.0375 75874.58173 63252.95313 80071.37965 88485.61692 121443.0726 109956.9201 181542.0785 168459.048 108865.3848 116802.404 plasmenyl-PE 32:1; [M-H]-@6.59 20319.31665 17206.48542 12888.08663 6772.042648 5025.555678 5622.344662 19571.82052 6041.90191 18872.993 21683.84763 30584.55232 7802.644633 19393.93465 13408.46614 14404.86306 12817.72562 9342.134969 14685.81063 10837.64362 23186.408 5844.063209 20556.67275 36140.74862 20391.65146 9699.140884 14678.94435 plasmenyl-PE 34:0; [M-H]-@7.20 25436.56011 46273.67981 26064.6238 25583.43181 29504.60012 16419.81373 28228.51732 26084.23551 42952.61146 33583.85333 48038.04142 25359.47897 34558.40702 30493.60527 17900.55306 19647.29098 21416.55692 25030.43065 29236.17957 49573.7026 20169.52156 39473.70075 35838.25472 31515.77307 17943.3658 27469.30293 plasmenyl-PE 34:1; [M-H]-@7.15 496622.989 204642.9975 265294.7992 152679.0236 148965.9305 53650.91534 219066.475 70689.67082 297082.309 116481.9974 234940.7706 143540.1803 366394.345 199768.9571 120050.1164 103739.3917 73124.0052 149268.4482 119244.7521 178758.6961 122306.8762 152945.0881 243731.2919 223751.0384 121947.7467 183108.0911 plasmenyl-PE 34:3; [M-H]-@6.30 8558.321469 16128.45004 10378.16903 16964.20921 17849.65963 8995.18447 27257.26069 5754.331126 29398.45481 11933.77077 21889.87994 27071.61041 19548.13589 19190.97659 13197.60182 11633.66605 5210.28843 19921.21864 7192.936153 19285.10296 11472.54049 18441.5631 30247.40227 22479.42023 11759.44526 8146.578549 plasmenyl-PE 36:1; [M-H]-@7.71 127126.4338 214404.9803 180570.246 210513.2818 138256.2384 123447.3256 360894.707 120786.3037 343612.8264 161040.1849 217260.3028 181058.1311 169544.0063 255338.592 144745.0203 159014.3435 105607.7754 182929.5892 138521.8634 340849.5724 93688.34029 186861.8664 250347.3789 133401.2712 129669.0124 164903.7733 plasmenyl-PE 36:3; [M-H]-@6.90 606971.1469 906363.3734 491496.7445 667479.3317 768596.1408 381062.2429 1010227.084 475346.6532 912455.6441 648298.4602 1001436.652 589520.3684 569474.0849 921704.0484 526581.4558 518206.1864 427757.7952 654514.0846 569856.9678 1106599.246 395308.1503 449555.9049 1072456.591 839244.3528 584416.6164 749287.2866 plasmenyl-PE 36:5; [M-H]-@6.27 145756.0542 126379.1712 500215.5215 99604.82083 78545.94659 329236.4452 236465.0171 68879.53205 153066.3825 179002.8952 244224.2146 280979.8781 438725.3667 326923.1012 292904.4858 104638.0243 109937.4025 160074.1229 93019.55836 168037.1601 70449.25828 176969.0621 215639.1825 167445.1103 131174.617 134763.2171 plasmenyl-PE 38:1; [M-H]-@8.22 28407.6927 18036.6289 27084.16065 25701.38768 20450.22806 19180.81395 19593.88103 7428.308776 43542.01245 16111.82978 27190.37295 14966.86156 32589.78279 60836.11218 17141.17887 21618.32774 10091.55916 20701.00513 20670.46477 25943.43317 16448.68873 30303.8415 15829.34543 28920.8948 15270.3201 20815.58728 plasmenyl-PE 38:2; [M-H]-@7.84 58240.29676 92845.73009 55201.71694 48429.34777 61969.59014 48854.8744 87094.57344 47626.73404 73844.10104 75663.18234 89516.78094 78706.14577 58047.84053 134031.7363 46921.53452 71465.23402 38972.44286 66149.44384 66654.91185 91133.14847 43007.7957 45229.36962 85267.75203 66488.68882 52212.67629 48167.9361 plasmenyl-PE 38:3; [M-H]-@7.51 294745.5284 530329.9425 321005.9222 448058.1819 336055.7285 244913.2557 625600.794 229059.0169 857876.4805 385518.615 488606.6328 456897.1695 407877.3231 479933.0068 276958.077 401435.006 330990.9406 505670.2017 318761.5221 998941.4284 216737.2425 413988.4601 635652.8292 550542.0123 460922.1854 453344.5455 plasmenyl-PE 38:4; [M-H]-@7.21 1913803.638 2846995.961 1865737.075 2644045.146 2309151.613 1603151.808 4149709.093 1645473.683 4726006.035 2753202.944 3115503.435 3728908.472 2995003.535 3461161.969 2167529.949 2867324.53 2493818.378 2515627.67 2124758.532 4737336.014 1530088.363 2153109.871 3556958.737 2529386.973 2404522.663 2834127.594 plasmenyl-PE 38:5; [M-H]-@6.74 2580955.5 2602514.639 2970127.979 2614925.077 2019844.171 1973059.6 3398278.298 1382963.388 3355149.019 2407978.197 4560555.28 2431769.294 3459281.138 3354831.441 2563817.82 2052708.342 2107673.066 2570530.914 1912756.019 2620007.716 1598449.775 2015024.07 3074515.801 2377597.369 1822548.74 2650355.8 plasmenyl-PE 38:6; [M-H]-@6.51 1000968.797 1266990.741 2170868.621 1236032.317 1630289.537 1562537.117 2430499.212 1026942.466 1490777.187 1535018.667 1754039.226 1573533.401 1975332.544 2103483.576 1475049.006 1252878.656 922199.073 1154118.952 1317299.274 1832889.638 1010113.678 1163620.604 2198368.409 1454151.215 1198047.879 1548770.287 plasmenyl-PE 40:3; [M-H]-@8.01 398307.5536 134421.9209 79202.20823 93309.58841 71856.46211 27605.39547 87687.75929 34093.31721 245180.2419 61150.65643 127026.1694 79938.36072 176668.1693 90060.23811 69991.08565 114711.559 49098.19248 98979.00359 101973.3867 100121.6679 73189.26193 102096.8946 75928.13659 106879.429 75583.00282 142219.6524 plasmenyl-PE 40:4; [M-H]-@7.72 1917030.656 604256.6501 336093.2168 494642.6728 292583.1468 139487.6166 362702.7524 184329.386 1373502.131 277084.5329 719388.2385 696475.1828 1353761.293 474258.8632 178769.0285 649759.3072 238989.0667 424021.7395 394404.1949 667900.2428 355462.1607 382438.4211 407201.8265 391847.1422 356125.6682 634503.0311 plasmenyl-PE 40:6; [M-H]-@7.17 473539.4289 463015.1334 621087.0166 475798.6888 571685.6241 568513.9563 671515.9303 332038.4517 547703.5775 459187.0348 539372.7831 612543.0824 728853.2362 806100.7393 567918.0186 427327.3654 424999.7546 377079.2947 345643.7158 757458.1012 320797.1895 395137.307 851190.0895 489861.5552 472654.764 568742.2687 plasmenyl-PE 42:5; [M-H]-@7.85 233503.58 94390.09415 110053.7808 77842.08902 60363.04382 30150.62481 64623.07619 29669.76693 138582.1326 50516.15119 84779.92967 86349.17487 168223.2145 86544.31117 49778.14962 99069.90956 35327.41572 99907.77758 73762.27893 104907.205 51591.36442 56834.52605 78532.40361 90220.27938 52868.56387 74253.05697 plasmenyl-PE 42:6; [M-H]-@7.74 145910.875 107549.9584 103719.8393 79636.63106 53186.81594 48853.32755 135087.3635 31019.17792 83090.97534 52691.02206 110282.9564 88680.3965 127837.1928 102138.5657 68365.03552 58520.92286 40041.14702 105517.1883 54937.41556 78094.52076 63704.91694 86151.48179 42894.78358 57384.50291 60271.33861 75091.58129 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 CerP 32:1; [M-H]-@5.11 5.11 CerP 32:1 LipidBLAST CerP 34:1; [M-H]-@5.83 5.83 CerP 34:1 LipidBLAST CerP 34:2; [M-H]-@5.29 5.29 CerP 34:2 LipidBLAST 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]-@8.46 8.46 5283568 N-(hexadecanoyl)-sphing-4-enine; [M-H]-@6.83 6.83 5283564 N-(tetracosanoyl)-sphing-4-enine; [M-H]-@8.90 8.9 5283571 PA 34:2; [M-H]-@6.26 6.26 PA(34:2) LipidMaps Bulk ID PC 30:1; [M-Ac-H]-@5.42 5.42 PC(30:1) LipidMaps Bulk ID PC 32:0; [M-Ac-H]-@6.62 6.62 PC(32:0) LipidMaps Bulk ID PC 32:1; [M-Ac-H]-@6.10 6.1 PC(32:1) LipidMaps Bulk ID PC 32:2; [M-Ac-H]-@5.59 5.59 PC(32:2) LipidMaps Bulk ID PC 33:1; [M-Ac-H]-@6.43 6.43 PC(33:1) LipidMaps Bulk ID PC 33:2; [M-Ac-H]-@5.98 5.98 PC(33:2) LipidMaps Bulk ID PC 34:1; [M-Ac-H]-@6.65 6.65 PC(34:1) LipidMaps Bulk ID PC 34:2; [M-Ac-H]-@6.21 6.21 PC(34:2) LipidMaps Bulk ID PC 34:3; [M-Ac-H]-@5.76 5.76 PC(34:3) LipidMaps Bulk ID PC 34:4; [M-Ac-H]-@5.53 5.53 PC(34:4) LipidMaps Bulk ID PC 34:5; [M-Ac-H]-@5.14 5.14 PC(34:5) LipidMaps Bulk ID PC 35:1; [M-Ac-H]-@7.04 7.04 PC(35:1) LipidMaps Bulk ID PC 35:2; [M-Ac-H]-@6.56 6.56 PC(35:2) LipidMaps Bulk ID PC 35:3; [M-Ac-H]-@6.10 6.1 PC(35:3) LipidMaps Bulk ID PC 35:5; [M-Ac-H]-@5.51 5.51 PC(35:5) LipidMaps Bulk ID PC 36:1; [M-Ac-H]-@7.27 7.27 PC(36:1) LipidMaps Bulk ID PC 36:2; [M-Ac-H]-@6.85 6.85 PC(36:2) LipidMaps Bulk ID PC 36:3; [M-Ac-H]-@6.40 6.4 PC(36:3) LipidMaps Bulk ID PC 36:4; [M-Ac-H]-@6.09 6.09 PC(36:4) LipidMaps Bulk ID PC 36:5; [M-Ac-H]-@5.68 5.68 PC(36:5) LipidMaps Bulk ID PC 36:6; [M-Ac-H]-@5.48 5.48 PC(36:6) LipidMaps Bulk ID PC 37:2; [M-Ac-H]-@7.22 7.22 PC(37:2) LipidMaps Bulk ID PC 37:4; [M-Ac-H]-@6.51 6.51 PC(37:4) LipidMaps Bulk ID PC 37:6; [M-Ac-H]-@5.79 5.79 PC(37:6) LipidMaps Bulk ID PC 38:2; [M-Ac-H]-@7.45 7.45 PC(38:2) LipidMaps Bulk ID PC 38:3; [M-Ac-H]-@7.08 7.08 PC(38:3) LipidMaps Bulk ID PC 38:4; [M-Ac-H]-@6.73 6.73 PC(38:4) LipidMaps Bulk ID PC 38:5; [M-Ac-H]-@6.37 6.37 PC(38:5) LipidMaps Bulk ID PC 38:6; [M-Ac-H]-@6.01 6.01 PC(38:6) LipidMaps Bulk ID PC 38:7; [M-Ac-H]-@5.51 5.51 PC(38:7) LipidMaps Bulk ID PC 39:5; [M-Ac-H]-@6.61 6.61 PC(39:5) LipidMaps Bulk ID PC 39:6; [M-Ac-H]-@6.40 6.4 PC(39:6) LipidMaps Bulk ID PC 40:3; [M-Ac-H]-@7.51 7.51 PC(40:3) LipidMaps Bulk ID PC 40:4; [M-Ac-H]-@7.31 7.31 PC(40:4) LipidMaps Bulk ID PC 40:5; [M-Ac-H]-@7.06 7.06 PC(40:5) LipidMaps Bulk ID PC 40:6; [M-Ac-H]-@6.69 6.69 PC(40:6) LipidMaps Bulk ID PC 40:7; [M-Ac-H]-@6.22 6.22 PC(40:7) LipidMaps Bulk ID PC 40:8; [M-Ac-H]-@5.79 5.79 PC(40:8) LipidMaps Bulk ID PC 42:10; [M-Ac-H]-@5.71 5.71 PC(42:10) LipidMaps Bulk ID PE 32:1; [M-H]-@6.23 6.23 PE(32:1) LipidMaps Bulk ID PE 33:1; [M-H]-@6.53 6.53 PE(33:1) LipidMaps Bulk ID PE 33:2; [M-H]-@6.05 6.05 PE(33:2) LipidMaps Bulk ID PE 34:1; [M-H]-@6.84 6.84 PE(34:1) LipidMaps Bulk ID PE 34:3; [M-H]-@5.95 5.95 PE(34:3) LipidMaps Bulk ID PE 35:1; [M-H]-@7.07 7.07 PE(35:1) LipidMaps Bulk ID PE 35:2; [M-H]-@6.68 6.68 PE(35:2) LipidMaps Bulk ID PE 35:4; [M-H]-@6.04 6.04 PE(35:4) LipidMaps Bulk ID PE 36:0; [M-H]-@7.84 7.84 PE(36:0) LipidMaps Bulk ID PE 36:1; [M-H]-@7.42 7.42 PE(36:1) LipidMaps Bulk ID PE 36:2; [M-H]-@6.97 6.97 PE(36:2) LipidMaps Bulk ID PE 36:3; [M-H]-@6.53 6.53 PE(36:3) LipidMaps Bulk ID PE 36:4; [M-H]-@6.21 6.21 PE(36:4) LipidMaps Bulk ID PE 36:5; [M-H]-@5.94 5.94 PE(36:5) LipidMaps Bulk ID PE 36:6; [M-H]-@5.60 5.6 PE(36:6) LipidMaps Bulk ID PE 37:3; [M-H]-@6.86 6.86 PE(37:3) LipidMaps Bulk ID PE 37:5; [M-H]-@6.14 6.14 PE(37:5) LipidMaps Bulk ID PE 37:6; [M-H]-@5.94 5.94 PE(37:6) LipidMaps Bulk ID PE 38:2; [M-H]-@7.50 7.5 PE(38:2) LipidMaps Bulk ID PE 38:3; [M-H]-@7.22 7.22 PE(38:3) LipidMaps Bulk ID PE 38:4; [M-H]-@6.93 6.93 PE(38:4) LipidMaps Bulk ID PE 38:5; [M-H]-@6.51 6.51 PE(38:5) LipidMaps Bulk ID PE 38:6; [M-H]-@6.11 6.11 PE(38:6) LipidMaps Bulk ID PE 38:7; [M-H]-@5.73 5.73 PE(38:7) LipidMaps Bulk ID PE 39:4; [M-H]-@7.24 7.24 PE(39:4) LipidMaps Bulk ID PE 39:6; [M-H]-@6.49 6.49 PE(39:6) LipidMaps Bulk ID PE 40:4; [M-H]-@7.40 7.4 PE(40:4) LipidMaps Bulk ID PE 40:5; [M-H]-@7.14 7.14 PE(40:5) LipidMaps Bulk ID PE 40:6; [M-H]-@6.88 6.88 PE(40:6) LipidMaps Bulk ID PE 40:7; [M-H]-@6.36 6.36 PE(40:7) LipidMaps Bulk ID PE 40:8; [M-H]-@5.91 5.91 PE(40:8) LipidMaps Bulk ID PG 33:0; [M-H]-@6.08 6.08 PG(33:0) LipidMaps Bulk ID PG 36:0; [M-H]-@6.92 6.92 PG(36:0) LipidMaps Bulk ID PG 36:1; [M-H]-@6.45 6.45 PG(36:1) LipidMaps Bulk ID PG 36:2; [M-H]-@6.02 6.02 PG(36:2) LipidMaps Bulk ID PI 34:2; [M-H]-@5.30 5.3 PI(34:2) LipidMaps Bulk ID PI 36:1; [M-H]-@6.34 6.34 PI(36:1) LipidMaps Bulk ID PI 36:2; [M-H]-@5.93 5.93 PI(36:2) LipidMaps Bulk ID PI 36:4; [M-H]-@5.27 5.27 PI(36:4) LipidMaps Bulk ID PI 38:3; [M-H]-@6.15 6.15 PI(38:3) LipidMaps Bulk ID PI 38:4; [M-H]-@5.91 5.91 PI(38:4) LipidMaps Bulk ID PI 38:5; [M-H]-@5.38 5.38 PI(38:5) LipidMaps Bulk ID PI 40:5; [M-H]-@5.98 5.98 PI(40:5) LipidMaps Bulk ID PI 40:6; [M-H]-@5.83 5.83 PI(40:6) LipidMaps Bulk ID PS 38:4; [M-H]-@6.03 6.03 PS(38:4) LipidMaps Bulk ID lysoPE 16:0; [M-H]-@1.66 1.66 LPE(16:0) LipidMaps Bulk ID lysoPE 18:0; [M-H]-@2.42 2.42 LPE(18:0) LipidMaps Bulk ID lysoPE 18:1; [M-H]-@1.82 1.82 LPE(18:1) LipidMaps Bulk ID lysoPE 18:2; [M-H]-@1.37 1.37 LPE(18:2) LipidMaps Bulk ID lysoPE 20:3; [M-H]-@1.63 1.63 LPE(20:3) LipidMaps Bulk ID lysoPE 20:4; [M-H]-@1.34 1.34 LPE(20:4) LipidMaps Bulk ID lysoPE 22:5; [M-H]-@1.64 1.64 LPE(22:5) LipidMaps Bulk ID lysoPE 22:6; [M-H]-@1.28 1.28 LPE(22:6) LipidMaps Bulk ID plasmenyl-PE 32:1; [M-H]-@6.59 6.59 PE(P-32:1) LipidMaps Bulk ID plasmenyl-PE 34:0; [M-H]-@7.20 7.2 PE(P-34:0) LipidMaps Bulk ID plasmenyl-PE 34:1; [M-H]-@7.15 7.15 PE(P-34:1) LipidMaps Bulk ID plasmenyl-PE 34:3; [M-H]-@6.30 6.3 PE(P-34:3) LipidMaps Bulk ID plasmenyl-PE 36:1; [M-H]-@7.71 7.71 PE(P-36:1) LipidMaps Bulk ID plasmenyl-PE 36:3; [M-H]-@6.90 6.9 PE(P-36:3) LipidMaps Bulk ID plasmenyl-PE 36:5; [M-H]-@6.27 6.27 PE(P-36:5) LipidMaps Bulk ID plasmenyl-PE 38:1; [M-H]-@8.22 8.22 PE(P-38:1) LipidMaps Bulk ID plasmenyl-PE 38:2; [M-H]-@7.84 7.84 PE(P-38:2) LipidMaps Bulk ID plasmenyl-PE 38:3; [M-H]-@7.51 7.51 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]-@6.74 6.74 PE(P-38:5) LipidMaps Bulk ID plasmenyl-PE 38:6; [M-H]-@6.51 6.51 PE(P-38:6) LipidMaps Bulk ID plasmenyl-PE 40:3; [M-H]-@8.01 8.01 PE(P-40:3) LipidMaps Bulk ID plasmenyl-PE 40:4; [M-H]-@7.72 7.72 PE(P-40:4) LipidMaps Bulk ID plasmenyl-PE 40:6; [M-H]-@7.17 7.17 PE(P-40:6) LipidMaps Bulk ID plasmenyl-PE 42:5; [M-H]-@7.85 7.85 plasmenyl-PE 42:5 LipidBLAST plasmenyl-PE 42:6; [M-H]-@7.74 7.74 PE(P-42:6) LipidMaps Bulk ID METABOLITES_END #END