#METABOLOMICS WORKBENCH araskind_20170605_132429 DATATRACK_ID:950 STUDY_ID:ST000671 ANALYSIS_ID:AN001029 PROJECT_ID:PR000474 VERSION 1 CREATED_ON June 30, 2017, 9:30 am #PROJECT PR:PROJECT_TITLE Lipidomics of LCR/HCR rat mitochondria PR:PROJECT_TYPE MS analysis PR:PROJECT_SUMMARY Lipidomics of LCR/HCR rat mitochondria (2010 study, rest and 10min exercise) PR:INSTITUTE University of Michigan PR:DEPARTMENT UMich Internal Medicine PR:LABORATORY Burant Lab PR:LAST_NAME Burant PR:FIRST_NAME Chuck PR:ADDRESS 1500 E. Medical Center Drive Ann Arbor, MI 48109 PR:EMAIL burantc@umich.edu PR:PHONE 734 615-3481 #STUDY ST:STUDY_TITLE LCR/HCR rat mitochondrial study ST:STUDY_TYPE MS analysis ST:STUDY_SUMMARY LCR and HCR rats (from Nathan Qi's 2010 study) were dissected at rest or ST:STUDY_SUMMARY following 10 minutes of exercise. Mitochondria were isolated from frozen ST:STUDY_SUMMARY gastrocnemius skeletal muscle. Samples consist of these isolated mitochondria ST:STUDY_SUMMARY suspended in 50 uL of mitochondrial isolation buffer (IBM containing sucrose, ST:STUDY_SUMMARY salts, etc; see Katie Overmyer's notebook E, p~23). 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 4 ST:TOTAL_SUBJECTS 12 ST:STUDY_COMMENTS Recommend extracting entire sample suspension, NOT pelleting and removing ST:STUDY_COMMENTS supernatant. Quantities are likely to be small (~1-3mg tissue each?) Protein ST:STUDY_COMMENTS assays were performed to estimate quantities; see Katie's notebook or contact ST:STUDY_COMMENTS Charles for these protein concentration estimates, but also RECOMMEND SAVING ST:STUDY_COMMENTS RESIDUAL PELLET to allow further normalization. #SUBJECT SU:SUBJECT_TYPE Rat SU:SUBJECT_SPECIES Rattus norvegicus SU:TAXONOMY_ID 10114 #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS SU0014069 S00021223 Line:HCR | Rest/Exercise:Rest SUBJECT_SAMPLE_FACTORS SU0014070 S00021224 Line:HCR | Rest/Exercise:Rest SUBJECT_SAMPLE_FACTORS SU0014071 S00021225 Line:HCR | Rest/Exercise:Rest SUBJECT_SAMPLE_FACTORS SU0014072 S00021226 Line:HCR | Rest/Exercise:10 minutes Exercise SUBJECT_SAMPLE_FACTORS SU0014073 S00021227 Line:HCR | Rest/Exercise:10 minutes Exercise SUBJECT_SAMPLE_FACTORS SU0014074 S00021228 Line:HCR | Rest/Exercise:10 minutes Exercise SUBJECT_SAMPLE_FACTORS SU0014075 S00021229 Line:LCR | Rest/Exercise:Rest SUBJECT_SAMPLE_FACTORS SU0014076 S00021230 Line:LCR | Rest/Exercise:Rest SUBJECT_SAMPLE_FACTORS SU0014077 S00021231 Line:LCR | Rest/Exercise:Rest SUBJECT_SAMPLE_FACTORS SU0014078 S00021232 Line:LCR | Rest/Exercise:10 minutes Exercise SUBJECT_SAMPLE_FACTORS SU0014079 S00021233 Line:LCR | Rest/Exercise:10 minutes Exercise SUBJECT_SAMPLE_FACTORS SU0014080 S00021234 Line:LCR | Rest/Exercise:10 minutes Exercise #COLLECTION CO:COLLECTION_SUMMARY - #TREATMENT TR:TREATMENT_SUMMARY - #SAMPLEPREP SP:SAMPLEPREP_SUMMARY - SP:SAMPLEPREP_PROTOCOL_FILENAME A004 - Shotgun Lipidomics.pdf #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE Reversed phase MS:INSTRUMENT_NAME ABI Sciex 5600+ TripleTOF CH:COLUMN_NAME Waters Acquity HSS T3 (50 x 2.1mm, 1.8um) #ANALYSIS AN:ANALYSIS_TYPE MS AN:ANALYSIS_PROTOCOL_FILE A004 - Shotgun Lipidomics.pdf #MS MS:MS_COMMENTS - MS:INSTRUMENT_NAME ABI Sciex 5600+ TripleTOF MS:INSTRUMENT_TYPE Triple TOF MS:MS_TYPE ESI MS:ION_MODE POSITIVE #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS peak area normalized MS_METABOLITE_DATA_START Samples S00021223 S00021224 S00021225 S00021226 S00021227 S00021228 S00021229 S00021230 S00021231 S00021232 S00021233 S00021234 Factors Line:HCR | Rest/Exercise:Rest Line:HCR | Rest/Exercise:Rest Line:HCR | Rest/Exercise:Rest Line:HCR | Rest/Exercise:10 minutes Exercise Line:HCR | Rest/Exercise:10 minutes Exercise Line:HCR | Rest/Exercise:10 minutes Exercise Line:LCR | Rest/Exercise:Rest Line:LCR | Rest/Exercise:Rest Line:LCR | Rest/Exercise:Rest Line:LCR | Rest/Exercise:10 minutes Exercise Line:LCR | Rest/Exercise:10 minutes Exercise Line:LCR | Rest/Exercise:10 minutes Exercise 502.3269;[+]+@1.94 277582.6143 224748.9195 269322.0655 278494.4947 294275.4678 273992.5776 183314.3813 290946.8072 268427.1051 18658.82821 32936.65346 217656.0813 699.496; [+]+@8.30 18032.73831 34157.92929 17534.08104 29763.82344 24993.58252 25634.82893 58769.7343 28562.45185 11451.96215 31968.79405 40131.14388 23778.49765 764.5225; [+]+@6.28 947623.7839 983068.7518 1330528.203 851762.0938 957913.5099 1429169.901 684282.696 709293.5527 703008.5322 995595.7726 1109246.813 721365.3053 780.5538; [+]+@7.66 40531.0084 16644.92547 38744.63375 30205.1682 24331.00193 49856.22783 11725.25141 32286.79083 11195.74989 41898.72331 12192.92365 16727.94531 788.5225; [+]+@5.86 2224590.073 1864340.143 2457711.767 2232441.762 2240313.818 2256320.505 777786.3146 2094925.009 2120468.228 1750906.98 2268897.294 1408017.362 CE(20:4); [M+NH4]+@10.54 2522.316849 1724.000272 2639.008945 2033.041999 3058.407518 1688.263096 1780.612952 3472.356876 2380.304602 2292.523482 2398.33054 1501.595679 DG 30:0; [M+NH4]+@7.37 31327.76182 23916.42455 22303.61227 28855.97523 30518.07765 30009.29707 8801.391345 24211.64406 22989.3827 20412.24805 31597.63874 13322.16848 DG 30:1; [M+NH4]+@6.89 3212.542235 1573.123774 2274.438325 2140.714432 7928.453938 3555.79783 2435.10916 4884.321943 4669.366124 6159.764358 8139.38338 3450.19059 DG 31:0; [M+NH4]+@7.63 8996.305753 8370.212584 5545.589332 5754.583681 6546.284882 5404.691966 3473.254369 6384.391071 5175.169632 5484.915612 8897.189013 3347.365849 DG 32:0; [M+NH4]+@7.85 186555.3127 144440.3198 200969.3905 195899.7743 243864.2184 206376.9705 44899.0005 149353.0832 162215.8961 118103.9956 213140.1298 94178.28078 DG 32:1; [M+NH4]+@7.44 60592.73267 49143.13429 50927.01763 42189.47617 56508.70316 58432.39068 19007.95005 65949.8615 56808.87391 46124.79952 89181.62522 34180.26595 DG 32:2; [M+NH4]+@7.03 21883.61637 20267.47909 14153.04301 18820.15773 17690.28358 19108.44947 8344.472355 28601.56091 26673.2961 17758.74803 31777.89167 16481.56859 DG 33:0; [M+NH4]+@8.10 11524.59833 10666.61594 11958.6576 9874.271444 9862.922268 8138.565962 3386.457724 6633.413197 10781.46963 8493.960244 19237.33467 6754.525043 DG 33:1; [M+NH4]+@7.71 12759.54208 14318.6829 12383.25413 14793.88141 10678.38351 13180.74015 6412.715008 15695.20037 10777.91159 13025.2565 22255.95265 6130.224201 DG 33:2; [M+NH4]+@7.24 20539.1106 20642.57761 29828.88079 33556.15897 32779.38569 25143.82183 19651.25888 17006.08472 24477.02863 28435.28011 26332.23104 21218.80045 DG 34:0; [M+NH4]+@8.38 116322.7276 112770.8376 115958.9185 109850.1705 122391.2295 104066.3903 42405.71549 124114.0901 146843.1242 96705.38534 184149.151 78350.16807 DG 34:2; [M+NH4]+@7.54 314941.9327 290546.8939 386986.9211 312887.3148 404044.1271 350980.5562 87601.7077 427525.9555 344498.3846 309695.3705 474244.4305 254498.7692 DG 34:3; [M+NH4]+@7.20 31430.62474 25814.32969 31449.62403 29690.9618 39683.99788 41198.83989 10593.74777 52130.53365 37722.46972 23478.20425 45998.95547 32175.69664 DG 35:1; [M+NH4]+@8.19 17553.95255 17679.38958 18120.33131 13589.37635 16774.72606 12758.45235 5483.065639 14086.12191 15688.18685 15952.34978 26016.34079 12815.28821 DG 35:2; [M+NH4]+@7.84 11625.91584 9201.213966 16580.49713 12367.71962 9738.997465 12995.38368 4750.334242 11325.26189 13166.1024 14176.86264 17997.89608 8886.325176 DG 36:0; [M+NH4]+@8.83 33742.43893 71228.54339 21833.30966 22961.11057 26440.67745 26966.23732 15251.49018 21399.38146 33209.15031 22893.53775 23272.49684 17958.11138 DG 36:1; [M+NH4]+@8.44 116344.7616 75774.01354 130044.2481 107063.1563 128004.6935 106197.2159 32565.35957 127017.0617 119847.8822 116399.013 153049.008 80905.96752 DG 36:2; [M+NH4]+@8.02 308834.0315 237149.7763 378399.5553 303745.1769 380688.9987 349453.8605 107217.0543 395978.5871 354181.8887 314074.3832 477751.3867 226186.4347 DG 36:3; [M+NH4]+@7.66 274103.7885 198982.7103 319862.8219 240227.143 358837.9406 298159.3798 96527.22209 329029.0319 292023.2316 292554.4641 366274.784 197235.264 DG 36:5; [M+NH4]+@6.98 15545.26352 17257.17189 9967.733188 9802.812939 13947.29648 10540.67482 1849.290435 18677.38239 13803.1254 14993.85244 21257.54777 8350.332052 DG 37:1; [M+NH4]+@8.66 3468.232056 4886.031984 2672.682588 4821.377705 4243.07253 2488.357852 2746.505857 3843.071559 6623.388662 6409.627228 6173.980801 5010.86021 DG 37:2; [M+NH4]+@8.28 4311.141171 1936.824545 6045.20217 5108.505242 6502.263317 3839.856306 2425.844919 5673.619533 8628.76325 5800.802821 10178.6713 4245.496065 DG 38:2; [M+NH4]+@8.48 23018.91768 13697.32202 27348.39499 27161.91288 29718.09714 25202.68467 7891.983485 28891.8803 31244.21031 37245.83815 26589.43284 20721.6867 DG 38:3; [M+NH4]+@8.17 36722.59262 27404.564 41982.21463 35520.63737 46556.47786 41646.74878 15511.28172 58683.04991 46680.93118 45924.33329 59060.69704 27899.10907 DG 38:4; [M+NH4]+@7.91 134781.511 75314.31399 140839.1955 117706.9599 121106.9293 97405.16593 29646.01657 186891.3982 153277.6314 130323.748 198591.5239 83989.04152 DG 38:5; [M+NH4]+@7.58 133401.9646 81974.52621 112110.2899 104525.6036 135778.2441 87296.96726 25891.80805 135173.1206 122895.7815 104358.7261 163396.7574 83083.15498 DG 38:6; [M+NH4]+@7.37 177954.4522 128469.5717 241863.4048 144552.3131 171761.0621 127915.4488 27466.10111 231567.4674 201670.0055 164860.189 250364.9759 128533.4447 DG 40:5; [M+NH4]+@8.09 50328.34338 33335.63383 54564.32205 40962.62518 54243.30205 32507.20756 9522.835984 61030.05566 58075.35225 52770.01201 77131.3024 39417.04406 DG 40:6; [M+NH4]+@7.80 172331.4447 57338.37165 158747.0359 90807.55028 124275.8122 93491.22014 23743.84782 115452.7271 171815.3945 77756.71538 250196.9839 64944.92778 DG 40:7; [M+NH4]+@7.39 92996.72563 58196.32436 76457.11455 61502.5567 90185.1471 55861.55251 24403.84127 140848.9837 117319.7815 54539.80873 137552.484 60872.16759 DG 40:8; [M+NH4]+@7.13 31377.91804 17195.01239 36179.73102 17564.62636 29558.42633 20182.9318 4692.618603 54702.35651 37670.57402 29581.22918 49031.52809 20506.44751 DG 42:1; [M+NH4]+@9.64 5134.030948 3974.119866 2909.380424 6107.179226 3605.576868 4424.963098 2495.552905 6654.816823 4418.427079 3016.955256 2634.498549 3999.476778 MG 17:0; [M+Li]+@3.20 92809.87934 100683.1503 87373.91628 86315.16016 107885.1616 84554.16421 103058.5236 73244.93401 82148.82489 78081.41853 77167.42823 85351.93639 MG 18:1; [M+NH4]+@2.90 982.1078085 1663.923889 751.3021902 5047.545999 2874.615583 2546.939717 623.0756358 2889.204724 3396.261482 4373.2122 6002.337606 1597.534162 PC 32:3; [M+H]+@5.18 20357.70109 11480.8037 15228.93094 29274.10402 25893.36071 21525.60038 12499.85596 24852.28811 21724.46365 21642.66191 22649.52784 13515.60632 PC 33:3; [M+H]+@5.57 41400.21784 33801.96767 33511.47108 27401.114 24964.76134 36424.51715 11962.7247 28052.29204 18334.03875 14343.26317 33653.67946 19341.45659 PC 34:4; [M+H]+@5.35 289161.8901 182309.2734 196792.5181 245481.7414 226683.6909 212960.2707 83886.54287 316132.3654 316983.1812 241301.8305 250729.9127 180694.6566 PC 36:5; [M+H]+@5.57 6295815.866 4188455.838 3853960.31 4668277.627 4403426.29 5830247.491 1692771.6 7887942.616 7137298.153 5657377.22 5931087.28 4365637.676 PC 36:6; [M+H]+@5.40 243091.9465 134808.6728 174687.6215 167518.1127 187013.6616 195017.0138 77410.18284 251963.5167 271932.2997 200540.1883 238350.8539 152707.2012 PC 37:6; [M+H]+@5.62 518778.0727 438043.9817 583806.388 427156.3859 412217.668 356525.0424 161994.1548 403992.2021 454561.5984 377408.3061 488330.5636 311925.5318 PC 38:2; [M+H]+@7.69 127388.0086 93918.62188 174398.5527 129981.0691 160660.6694 182698.7368 91275.88565 170245.4753 224668.3093 148997.2182 183829.0817 147428.3676 PC 38:7; [M+H]+@5.52 1374240.905 1066936.394 1229029.292 1170806.908 1276754.398 1174595.858 446775.8169 1803873.026 1626860.977 1161179.94 1630053.126 943456.9166 PC 38:9; [M+H]+@5.46 14020.03659 14688.88615 15105.31133 16661.14034 17612.07729 22001.88161 9135.388731 13094.29977 24523.7078 12259.83971 17710.44654 15054.1478 PC 39:1; [M+H]+@7.98 6276.611017 8716.519408 6365.134723 10125.84123 5187.7256 6454.242821 3092.805367 6374.458958 12304.63599 29143.15421 5718.60968 16276.34346 PC 39:7; [M+H]+@5.96 116167.0375 100275.6952 113253.1858 109874.2749 109668.5391 95479.20702 44009.43532 122576.6978 124543.3842 114210.6395 146257.091 84180.60835 PC 40:10; [M+H]+@5.60 42255.09877 32034.32815 30783.86867 45333.0062 33846.12216 27577.16036 16889.56934 48569.98131 52133.6999 32406.62012 45859.89998 37883.03756 PC 40:4; [M+H]+@7.39 108813.4049 101265.4471 107476.4119 200520.2783 149585.4754 88885.84884 67137.51234 142268.2924 142366.4518 123200.9559 142548.3002 112653.1635 PC 40:8; [M+H]+@5.62 3411471.955 3156427.93 3963670.778 3096114.553 3967124.521 3106336.052 1353830.955 4300044.171 4069027.744 2900292.437 4105942.427 2666488.808 PC 40:9; [M+H]+@5.41 85710.38761 63437.02935 70601.99277 70210.23122 75084.2449 57462.93983 22420.2189 102413.1198 111382.4683 66431.69605 97977.96858 51265.3039 PC 41:6; [M+H]+@7.00 27939.42063 28450.7871 21991.57399 21786.721 17730.64566 22531.93935 11989.6814 41900.54242 38498.24869 57223.05036 41501.60106 20922.28021 PC 42:11; [M+H]+@5.32 30836.59045 22214.48896 18033.97903 25405.24533 31075.48687 23843.25238 12200.43805 59428.86507 38259.33403 27348.00988 47926.68669 22819.04647 PC 42:2; [M+H]+@8.81 11534.63733 12498.50003 9178.697532 18178.45362 9104.015982 5506.770221 3920.458118 30867.98218 20265.5423 21402.66901 12936.79991 6871.034318 PC 42:9; [M+H]+@6.84 18242.10663 12945.93644 12446.87023 6870.632371 13687.11265 8529.571415 20580.17351 15550.06882 13893.28779 23399.2914 13668.7203 10435.46091 PC 44:12; [M+H]+@5.66 44876.36547 56740.15588 47384.02929 56215.70678 87872.79066 30077.49763 11023.67964 95388.47478 74399.83665 38252.42806 69464.73446 29202.01267 PE 36:0; [M+H]+@7.85 23992.68469 20458.51077 23713.01933 24088.28532 23133.79971 22625.43901 26895.61004 20863.77821 19477.95009 19126.45285 27576.24749 20324.40936 PE 36:4; [M+H]+@6.23 441627.6347 346721.4373 458960.0035 472753.8918 429009.7989 498632.9048 182374.7884 398262.9561 418975.5814 352357.0278 399346.9015 323567.8601 PS 38:6; [M+H]+@5.17 43334.47742 26351.41595 42691.44562 59641.91516 61840.3466 126235.4478 9964.633307 33556.09737 61256.97068 40856.57938 79889.26907 40353.18934 SM 32:1; [M]+@5.14 7043.195531 4773.570366 6069.769131 10119.41669 8108.789395 9448.639654 3272.959684 10750.99342 7413.559834 7526.308968 10021.15023 4190.842396 SM 34:0; [M+Na]+@6.09 2529.367262 499.3128638 2298.798642 416.6501336 2789.39537 2120.909925 1750.976846 4312.935527 3836.087026 860.657144 865.616599 668.4549567 SM 34:2; [M]+@5.30 28840.20447 29753.63766 33847.04906 35035.67482 39307.05992 24181.52002 13694.33092 63642.97267 53641.43211 23580.66521 43221.6252 19504.60001 SM 36:1; [M+Na]+@6.53 6900.541412 18322.38328 15003.61397 15285.22456 10170.12479 11801.41563 13688.22401 10959.42794 12300.83242 14973.36952 16527.65471 14481.91897 SM 36:2; [M+Na]+@6.03 3253.137315 636.9689001 1261.675036 2997.1141 3026.141296 11527.04255 5968.191258 1528.490799 3120.747986 2556.400951 1086.972846 1971.919374 SM 37:1; [M]+@6.80 38250.23866 33115.41437 35052.25096 58102.02508 46190.74348 31958.47268 19953.53153 54450.74284 49267.99657 41761.23723 72268.29939 28230.58004 SM 38:0; [M]+@7.44 19211.41782 21995.18436 11726.26704 25732.01436 17988.9068 4897.01468 2942.607422 45969.13881 26447.91204 7434.26238 11264.47997 14430.7897 SM 38:1; [M]+@7.23 102225.3012 103276.3041 106711.5566 142358.9464 157642.6626 94019.53348 32356.9398 229040.4663 157504.4283 67750.42782 125595.7246 78219.54156 SM 38:2; [M]+@6.50 13832.86193 7255.424988 9442.965062 12842.27871 15022.79444 14697.11402 4925.33459 15256.98823 22443.52007 9218.983998 16527.76718 4896.442976 SM 39:1; [M]+@7.52 14508.89607 8088.8225 7680.569479 13945.63261 11434.84502 11670.56832 6448.949176 24881.34204 15259.93434 7943.182213 11340.45801 8607.774266 SM 40:1; [M]+@7.82 117180.4905 121631.6817 118440.9179 180549.7486 184735.5179 100869.3731 39280.07879 399726.8086 238243.8021 98403.77005 146364.1057 138838.9111 SM 40:2; [M]+@7.41 29402.10057 45180.51851 36936.60186 63827.9393 56175.75365 42429.05585 19141.63585 86780.65489 66619.17522 48114.25104 56723.24161 34607.75912 SM 41:1; [M+Na]+@8.09 21642.66741 12523.70749 19585.23908 16961.48563 17455.02641 16024.31674 4826.427432 25659.49234 14621.18516 15493.921 28623.10747 14938.34098 SM 41:2; [M]+@7.59 19586.81305 14149.60212 20121.45606 20418.68217 19992.29737 17328.2828 5303.163877 29683.91932 22093.17492 17975.77427 28566.73947 15235.22545 SM 42:0; [M+Na]+@8.55 5534.86361 5936.113459 8052.186031 7906.299985 7693.336736 6420.731308 2258.388547 22881.79823 16639.84606 3742.922966 9609.780189 8176.051481 SM 42:1; [M]+@8.37 308682.6474 257011.8761 334751.064 383226.9373 394127.9058 325411.1797 92809.69472 719417.6691 514268.4078 287426.3454 473951.0209 275341.2272 SM 42:2; [M+Na]+@7.81 42471.35693 37579.50234 38225.66123 41428.11348 44809.25387 38596.50911 25714.71003 58919.97858 48845.40638 43771.41475 60959.55738 44179.4584 SM 43:1; [M]+@8.53 28031.28481 13586.56902 29309.55377 20007.15207 21282.67207 24332.2235 6752.796235 47281.8775 39264.79186 24622.88037 54483.5019 24243.28863 SM 43:2; [M+Na]+@7.98 341.374053 1221.537666 1267.280167 2248.050427 3942.350842 2086.962446 1052.532428 6803.504374 3687.89101 2764.045143 3018.386437 2628.911826 SM 43:5; [M]+@7.31 28552.64653 27280.18348 28126.58107 27999.12008 20639.75898 24891.86945 28416.69834 28119.34395 24339.15729 30515.84917 15292.27293 20632.6732 SM 44:1; [M]+@8.91 9645.032617 9443.824637 11087.0565 13075.6374 9625.10577 9820.212276 3291.525119 32731.77165 18337.11621 8673.930225 11863.5512 11505.5642 SM 44:2; [M]+@8.38 4338.179722 7793.980653 6777.371479 7454.099447 8886.17021 5814.615502 3204.752535 18329.98275 15117.28803 9693.687453 7030.175331 9543.776031 TG 40:0; [M+NH4]+@9.45 8527.736168 8874.78268 8197.250729 7512.550775 9554.532853 15120.93326 9635.76167 9747.900682 11776.25323 8230.781648 15175.72823 10642.66741 TG 42:0; [M+NH4]+@9.78 6838.092491 12830.93305 8762.683344 9073.789328 10583.11408 9886.258566 9109.016085 10685.57428 9820.081722 11766.62275 8548.545441 8086.441223 TG 44:1; [M+NH4]+@9.82 14536.39949 5195.360928 5941.960903 7004.65468 9266.572206 9807.93089 6172.375351 10923.86059 12077.56174 9047.124787 11482.22963 9697.524429 TG 44:2; [M+NH4]+@9.50 9143.45534 5642.617366 2592.460924 5448.981701 7362.00295 5638.161267 2203.449708 6182.786893 7163.802887 6845.199718 6000.421168 5719.763817 TG 46:0; [M+NH4]+@10.29 43386.7711 34586.66427 20936.35534 31585.22286 40003.24642 41876.6461 20429.95891 43970.46873 39258.88722 15016.06091 42202.89621 12618.15212 TG 46:1; [M+NH4]+@10.08 50365.72979 32006.35833 19186.92553 25932.96515 44680.73287 40317.01973 12060.61383 41552.48139 39638.17126 13370.07527 37602.78995 10417.96699 TG 46:2; [M+NH4]+@9.83 32325.20514 12849.38144 12344.07253 21199.20955 30643.74814 16227.18769 7773.134371 22237.61333 33900.38317 7369.474311 23855.36472 7895.854071 TG 48:0; [M+NH4]+@10.55 91801.60376 67917.45877 76482.0889 119484.2445 160227.1592 121415.5875 34629.69945 124632.6071 75846.28958 47921.46498 168151.6718 32337.98587 TG 48:1; [M+NH4]+@10.35 190091.689 111822.1809 113835.3235 132763.0111 171064.6023 132520.7918 36798.2474 145142.8082 143995.9384 63237.98084 162663.647 48242.62823 TG 48:2; [M+NH4]+@10.12 177109.0726 88685.08761 65974.28866 109131.1905 159783.5929 96251.09211 40944.7812 114406.2272 121522.755 37255.98068 130536.8935 33604.69563 TG 48:3; [M+NH4]+@9.88 46699.80088 25856.48234 18580.19038 32668.01113 54634.16676 25155.57082 9561.457179 38484.63454 53127.79421 12043.58381 42061.66718 10444.21293 TG 49:0; [M+NH4]+@10.66 17044.59318 12316.03474 12653.68428 21224.34285 22363.06893 18567.8478 19610.42002 19817.54185 11332.79203 10591.07341 25054.4743 7619.380071 TG 49:1; [M+NH4]+@10.48 40743.15621 29954.08277 23491.08267 22967.9904 33484.52738 14748.90208 11142.89664 14209.90551 24232.87594 7878.807244 23135.34029 9922.051812 TG 49:2; [M+NH4]+@10.27 49891.40954 24890.63791 22236.64618 21999.13703 31522.36511 24355.08656 9310.64517 22056.04301 28355.71248 7846.662655 35753.90243 11032.58774 TG 49:3; [M+NH4]+@10.04 16035.07532 7526.406727 5667.061639 6682.724885 10974.94335 7576.961872 2381.689708 8783.804289 9490.388281 4169.003172 11164.4012 2141.174105 TG 50:0; [M+NH4]+@10.79 122478.9029 54150.07741 104245.2411 128521.5063 148939.2089 124551.0441 46285.147 141506.8323 66910.1403 80329.0584 183449.68 45241.22353 TG 50:1; [M+NH4]+@10.55 673242.5588 323837.9103 538235.7991 551045.7744 619355.4087 497781.8483 115268.2931 382783.6367 353746.088 363420.8279 558779.8664 253176.9821 TG 50:2; [M+NH4]+@10.35 809428.783 349606.2029 450532.185 491444.4193 683097.1737 434987.6703 123680.2366 429712.5049 414194.9296 393501.4573 614275.3766 239282.7429 TG 50:3; [M+NH4]+@10.18 321923.37 187259.2503 138130.4502 206416.1184 348541.5745 200712.4925 46771.81703 201240.8505 226427.2222 76729.78735 265217.9848 66134.08236 TG 50:4; [M+NH4]+@9.96 89903.74203 46083.24766 36015.35747 49923.52353 91081.17268 46920.31214 13084.26022 57768.42478 58292.08233 29455.6158 68011.92447 20466.63652 TG 50:5; [M+NH4]+@9.77 19136.85238 11602.97429 8202.289905 15268.06175 17922.4327 9272.927348 3995.350097 13974.78282 18774.70224 5685.070418 12528.21724 3679.879679 TG 51:1; [M+NH4]+@10.71 34644.62254 24863.20905 31150.30966 25856.33892 38463.18484 27063.67507 8170.558914 26823.04534 25111.03947 18479.41105 43799.80204 12595.66293 TG 51:2; [M+NH4]+@10.51 64595.36713 33409.25855 42950.75164 37789.17113 59317.84524 31285.44571 10246.78924 34814.8145 29996.68342 26373.21377 49322.0646 14055.50658 TG 51:3; [M+NH4]+@10.31 52033.64278 28369.95295 20366.92273 28460.38087 47186.38404 29926.9377 5135.536165 24847.83065 26076.82101 11786.84434 37593.52061 11312.62913 TG 51:4; [M+NH4]+@10.10 22671.64986 15892.18938 10037.00747 12696.21405 13902.71809 11650.61818 2002.26975 7392.022577 12174.47983 7327.570548 16138.86937 5094.755921 TG 51:5; [M+NH4]+@9.90 4449.941782 4185.725163 5788.023047 3184.422219 4926.947091 3838.032739 1038.413071 4460.628764 2194.125771 2367.641413 4689.545753 3417.175185 TG 52:0; [M+NH4]+@11.02 46677.58216 29889.51765 43365.10718 64495.11306 60114.86913 61918.99118 35940.3538 54873.92339 44425.37018 49281.70372 84978.79876 24916.4075 TG 52:1; [M+NH4]+@10.82 409113.4176 190742.8932 308990.5425 302221.3203 392955.5759 294033.8454 85816.93986 277214.7264 273718.0416 235653.0496 376096.351 150069.5653 TG 52:2; [M+NH4]+@10.59 1091516.35 631963.7903 751494.5858 764290.0991 986669.315 760287.9842 193510.9638 600162.704 561127.2597 839167.0276 766102.0745 559832.1069 TG 52:3; [M+NH4]+@10.37 1005948.565 502232.4767 614693.8797 715291.2954 941842.9924 552413.1923 198243.7347 449242.6094 501939.6585 1153386.263 653726.2612 752177.9109 TG 52:4; [M+NH4]+@10.18 660828.5613 308449.1216 348515.869 464420.843 675204.8444 377992.5 97860.29856 315597.5549 347860.9222 1497909.902 484659.366 803988.5663 TG 52:5; [M+NH4]+@10.01 150262.7491 91931.80184 65576.13311 93646.98575 159834.7757 92622.99196 20494.56062 88654.62077 95027.38184 78281.12549 118012.0629 69692.14273 TG 52:6;[M+NH4]+@9.8 59262.53395 24722.63196 33240.01372 30390.35347 38460.81845 36559.2905 7909.737643 42775.97572 40787.29931 20167.86209 45357.80401 16112.3477 TG 53:0; [M+NH4]+@11.14 25231.92335 31649.85024 42231.73623 74974.81799 97778.30244 103974.161 108607.1514 123796.7716 29399.29135 57447.72649 128998.5095 28638.3159 TG 53:2; [M+NH4]+@10.75 70568.43581 19970.16078 25564.8835 36546.11772 35929.7985 18538.74211 14513.69118 24543.79521 23988.16402 21938.59748 33621.55587 16903.53409 TG 53:3; [M+NH4]+@10.54 44837.63122 29826.74531 30165.69601 39407.66337 47573.21454 31180.4548 8126.380047 31536.21269 18858.95315 18318.843 39172.1632 18930.70891 TG 53:4; [M+NH4]+@10.35 23910.61543 12890.87746 12778.34567 23147.88498 28689.17239 17120.03935 3782.095848 16038.24988 15498.24281 21311.66157 25050.98465 16324.58687 TG 54:1; [M+NH4]+@11.04 53952.40122 41233.25613 46174.82125 46983.78977 31119.19774 36947.84453 12807.09303 33156.2361 42497.40623 55488.45683 51771.73976 30149.26185 TG 54:2; [M+NH4]+@10.85 293836.0306 123222.6963 191622.247 209602.2181 221621.6689 173966.2507 49787.83556 127340.5646 172567.7654 230106.7998 212542.6383 148488.6543 TG 54:3; [M+NH4]+@10.66 623342.0693 280884.87 383114.6546 424185.2041 547886.0646 357678.3012 107460.3453 251368.3803 265255.484 784261.456 397415.4225 492891.1816 TG 54:4; [M+NH4]+@10.46 623090.1909 268299.0842 369319.5866 391618.7541 586330.7049 334834.5855 87403.29545 250329.6456 294261.1629 1241682.937 390843.0167 795655.1373 TG 54:5; [M+NH4]+@10.25 556167.5438 278380.1934 357449.8737 356385.4118 598804.1911 305629.9243 72729.72349 273517.2409 286564.5976 2008746.814 366892.6943 1202636.231 TG 54:6; [M+NH4]+@10.11 324453.4822 146857.5657 234441.0892 201119.9677 257790.4788 158489.1397 51876.59745 188741.207 198931.7224 1819526.653 228269.5827 982346.8116 TG 54:7; [M+NH4]+@9.93 71599.65122 43275.54195 49444.96701 41854.11611 46477.0788 40198.71513 10288.47496 43062.52664 70382.25794 103921.2978 54618.19529 60810.29414 TG 54:8; [M+NH4]+@9.73 16541.15425 7656.869706 8590.578066 6940.793497 16775.78845 7927.417703 3229.182931 9333.298258 12806.79451 11106.72887 13852.1585 5902.780383 TG 55:3; [M+NH4]+@10.78 13819.34835 5331.31479 5552.745657 11874.2017 12637.10028 6450.577562 1063.47091 6668.630121 9198.482005 6948.337104 3094.908089 5456.979014 TG 56:4; [M+NH4]+@10.70 73852.71426 32770.78528 55386.92941 53201.58375 74656.57212 54028.39847 17808.34851 32632.49666 40638.29154 87224.27615 37416.83422 52111.77459 TG 56:5; [M+NH4]+@10.55 146566.6838 72310.88853 97984.63864 84314.41073 102297.4068 66064.2179 25286.45079 74035.06783 78390.50598 86782.30772 81788.73316 61722.30026 TG 56:6; [M+NH4]+@10.38 224016.709 126690.5221 226246.4697 151703.6771 200015.9061 149799.6114 35556.41592 183612.0338 168493.4772 79228.24156 186031.3622 71607.21461 TG 56:7; [M+NH4]+@10.21 249650.4688 149844.0977 270471.7124 165828.3215 194994.1674 165677.1868 47968.71928 171961.8349 185417.3507 71774.8162 145494.7466 86128.71694 TG 56:8; [M+NH4]+@10.05 117744.9552 76710.50065 122213.3569 85768.66129 94568.24072 78085.1055 23079.99441 86282.89627 93788.38662 26433.87239 67312.52683 30482.30112 TG 56:9; [M+NH4]+@9.85 20043.76003 16630.18681 13978.58554 10591.25955 12342.20316 12540.99625 4008.954671 11874.02465 14279.97079 5819.945082 12699.26954 6951.873742 TG 57:7; [M+NH4]+@10.30 9661.21442 5018.428558 10006.65851 6485.028885 5986.115794 3984.275753 1610.602798 7198.111992 5204.899068 7381.970072 6474.379507 5119.358668 TG 58:10; [M+NH4]+@9.91 30654.62127 17849.90939 33384.63939 19496.7585 18579.81567 13742.06338 4637.388315 26753.62061 29523.97153 7952.633642 18828.55317 12500.91396 TG 58:12; [M+NH4]+@9.61 358.9529661 427.5930473 1538.956717 1140.415055 698.5990876 640.8749524 706.2114135 1644.66017 1581.361108 561.6304709 1618.339418 1385.868034 TG 58:3; [M+NH4]+@11.12 3442.065393 2733.759702 1599.188241 4834.854169 7122.078119 43.8943052 1723.826707 4095.030456 2840.270381 11869.46566 3973.87601 9966.78281 TG 58:6; [M+NH4]+@10.57 54352.9075 25935.14296 52003.42712 32925.89538 48577.02258 27453.97207 11972.88545 32835.09286 49845.82511 28308.82478 30481.73785 20200.62597 TG 58:7; [M+NH4]+@10.44 81112.43443 47733.37106 96926.34726 73676.76078 82243.91999 61664.626 18357.67743 64765.41141 79618.57302 34658.85392 50973.61285 34629.33021 TG 58:8; [M+NH4]+@10.29 87761.97928 49229.25738 116078.7293 65258.16982 78071.72112 62338.06586 29096.60505 73911.86942 85298.88633 31660.05581 62169.08606 30001.64669 TG 58:9; [M+NH4]+@10.16 62066.167 34105.06254 77322.25715 42541.6206 57574.50457 40144.08407 17663.48793 59777.52993 62042.83911 20997.00888 38094.22437 22452.98933 TG 60:10; [M+NH4]+@10.21 14548.97811 11821.2219 15332.69815 11983.14811 19049.6523 7529.1797 2958.448978 13969.51003 16825.10411 7493.203274 7676.619209 7647.298309 TG 60:11; [M+Na]+@10.01 6713.937433 6784.18534 7691.817685 5501.556093 5689.449087 4726.036628 1976.778374 6760.6486 7349.757782 3764.505683 2990.345735 2820.091622 TG 60:12; [M+NH4]+@9.91 14043.13489 8273.698134 24793.83788 8957.844567 11612.95581 9070.136404 3444.390815 14136.67811 21739.88417 8013.799762 10617.24104 7765.174346 TG 60:13; [M+NH4]+@9.71 1189.452366 2235.006323 628.3254171 705.3623641 913.3663664 282.4340312 1348.666294 1343.321893 2329.841934 145.1672345 871.2498196 525.8941133 TG 62:13; [M+NH4]+@9.88 4379.045294 6680.923258 16656.59117 5076.814088 7982.870019 3002.451269 1900.748651 10376.49854 9014.940148 2429.269058 6837.506757 4726.751856 lysoPC 14:0; [M+H]+@0.99 187.1003663 5009.441063 5025.657035 4802.926201 647.7869164 4370.639015 1878.579663 89.99766039 6137.191663 4093.059169 496.5432701 4528.738608 lysoPC 16:0; [M+H]+@1.57 218745.3886 288935.8325 224302.222 197854.4702 231246.0857 223498.8972 178566.0454 403209.675 320891.2514 329403.1141 233644.2233 248491.7234 lysoPC 16:1; [M+H]+@1.14 248166.4104 239277.289 213646.4329 187972.2908 249653.7444 176797.2244 197221.4839 226396.9198 222952.1128 231323.5648 213734.3527 215926.1658 lysoPC 17:1; [M+H]+@1.38 76454.93093 42467.66404 45225.08663 46643.46872 51711.93598 39893.43604 24908.00125 66808.57663 71306.51306 17983.39353 56067.88382 35310.62129 lysoPC 18:0; [M+H]+@2.32 177593.3827 165606.109 234147.3394 210348.2678 221992.9221 210170.1697 244307.3327 379198.8523 250876.4749 312951.1781 221776.8186 257489.9269 lysoPC 18:2; [M+H]+@1.42 26014.44576 30065.9728 16850.22153 28515.32211 18856.23838 34362.55983 38055.47621 59024.9843 64132.36263 41577.65958 24020.01191 41038.37919 lysoPC 18:3; [M+H]+@1.04 8266.381241 224748.9195 269322.0655 278494.4947 294275.4678 273992.5776 183314.3813 290946.8072 268427.1051 9875.019543 299223.5195 5238.315232 lysoPC 19:0; [M+H]+@2.82 39416.23644 15513.34687 43538.62205 40317.0038 54022.25724 48044.13617 38747.90192 34832.55125 48572.13743 42969.50635 62055.84887 39937.40739 lysoPC 20:0; [M+H]+@3.34 209748.1663 153705.0688 213939.8566 193555.2276 230199.8356 274734.0644 188902.6625 283478.645 229141.7418 196760.8324 280480.0219 168933.6283 lysoPC 20:1; [M+H]+@2.53 161041.2012 154595.6069 182533.5126 161387.6001 186340.7936 131797.9335 161024.541 168070.5449 146977.3062 156393.7615 184547.8828 135227.7641 lysoPC 20:3; [M+H]+@1.51 277582.6143 224748.9195 269322.0655 87129.55164 294275.4678 273992.5776 183314.3813 290946.8072 268427.1051 265491.7907 119413.8673 217656.0813 lysoPC 22:5; [M+H]+@1.45 3080.230493 3910.654221 6585.863739 5792.357866 5624.797536 1162.568769 2704.440637 9506.206893 1111.295656 11040.98013 7956.116863 10616.49014 lysoPC 22:6; [M+H]+@1.30 18157.05879 8097.38691 23914.71541 22940.17016 10911.53121 33600.31217 14207.72667 32655.12371 13767.16133 26658.32963 23836.83107 22023.60126 lysoPE 16:0; [M+H]+@1.64 8509.60937 15564.14281 11912.01685 8492.601023 10762.67516 13265.37916 4328.659737 12804.58844 10721.41845 7920.833477 7914.089574 10096.16912 lysoPE 18:2; [M+H]+@1.29 19405.36804 22277.69443 14649.21404 18062.52313 16951.52632 16314.81824 11856.27612 19815.68868 14761.17456 21255.4603 12884.47696 12909.68001 plasmenyl-PC 38:0; [M+Na]+@7.64 6461.340562 17436.37702 9005.986389 18587.62665 17580.14545 2301.516652 7133.787822 30674.4025 21098.95561 10077.37273 13064.83341 13543.96259 plasmenyl-PE 36:0; [M+H]+@8.19 7414.84379 5900.727069 7297.737289 7057.696246 6991.617615 7008.14621 2235.021249 9206.401891 8831.229399 7396.526749 8037.58626 3311.687179 plasmenyl-PE 36:2; [M+H]+@7.29 211276.8402 280995.7907 269396.446 358060.367 360839.2237 267585.3379 121503.7855 612532.419 379254.8195 208633.2294 213687.6243 237881.8636 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 502.3269;[+]+@1.94 1.94 699.496; [+]+@8.30 8.3 764.5225; [+]+@6.28 6.28 780.5538; [+]+@7.66 7.66 788.5225; [+]+@5.86 5.86 CE(20:4); [M+NH4]+@10.54 10.54 6479222 LMST01020014 LipidMaps DG 30:0; [M+NH4]+@7.37 7.37 DG(30:0) LipidMaps Bulk ID DG 30:1; [M+NH4]+@6.89 6.89 DG(30:1) LipidMaps Bulk ID DG 31:0; [M+NH4]+@7.63 7.63 DG(31:0) LipidMaps Bulk ID DG 32:0; [M+NH4]+@7.85 7.85 DG(32:0) LipidMaps Bulk ID DG 32:1; [M+NH4]+@7.44 7.44 DG(32:1) LipidMaps Bulk ID DG 32:2; [M+NH4]+@7.03 7.03 DG(32:2) LipidMaps Bulk ID DG 33:0; [M+NH4]+@8.10 8.1 DG(33:0) LipidMaps Bulk ID DG 33:1; [M+NH4]+@7.71 7.71 DG(33:1) LipidMaps Bulk ID DG 33:2; [M+NH4]+@7.24 7.24 DG(33:2) LipidMaps Bulk ID DG 34:0; [M+NH4]+@8.38 8.38 DG(34:0) LipidMaps Bulk ID DG 34:2; [M+NH4]+@7.54 7.54 DG(34:2) LipidMaps Bulk ID DG 34:3; [M+NH4]+@7.20 7.2 DG(34:3) LipidMaps Bulk ID DG 35:1; [M+NH4]+@8.19 8.19 DG(35:1) LipidMaps Bulk ID DG 35:2; [M+NH4]+@7.84 7.84 DG(35:2) LipidMaps Bulk ID DG 36:0; [M+NH4]+@8.83 8.83 DG(36:0) LipidMaps Bulk ID DG 36:1; [M+NH4]+@8.44 8.44 DG(36:1) LipidMaps Bulk ID DG 36:2; [M+NH4]+@8.02 8.02 DG(36:2) LipidMaps Bulk ID DG 36:3; [M+NH4]+@7.66 7.66 DG(36:3) LipidMaps Bulk ID DG 36:5; [M+NH4]+@6.98 6.98 DG(36:5) LipidMaps Bulk ID DG 37:1; [M+NH4]+@8.66 8.66 DG(37:1) LipidMaps Bulk ID DG 37:2; [M+NH4]+@8.28 8.28 DG(37:2) LipidMaps Bulk ID DG 38:2; [M+NH4]+@8.48 8.48 DG(38:2) LipidMaps Bulk ID DG 38:3; [M+NH4]+@8.17 8.17 DG(38:3) LipidMaps Bulk ID DG 38:4; [M+NH4]+@7.91 7.91 DG(38:4) LipidMaps Bulk ID DG 38:5; [M+NH4]+@7.58 7.58 DG(38:5) LipidMaps Bulk ID DG 38:6; [M+NH4]+@7.37 7.37 DG(38:6) LipidMaps Bulk ID DG 40:5; [M+NH4]+@8.09 8.09 DG(40:5) LipidMaps Bulk ID DG 40:6; [M+NH4]+@7.80 7.8 DG(40:6) LipidMaps Bulk ID DG 40:7; [M+NH4]+@7.39 7.39 DG(40:7) LipidMaps Bulk ID DG 40:8; [M+NH4]+@7.13 7.13 DG(40:8) LipidMaps Bulk ID DG 42:1; [M+NH4]+@9.64 9.64 DG(42:1) LipidMaps Bulk ID MG 17:0; [M+Li]+@3.20 3.2 107036 LMGL01010002 LipidMaps MG 18:1; [M+NH4]+@2.90 2.9 MG(18:1) LipidMaps Bulk ID PC 32:3; [M+H]+@5.18 5.18 PC(32:3) LipidMaps Bulk ID PC 33:3; [M+H]+@5.57 5.57 PC(33:3) LipidMaps Bulk ID PC 34:4; [M+H]+@5.35 5.35 PC(34:4) LipidMaps Bulk ID PC 36:5; [M+H]+@5.57 5.57 PC(36:5) LipidMaps Bulk ID PC 36:6; [M+H]+@5.40 5.4 PC(36:6) LipidMaps Bulk ID PC 37:6; [M+H]+@5.62 5.62 PC(37:6) LipidMaps Bulk ID PC 38:2; [M+H]+@7.69 7.69 PC(38:2) LipidMaps Bulk ID PC 38:7; [M+H]+@5.52 5.52 PC(38:7) LipidMaps Bulk ID PC 38:9; [M+H]+@5.46 5.46 PC(38:9) LipidMaps Bulk ID PC 39:1; [M+H]+@7.98 7.98 PC(39:1) LipidMaps Bulk ID PC 39:7; [M+H]+@5.96 5.96 PC(39:7) LipidMaps Bulk ID PC 40:10; [M+H]+@5.60 5.6 PC(40:10) LipidMaps Bulk ID PC 40:4; [M+H]+@7.39 7.39 PC(40:4) LipidMaps Bulk ID PC 40:8; [M+H]+@5.62 5.62 PC(40:8) LipidMaps Bulk ID PC 40:9; [M+H]+@5.41 5.41 PC(40:9) LipidMaps Bulk ID PC 41:6; [M+H]+@7.00 7 PC(41:6) LipidMaps Bulk ID PC 42:11; [M+H]+@5.32 5.32 PC(42:11) LipidMaps Bulk ID PC 42:2; [M+H]+@8.81 8.81 PC(42:2) LipidMaps Bulk ID PC 42:9; [M+H]+@6.84 6.84 PC(42:9) LipidMaps Bulk ID PC 44:12; [M+H]+@5.66 5.66 24779134 LMGP01011119 LipidMaps PE 36:0; [M+H]+@7.85 7.85 PE(36:0) LipidMaps Bulk ID PE 36:4; [M+H]+@6.23 6.23 PE(36:4) LipidMaps Bulk ID PS 38:6; [M+H]+@5.17 5.17 PS(38:6) LipidMaps Bulk ID SM 32:1; [M]+@5.14 5.14 11433862 SM 34:0; [M+Na]+@6.09 6.09 9939965 SM 34:2; [M]+@5.30 5.3 SM 34:2 LipidBLAST SM 36:1; [M+Na]+@6.53 6.53 44260139 SM 36:2; [M+Na]+@6.03 6.03 SM 36:2 LipidBLAST SM 37:1; [M]+@6.80 6.8 SM 37:1 LipidBLAST SM 38:0; [M]+@7.44 7.44 44260131 SM 38:1; [M]+@7.23 7.23 SM 38:1 LipidBLAST SM 38:2; [M]+@6.50 6.5 SM 38:2 LipidBLAST SM 39:1; [M]+@7.52 7.52 SM 39:1 LipidBLAST SM 40:1; [M]+@7.82 7.82 SM 40:1 LipidBLAST SM 40:2; [M]+@7.41 7.41 SM 40:2 LipidBLAST SM 41:1; [M+Na]+@8.09 8.09 SM 41:1 LipidBLAST SM 41:2; [M]+@7.59 7.59 SM 41:2 LipidBLAST SM 42:0; [M+Na]+@8.55 8.55 44260134 SM 42:1; [M]+@8.37 8.37 44260133 SM 42:2; [M+Na]+@7.81 7.81 SM 42:2 LipidBLAST SM 43:1; [M]+@8.53 8.53 SM 43:1 LipidBLAST SM 43:2; [M+Na]+@7.98 7.98 SM 43:2 LipidBLAST SM 43:5; [M]+@7.31 7.31 SM 43:5 LipidBLAST SM 44:1; [M]+@8.91 8.91 SM 44:1 LipidBLAST SM 44:2; [M]+@8.38 8.38 SM 44:2 LipidBLAST TG 40:0; [M+NH4]+@9.45 9.45 TG(40:0) LipidMaps Bulk ID TG 42:0; [M+NH4]+@9.78 9.78 TG(42:0) LipidMaps Bulk ID TG 44:1; [M+NH4]+@9.82 9.82 TG(44:1) LipidMaps Bulk ID TG 44:2; [M+NH4]+@9.50 9.5 TG(44:2) LipidMaps Bulk ID TG 46:0; [M+NH4]+@10.29 10.29 TG(46:0) LipidMaps Bulk ID TG 46:1; [M+NH4]+@10.08 10.08 TG(46:1) LipidMaps Bulk ID TG 46:2; [M+NH4]+@9.83 9.83 TG(46:2) LipidMaps Bulk ID TG 48:0; [M+NH4]+@10.55 10.55 TG(48:0) LipidMaps Bulk ID TG 48:1; [M+NH4]+@10.35 10.35 TG(48:1) LipidMaps Bulk ID TG 48:2; [M+NH4]+@10.12 10.12 TG(48:2) LipidMaps Bulk ID TG 48:3; [M+NH4]+@9.88 9.88 TG(48:3) LipidMaps Bulk ID TG 49:0; [M+NH4]+@10.66 10.66 TG(49:0) LipidMaps Bulk ID TG 49:1; [M+NH4]+@10.48 10.48 TG(49:1) LipidMaps Bulk ID TG 49:2; [M+NH4]+@10.27 10.27 TG(49:2) LipidMaps Bulk ID TG 49:3; [M+NH4]+@10.04 10.04 TG(49:3) LipidMaps Bulk ID TG 50:0; [M+NH4]+@10.79 10.79 TG(50:0) LipidMaps Bulk ID TG 50:1; [M+NH4]+@10.55 10.55 TG(50:1) LipidMaps Bulk ID TG 50:2; [M+NH4]+@10.35 10.35 TG(50:2) LipidMaps Bulk ID TG 50:3; [M+NH4]+@10.18 10.18 TG(50:3) LipidMaps Bulk ID TG 50:4; [M+NH4]+@9.96 9.96 TG(50:4) LipidMaps Bulk ID TG 50:5; [M+NH4]+@9.77 9.77 TG(50:5) LipidMaps Bulk ID TG 51:1; [M+NH4]+@10.71 10.71 TG(51:1) LipidMaps Bulk ID TG 51:2; [M+NH4]+@10.51 10.51 TG(51:2) LipidMaps Bulk ID TG 51:3; [M+NH4]+@10.31 10.31 TG(51:3) LipidMaps Bulk ID TG 51:4; [M+NH4]+@10.10 10.1 TG(51:4) LipidMaps Bulk ID TG 51:5; [M+NH4]+@9.90 9.9 TG(51:5) LipidMaps Bulk ID TG 52:0; [M+NH4]+@11.02 11.02 TG(52:0) LipidMaps Bulk ID TG 52:1; [M+NH4]+@10.82 10.82 TG(52:1) LipidMaps Bulk ID TG 52:2; [M+NH4]+@10.59 10.59 TG(52:2) LipidMaps Bulk ID TG 52:3; [M+NH4]+@10.37 10.37 TG(52:3) LipidMaps Bulk ID TG 52:4; [M+NH4]+@10.18 10.18 TG(52:4) LipidMaps Bulk ID TG 52:5; [M+NH4]+@10.01 10.01 TG(52:5) LipidMaps Bulk ID TG 52:6;[M+NH4]+@9.8 9.8 TG(52:6) LipidMaps Bulk ID TG 53:0; [M+NH4]+@11.14 11.14 TG(53:0) LipidMaps Bulk ID TG 53:2; [M+NH4]+@10.75 10.75 TG(53:2) LipidMaps Bulk ID TG 53:3; [M+NH4]+@10.54 10.54 TG(53:3) LipidMaps Bulk ID TG 53:4; [M+NH4]+@10.35 10.35 TG(53:4) LipidMaps Bulk ID TG 54:1; [M+NH4]+@11.04 11.04 TG(54:1) LipidMaps Bulk ID TG 54:2; [M+NH4]+@10.85 10.85 TG(54:2) LipidMaps Bulk ID TG 54:3; [M+NH4]+@10.66 10.66 TG(54:3) LipidMaps Bulk ID TG 54:4; [M+NH4]+@10.46 10.46 TG(54:4) LipidMaps Bulk ID TG 54:5; [M+NH4]+@10.25 10.25 TG(54:5) LipidMaps Bulk ID TG 54:6; [M+NH4]+@10.11 10.11 TG(54:6) LipidMaps Bulk ID TG 54:7; [M+NH4]+@9.93 9.93 TG(54:7) LipidMaps Bulk ID TG 54:8; [M+NH4]+@9.73 9.73 TG(54:8) LipidMaps Bulk ID TG 55:3; [M+NH4]+@10.78 10.78 TG(55:3) LipidMaps Bulk ID TG 56:4; [M+NH4]+@10.70 10.7 TG(56:4) LipidMaps Bulk ID TG 56:5; [M+NH4]+@10.55 10.55 TG(56:5) LipidMaps Bulk ID TG 56:6; [M+NH4]+@10.38 10.38 TG(56:6) LipidMaps Bulk ID TG 56:7; [M+NH4]+@10.21 10.21 TG(56:7) LipidMaps Bulk ID TG 56:8; [M+NH4]+@10.05 10.05 TG(56:8) LipidMaps Bulk ID TG 56:9; [M+NH4]+@9.85 9.85 TG(56:9) LipidMaps Bulk ID TG 57:7; [M+NH4]+@10.30 10.3 TG(57:7) LipidMaps Bulk ID TG 58:10; [M+NH4]+@9.91 9.91 TG(58:10) LipidMaps Bulk ID TG 58:12; [M+NH4]+@9.61 9.61 TG(58:12) LipidMaps Bulk ID TG 58:3; [M+NH4]+@11.12 11.12 TG(58:3) LipidMaps Bulk ID TG 58:6; [M+NH4]+@10.57 10.57 TG(58:6) LipidMaps Bulk ID TG 58:7; [M+NH4]+@10.44 10.44 TG(58:7) LipidMaps Bulk ID TG 58:8; [M+NH4]+@10.29 10.29 TG(58:8) LipidMaps Bulk ID TG 58:9; [M+NH4]+@10.16 10.16 TG(58:9) LipidMaps Bulk ID TG 60:10; [M+NH4]+@10.21 10.21 TG(60:10) LipidMaps Bulk ID TG 60:11; [M+Na]+@10.01 10.01 TG(60:11) LipidMaps Bulk ID TG 60:12; [M+NH4]+@9.91 9.91 TG(60:12) LipidMaps Bulk ID TG 60:13; [M+NH4]+@9.71 9.71 TG(60:13) LipidMaps Bulk ID TG 62:13; [M+NH4]+@9.88 9.88 TG(62:13) LipidMaps Bulk ID lysoPC 14:0; [M+H]+@0.99 .99 LPC(14:0) LipidMaps Bulk ID lysoPC 16:0; [M+H]+@1.57 1.57 LPC(16:0) LipidMaps Bulk ID lysoPC 16:1; [M+H]+@1.14 1.14 LPC(16:1) LipidMaps Bulk ID lysoPC 17:1; [M+H]+@1.38 1.38 LPC(17:1) LipidMaps Bulk ID lysoPC 18:0; [M+H]+@2.32 2.32 LPC(18:0) LipidMaps Bulk ID lysoPC 18:2; [M+H]+@1.42 1.42 LPC(18:2) LipidMaps Bulk ID lysoPC 18:3; [M+H]+@1.04 1.04 LPC(18:3) LipidMaps Bulk ID lysoPC 19:0; [M+H]+@2.82 2.82 24779472 LMGP01050041 LipidMaps lysoPC 20:0; [M+H]+@3.34 3.34 24779473 LMGP01050045 LipidMaps lysoPC 20:1; [M+H]+@2.53 2.53 LPC(20:1) LipidMaps Bulk ID lysoPC 20:3; [M+H]+@1.51 1.51 LPC(20:3) LipidMaps Bulk ID lysoPC 22:5; [M+H]+@1.45 1.45 LPC(22:5) LipidMaps Bulk ID lysoPC 22:6; [M+H]+@1.30 1.3 10415542 LMGP01050056 LipidMaps lysoPE 16:0; [M+H]+@1.64 1.64 LPE(16:0) LipidMaps Bulk ID lysoPE 18:2; [M+H]+@1.29 1.29 LPE(18:2) LipidMaps Bulk ID plasmenyl-PC 38:0; [M+Na]+@7.64 7.64 PC(P-38:0) LipidMaps Bulk ID plasmenyl-PE 36:0; [M+H]+@8.19 8.19 PE(P-36:0) LipidMaps Bulk ID plasmenyl-PE 36:2; [M+H]+@7.29 7.29 PE(P-36:2) LipidMaps Bulk ID METABOLITES_END #END