"Metabolite name","Identifier","Annotation","InChIKey","Species","count","ESI mode","m/z","RT","qc_mean","qc_sd","qc_cv","class","ESI","keep" "Feature025","5.78_572.48_5.76_596.53","Ceramide (d34:1)","YDNKGFDKKRUKPY-TURZORIXSA-N","[M+Cl]-_[M+Hac-H]-",40,"(-) ES)","572.4815_596.5264",5.77,20985.4,1064.5744689781,19.7124772493785,"Cer","neg",TRUE "Feature026","7.18_628.55","Ceramide (d38:1)","XWBWIAOWSABHFI-NUKVNZTCSA-N","[M+Cl]-",40,"(-) ES)","628.54520000000002",7.18,4417,217.008064366281,20.3540822913598,"Cer","neg",TRUE "Feature027","8.18_670.59","Ceramide (d41:1)","NAJHAHQNQCNWOP-PUYNVXOJSA-N?","[M+Cl]-",40,"(-) ES)","670.5915",8.18,18551.4,1472.39831567412,12.599443915763,"Cer","neg",TRUE "Feature028","8.50_684.61_8.50_708.65","Ceramide (d42:1)","ZJVVOYPTFQEGPH-AUTSUKAISA-N","[M+Cl]-",40,"(-) ES)","684.6068_708.6511",8.5,165194.6,14628.2495637721,11.2928480799996,"Cer","neg",TRUE "Feature030","7.91_682.59","Ceramide (d42:2) B","VJSBNBBOSZJDKB-KPEYJIHVSA-N","[M+Cl]-",38,"(-) ES)","682.59320000000002",7.91,1172.4,967.783705173837,1.21142771234137,"Cer","neg",TRUE "Feature031","7.18_818.63","GlcCer (d40:1)","YIGARKIIFOHVPF-YAEABVQUSA-N","[M+Cl]-",40,"(-) ES)","818.6277",7.18,4717.2,360.515880371448,13.0845831122328,"Cer","neg",TRUE "Feature032","7.83_846.66","GlcCer (d42:1)","POQRWMRXUOPCLD-AAAFHMTMSA-N","[M+Cl]-",40,"(-) ES)","846.65840000000003",7.83,2958,2820.59949301562,1.0487132282781,"Cer","neg",TRUE "Feature033","7.16_844.65","GlcCer (d42:2)","WBOZIXHPUPAOIA-RBELZSLISA-N","[M+Cl]-",40,"(-) ES)","844.64530000000002",7.16,4191.2,446.888912370849,9.37861711037922,"Cer","neg",TRUE "Feature040","4.58_788.54","PC (32:2)","GPWHCUUIQMGELX-VHQDNGOZSA-N","[M+Hac-H]-",40,"(-) ES)","788.54459999999995",4.58,2769.6,276.667309236202,10.0105791596632,"PC","neg",TRUE "Feature043","5.18_816.58","PC (34:2)","JLPULHDHAOZNQI-ZTIMHPMXSA-N","[M+Hac-H]-",40,"(-) ES)","816.57709999999997",5.18,139850.2,9551.88241657109,14.641114065368,"PC","neg",TRUE "Feature044","4.82_814.56","PC (34:3)","CNNSEHUKQJCGTE-UPPWDXJYSA-N","[M+Hac-H]-",40,"(-) ES)","814.56100000000004",4.82,3042,710.058096214669,4.28415648834504,"PC","neg",TRUE "Feature045","5.51_830.59","PC (35:2)","ZSKWZJYUVZYDQU-WESJWMGVSA-N","[M+Hac-H]-",40,"(-) ES)","830.58969999999999",5.51,3962,189.910505238652,20.8624583196234,"PC","neg",TRUE "Feature048","5.35_842.59","PC (36:3) B","YPAZQMWFRMHBBM-CLKMJQEKSA-N","[M+Hac-H]-",40,"(-) ES)","842.59220000000005",5.35,29331.6,1624.9213211722,18.0510893775709,"PC","neg",TRUE "Feature051","4.70_838.56","PC (36:5) B","DYDDZDMJSQYFGN-OIVUZXIWSA-N","[M+Hac-H]-",40,"(-) ES)","838.5607",4.7,7166.6,244.435676610433,29.3189607154675,"PC","neg",TRUE "Feature052","6.03_870.62","PC (38:3)","OJHJKEBRZSDTTL-VHWCKNCUSA-N","[M+Hac-H]-",40,"(-) ES)","870.62429999999995",6.03,16112,791.96433000483,20.344350609707,"PC","neg",TRUE "Feature057","5.77_894.62","PC (40:5) A","LJFKFKIYUJNFPZ-ZLFSCUDPSA-N","[M+Hac-H]-",40,"(-) ES)","894.62239999999997",5.77,1905.4,963.017029963645,1.97857352540477,"PC","neg",TRUE "Feature058","5.57_892.61","PC (40:6) B","FYVNIFOYDIIODX-KNKJIUSSSA-N","[M+Hac-H]-",40,"(-) ES)","892.60749999999996",5.57,8686.8,568.841542083558,15.271036584603,"PC","neg",TRUE "Feature060","5.58_802.60","PC (p-34:1) or PC (o-34:2) A","MBRHHFWRXQYYAN-RTVLTNFHSA-N","[M+Hac-H]-",40,"(-) ES)","802.59670000000006",5.58,3406.8,143.072359315138,23.8117272707862,"PC","neg",TRUE "Feature061","5.47_800.58","PC (p-34:2) or PC (o-34:3)","QLEHHUPUHJPURI-PWYDUFMYSA-N","[M+Hac-H]-",40,"(-) ES)","800.58069999999998",5.47,6450.2,392.448340549428,16.435793793827,"PC","neg",TRUE "Feature062","5.47_826.60","PC (p-36:3) or PC (o-36:4)","SOUZQPFUXRVDGK-KCTKZSJBSA-N","[M+Hac-H]-",40,"(-) ES)","826.59720000000004",5.47,8328.8,296.581691950127,28.0826505008966,"PC","neg",TRUE "Feature065","6.02_852.61","PC (p-38:4) or PC (o-38:5) B","DBQMOXDLWKVKKG-REWQMPQJSA-N","[M+Hac-H]-",40,"(-) ES)","852.61329999999998",6.02,1793.8,199.162496469591,9.00671578132122,"PC","neg",TRUE "Feature066","5.97_742.54","PE (36:2)","MWRBNPKJOOWZPW-CLFAGFIQSA-N","[M-H]-",40,"(-) ES)","742.53880000000004",5.97,3449.2,357.979329012165,9.63519320938999,"PE","neg",TRUE "Feature067","5.20_738.51","PE (36:4)","DUQDVNACTOXOJA-KTKXOIIHSA-N","[M-H]-",40,"(-) ES)","738.50840000000005",5.2,5900.6,469.45905039737,12.5689343831064,"PE","neg",TRUE "Feature069","5.07_762.51","PE (38:6)","VRBJSZDBPQLNEM-PFTGJCAASA-N","[M-H]-",38,"(-) ES)","762.50789999999995",5.07,3845,295.317625616894,13.0198798394377,"PE","neg",TRUE "Feature070","5.63_698.51","PE (p-34:2) or PE (o-34:3)","LALFTIIBOJSVNP-OBEJFMRTSA-N","[M-H]-",40,"(-) ES)","698.51189999999997",5.63,2925.2,154.517636533827,18.9311722960479,"PE","neg",TRUE "Feature071","6.30_726.54","PE (p-36:2) or PE (o-36:3)","XVXISDREVDGQPX-PISDLAQISA-N","[M-H]-",40,"(-) ES)","726.54150000000004",6.3,3731.4,207.714467478796,17.9640833173111,"PE","neg",TRUE "Feature072","5.50_722.51","PE (p-36:4) or PE (o-36:5)","UUYSKERSKRMYME-MAIXUNBTSA-N","[M-H]-",40,"(-) ES)","722.51289999999995",5.5,9129.4,821.995620426289,11.1063852083123,"PE","neg",TRUE "Feature073","6.19_750.54","PE (p-38:4) or PE (o-38:5)","URPXXNCTXCOATD-FXMFQVEGSA-N","[M-H]-",40,"(-) ES)","750.54489999999998",6.19,9397.8,1279.04757534659,7.34749838953676,"PE","neg",TRUE "Feature074","5.56_748.53","PE (p-38:5) or PE (o-38:6)","KCNBSSYOJRUKOM-JALPNNRCSA-N","[M-H]-",40,"(-) ES)","748.52880000000005",5.56,8159,1366.34915010769,5.97138732757799,"PE","neg",TRUE "Feature075","5.32_746.51","PE (p-38:6) or PE (o-38:7)","WVGALBKSWOUIEZ-XNHMFJFDSA-N","[M-H]-",40,"(-) ES)","746.51260000000002",5.32,5213.6,240.67883164084,21.6620629427857,"PE","neg",TRUE "Feature076","5.97_774.54","PE (p-40:6) or PE (o-40:7)","FIJFPUAJUDAZEY-MNDXXDKYSA-N","[M-H]-",40,"(-) ES)","774.54409999999996",5.97,2529,262.193630738811,9.64554323029803,"PE","neg",TRUE "Feature078","4.57_747.57","SM (d33:1)","LQINJRUGTUOHGS-YPDYIYJKSA-N","[M+Hac-H]-",40,"(-) ES)","747.56690000000003",4.57,4975.4,2219.55081041187,2.24162473625766,"SM","neg",TRUE "Feature084","6.25_843.66","SM (d40:2) A","FOULCGVQZYQEQM-DNXGLLHMSA-N","[M+Hac-H]-",40,"(-) ES)","843.66",6.25,3950.2,1711.74244557994,2.30770698605985,"SM","neg",TRUE "Feature090","7.03_871.69","SM (d42:2) B","DACOGJMBYLZYDH-GXJPFUDISA-N","[M+Hac-H]-",40,"(-) ES)","871.69129999999996",7.03,11073.2,5531.44390733559,2.00186428453431,"SM","neg",TRUE "Feature092","10.49_645.56","CE (16:1)","HODJWNWCVNUPAQ-FSAOOAOSSA-N","[M+Na]+",40,"-1","645.55849999999998",10.49,7012.2,282.921720622507,24.7849475274334,"CE","pos",TRUE "Feature093","11.06_668.63_11.06_673.59","CE (18:1)","RJECHNNFRHZQKU-RMUVNZEASA-N","[M+NH4]+_[M+Na]+",40,"-1","668.6350_673.5904",11.06,47728.4,2267.13901205903,21.0522600273429,"CE","pos",TRUE "Feature094","10.58_666.62_10.56_671.58","CE (18:2)","NAACPBBQTFFYQB-LJAITQKLSA-N","[M+NH4]+_[M+Na]+",40,"-1","666.6194_671.5755",10.57,432313.8,28157.3210852879,15.3535131659198,"CE","pos",TRUE "Feature095","10.17_669.56","CE (18:3)","FYMCIBHUFSIWCE-WVXFKAQASA-N","[M+Na]+",40,"-1","669.55849999999998",10.17,9479.6,366.105585862876,25.8930766589029,"CE","pos",TRUE "Feature096","10.68_697.59","CE (20:3)","MLPRJPSMAFZPLA-PJSAOELNSA-N","[M+Na]+",40,"-1","697.58960000000002",10.68,2067.2,196.476970660686,10.5213348569489,"CE","pos",TRUE "Feature097","10.35_695.57_10.34_690.62","CE (20:4)","IMXSFYNMSOULQS-BEDFLICRSA-N","[M+NH4]+_[M+Na]+",40,"-1","695.5744_690.6185",10.345,100722.8,2489.90797018685,40.4524188066443,"CE","pos",TRUE "Feature098","9.92_693.56","CE (20:5)","XZFUGMCJZFRBKF-JIKDAPOUSA-N","[M+Na]+",40,"-1","693.55669999999998",9.92,5927.4,265.364466347701,22.3368263339127,"CE","pos",TRUE "Feature099","10.09_719.57","CE (22:6)","VOEVEGPMRIYYKC-HNJOWPRISA-N","[M+Na]+",40,"-1","719.57349999999997",10.09,12641.8,812.209455744022,15.5647042897568,"CE","pos",TRUE "Feature100","7.83_644.59","Ceramide (d40:1)","KEPQASGDXIEOIL-GLQCRSEXSA-N","[M+Na]+",40,"-1","644.59479999999996",7.83,5312.6,252.959087601138,21.001815156674,"Cer","pos",TRUE "Feature103","4.96_369.35","Cholesterol","HVYWMOMLDIMFJA-DPAQBDIFSA-N","[M-H2O+H]+",40,"-1","369.35210000000001",4.96,66796,1300.1836408754,51.3742812169419,"Cholesterol","pos",TRUE "Feature104","7.10_643.53","DG (36:2)","AFSHUZFNMVJNKX-LLWMBOQKSA-N","[M+Na]+",40,"-1","643.52760000000001",7.1,8534.6,999.625079717391,8.53780099476182,"DG","pos",TRUE "Feature105","6.57_641.51","DG (36:3)","BLZVZPYMHLXLHG-JOBMVARSSA-N","[M+Na]+",40,"-1","641.51210000000003",6.57,15427.8,2071.67256099993,7.44702627743137,"DG","pos",TRUE "Feature106","4.92_862.62_4.92_884.61","Gal-Gal-Cer(d18:1/16:0) or Lactosylceramide(d18:1/16:0)","HLIJNIKSBCIDGO-QKLMXXKVSA-N or HLIJNIKSBCIDGO-NLXPYQMASA-N","[M+H]+_[M+Na]+",40,"-1","862.6243_884.6073",4.92,29710.6,2982.34375952874,9.9621647923963,"Cer","pos",TRUE "Feature107","7.15_806.65","GlcCer (d40:1)","QMYGQSYNQBLKGY-YAEABVQUSA-N","[M+Na]+",40,"-1","806.64620000000002",7.15,2871.4,131.256618880725,21.8762301245111,"Cer","pos",TRUE "Feature108","7.81_834.68","GlcCer (d42:1)","SNVYJLGKALMFOP-MOLROICHSA-N","[M+Na]+",40,"-1","834.67899999999997",7.81,3895,228.069068485843,17.0781598129857,"Cer","pos",TRUE "Feature109","1.52_496.34","LPC (16:0)","ASWBNKHCZGQVJV-HSZRJFAPSA-N","[M+H]+",40,"-1","496.33980000000003",1.52,1485296.8,211318.819449901,7.02870101142188,"LPC","pos",TRUE "Feature110","2.31_524.37","LPC (18:0)","IHNKQIMGVNPMTC-RUZDIDTESA-N","[M+H]+",40,"-1","524.37139999999999",2.31,427646.4,52969.5867673139,8.07343281492029,"LPC","pos",TRUE "Feature111","1.67_522.36","LPC (18:1)","YAMUFBLWGFFICM-PTGWMXDISA-N","[M+H]+",40,"-1","522.35580000000004",1.67,148846.6,21218.3287819753,7.01500111198407,"LPC","pos",TRUE "Feature112","1.26_520.34","LPC (18:2)","SPJFYYJXNPEZDW-FTJOPAKQSA-N","[M+H]+",40,"-1","520.33979999999997",1.26,307005.6,71919.4126665395,4.26874453804924,"LPC","pos",TRUE "Feature113","1.23_544.34","LPC (20:4)","GOMVPVRDBLLHQC-VEJNOCSESA-N","[M+H]+",40,"-1","544.33910000000003",1.23,68888.6,18363.9185578678,3.75130175963918,"LPC","pos",TRUE "Feature114","4.94_706.54_4.93_728.52","PC (30:0)","RFVFQQWKPSOBED-PSXMRANNSA-N","[M+H]+_[M+Na]+",40,"-1","706.5395_728.5220",4.935,58139.8,7182.61524098291,8.09451683674536,"PC","pos",TRUE "Feature115","5.56_734.57","PC (32:0)","KILNVBDSWZSGLL-KXQOOQHDSA-N","[M+H]+",40,"-1","734.56960000000004",5.56,71825.8,8599.00419816155,8.35280438813557,"PC","pos",TRUE "Feature116","4.98_732.55_4.98_754.54","PC (32:1)","QIBZFHLFHCIUOT-NPBIGWJUSA-N","[M+H]+_[M+Na]+",40,"-1","732.5548_754.5376",4.98,213523,24865.4460446621,8.58713733172052,"PC","pos",TRUE "Feature118","5.77_748.58","PC (33:0)","FHENRYRLCPXONH-LDLOPFEMSA-N","[M+H]+",40,"-1","748.58389999999997",5.77,3245.4,299.551831908937,10.8341851202118,"PC","pos",TRUE "Feature119","5.31_746.57","PC (33:1)","OFRWLQSOUIZELQ-VEAYGOGPSA-N?","[M+H]+",40,"-1","746.56949999999995",5.31,10345,1158.29055076867,8.93126512439799,"PC","pos",TRUE "Feature120","4.84_744.55","PC (33:2)","SBNDHGBVMZMSNL-UESLNCBNSA-N","[M+H]+",40,"-1","744.55330000000004",4.84,16302.4,1964.62726744795,8.29796077358572,"PC","pos",TRUE "Feature121","6.23_762.60","PC (34:0)","PZNPLUBHRSSFHT-RRHRGVEJSA-N","[M+H]+",40,"-1","762.60249999999996",6.23,12430,1231.50294356124,10.0933579290157,"PC","pos",TRUE "Feature122","5.65_760.59_5.66_782.57","PC (34:1)","WTJKGGKOPKCXLL-VYOBOKEXSA-N","[M+H]+_[M+Na]+",40,"-1","760.5871_782.5680",5.655,1581248.4,167239.541901131,9.45499121813434,"PC","pos",TRUE "Feature124","4.63_756.55","PC (34:3)","VKVSSDKCKXJFIM-AFYHZPHLSA-N","[M+H]+",40,"-1","756.55380000000002",4.63,19711.8,2079.00942758805,9.48134228658525,"PC","pos",TRUE "Feature125","4.45_754.54","PC (34:4)","YWDDIWXKFJEMKF-JTZVLWBESA-N","[M+H]+",40,"-1","754.53750000000002",4.45,4087.2,457.127115800408,8.94105787805543,"PC","pos",TRUE "Feature126","5.96_774.60","PC (35:1)","MFHIZGSSDZJFKD-IYEJTHTFSA-N","[M+H]+",40,"-1","774.60059999999999",5.96,9908.4,1246.548555011,7.94866751091986,"PC","pos",TRUE "Feature127","5.46_772.59","PC (35:2)","MJWAVUYQCBFFHQ-WESJWMGVSA-N","[M+H]+",40,"-1","772.58500000000004",5.46,33103.6,3594.97688448758,9.20829286631659,"PC","pos",TRUE "Feature128","4.95_770.57","PC (35:3)","AYXGHIQPMDYMJC-AHMBLZLYSA-N","[M+H]+",40,"-1","770.5684",4.95,13820.4,1444.64711954165,9.56662690358931,"PC","pos",TRUE "Feature129","4.75_768.55","PC (35:4)","OROZWUJCDDCYAU-IPUAOQJZSA-N","[M+H]+",40,"-1","768.55460000000005",4.75,3736.8,1148.97528258879,3.25228928474466,"PC","pos",TRUE "Feature130","6.30_788.62_6.29_810.60","PC (36:1)","ATHVAWFAEPLPPQ-VRDBWYNSSA-N","[M+H]+_[M+Na]+",40,"-1","788.6171_810.5985",6.295,181198.6,22508.4659361761,8.05024209618718,"PC","pos",TRUE "Feature131","5.78_786.60_5.77_808.58","PC (36:2)","SNKAWJBJQDLSFF-NVKMUCNASA-N","[M+H]+_[M+Na]+",40,"-1","786.6031_808.5841",5.775,2508804,239638.833164619,10.4691045556735,"PC","pos",TRUE "Feature132","5.19_784.59_5.19_806.57","PC (36:3) A","BXRLDROZWDUSGM-ZRYFCQOPSA-N","[M+H]+_[M+Na]+",40,"-1","784.5865_806.5673",5.19,536978.8,62117.6091716351,8.64455034829644,"PC","pos",TRUE "Feature133","5.30_784.59_5.30_806.57","PC (36:3) B","WZCLAXMADUBPSG-RIXBAXMTSA-","[M+H]+_[M+Na]+",40,"-1","784.5861_806.5668",5.3,584333.6,77708.8232750953,7.51952706749159,"PC","pos",TRUE "Feature134","4.75_782.57","PC (36:4) A","NKQPOVROGSWLTO-NVPMBMBWSA-N","[M+H]+",40,"-1","782.56989999999996",4.75,128745.6,13990.0694172688,9.20264197124579,"PC","pos",TRUE "Feature135","5.05_782.57_5.05_804.55","PC (36:4) B","IIZPXYDJLKNOIY-JXPKJXOSSA-N","[M+H]+_[M+Na]+",40,"-1","782.5715_804.5524",5.05,1904255.8,201287.905953636,9.46035873828712,"PC","pos",TRUE "Feature136","4.36_780.55","PC (36:5) A","SUZYROYNFNQALJ-MHEIZRSESA-N","[M+H]+",40,"-1","780.55439999999999",4.36,1803.6,1521.92519527078,1.18507795626519,"PC","pos",TRUE "Feature138","6.12_800.62","PC (37:2)","MCZUABDVGPPWPM-HJTCUGKVSA-N","[M+H]+",40,"-1","800.61770000000001",6.12,3754.8,260.253145994434,14.4274913014128,"PC","pos",TRUE "Feature139","5.52_798.60","PC (37:3)","OOYQEEUUQRMQKL-JUUDQZDJSA-N","[M+H]+",40,"-1","798.6",5.52,2567.6,1269.5760315948,2.02240743059292,"PC","pos",TRUE "Feature140","5.36_796.58","PC (37:4)","QRPUCJXFPYFTMB-FBFLODOBSA-N","[M+H]+",40,"-1","796.58479999999997",5.36,13215.4,1579.52296596156,8.36670329256968,"PC","pos",TRUE "Feature141","6.39_814.63","PC (38:2)","KXXLFCAPKGRXBT-FMJYHZMHSA-N","[M+H]+",40,"-1","814.63260000000002",6.39,12494,1256.80806012692,9.94105655141824,"PC","pos",TRUE "Feature142","5.97_812.62_5.97_834.60","PC (38:3)","KNNHXKQRTYEWCA-HYYWERRFSA-N","[M+H]+_[M+Na]+",40,"-1","812.6166_834.5980",5.97,178175.2,19946.5820054464,8.93261812732372,"PC","pos",TRUE "Feature143","5.69_810.60_5.70_832.58","PC (38:4) A","PSVRFUPOQYJOOZ-QNPWAGBNSA-N","[M+H]+_[M+Na]+",40,"-1","810.6025_832.5836",5.695,1219521,126286.211038656,9.65680251208665,"PC","pos",TRUE "Feature144","5.11_808.59_5.10_830.57","PC (38:5) A","SUACBSWYGWBPFC-GPUJSUHJSA-N","[M+H]+_[M+Na]+",40,"-1","808.5862_830.5671",5.105,285662.4,30629.6189708589,9.32634520435203,"PC","pos",TRUE "Feature145","5.28_808.58","PC (38:5) B","YLWBKBDNHWQEFU-YJXJLLHLSA-N","[M+H]+",40,"-1","808.58399999999995",5.28,63285,33123.3743903003,1.91058432798236,"PC","pos",TRUE "Feature146","4.92_806.57_4.92_828.55","PC (38:6) 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