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Analysis: Reversed phase POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
AC 16:0CAR 16:0ME576816----
AC 18:1CAR 18:1ME576817----
AC 18:2CAR 18:2ME576818----
BMP 40:8BMP 40:8ME576819----
BMP 42:10BMP 42:10ME576820----
BMP 44:11BMP 44:11ME576821----
BMP 44:12BMP 44:12ME576822----
CAR 14:0CAR 14:0ME576823----
CAR 18:0CAR 18:0ME576824----
CE 22:6CE 22:6ME576825----
Cer 34:0Cer 34:0;O2ME576826----
Cer 42:0Cer 42:0;O2ME576827----
Cer 42:4Cer 42:4;O2ME576828----
Cer 44:2Cer 44:2;O2ME576829----
Cer d34:1Cer 34:1;O2ME576830----
Cer d36:1Cer 36:1;O2ME576831----
Cer d38:1Cer 38:1;O2ME576832----
Cer d40:1Cer 40:1;O2ME576833----
Cer d41:1Cer 41:1;O2ME576834----
Cer d42:1Cer 42:1;O2ME576835----
Cer d42:2Cer 42:2;O2ME576836----
CholesterolCholesterolME576837----
DG 30:0DG 30:0ME576838----
DG 32:0DG 32:0ME576839----
DG 32:1DG 32:1ME576840----
DG 34:0DG 34:0ME576841----
DG 34:1DG 34:1ME576842----
DG 34:2DG 34:2ME576843----
DG 34:3DG 34:3ME576844----
DG 36:0DG 36:0ME576845----
DG 36:1DG 36:1ME576846----
DG 36:2DG 36:2ME576847----
DG 36:3DG 36:3ME576848----
DG 36:4DG 36:4ME576849----
DG 38:4|DG 16:0_22:4DG 16:0_22:4ME576850----
DG 38:4|DG 18:0_20:4DG 18:0_20:4ME576851----
DG 38:5DG 38:5ME576852----
DG 38:6|DG 16:0_22:6DG 16:0_22:6ME576853----
DG 40:4|DG 18:0_22:4DG 18:0_22:4ME576854----
DG 40:5|DG 18:0_22:5DG 18:0_22:5ME576855----
DG 40:6|DG 18:0_22:6DG 18:0_22:6ME576856----
DG 40:7|DG 18:1_22:6DG 18:1_22:6ME576857----
DG 41:7DG 41:7ME576858----
DG 43:8DG 43:8*ME576859----
DG 43:9DG 43:9*ME576860----
Gal-Gal-Cer d18:1/16:0-ME576861----
GlcCer d40:1GlcCer 40:1;O2ME576862----
GlcCer d42:1GlcCer 42:1;O2ME576863----
GlcCer d42:2GlcCer 42:2;O2ME576864----
HexCer 34:1;2O|HexCer 18:1;2O/16:0HexCer 18:1;O2/16:0ME576865----
HexCer 36:1;2O|HexCer 18:1;2O/18:0HexCer 18:1;O2/18:0ME576866----
HexCer 38:1;2O|HexCer 18:1;2O/20:0HexCer 18:1;O2/20:0ME576867----
HexCer 41:1;2O|HexCer 18:1;2O/23:0HexCer 18:1;O2/23:0ME576868----
HexCer 42:3;2O|HexCer 18:1;2O/24:2HexCer 18:1;O2/24:2ME576869----
InosineInosineME576870----
LPC 14:0LPC 14:0ME576875----
LPC 15:0LPC 15:0ME576876----
LPC 16:0LPC 16:0ME576877----
LPC 16:1LPC 16:1ME576878----
LPC 18:0LPC 18:0ME576879----
LPC 18:1LPC 18:1ME576880----
LPC 18:2LPC 18:2ME576881----
LPC 19:0/0:0LPC 19:0/0:0ME576882----
LPC 20:0LPC 20:0ME576871----
LPC 20:2LPC 20:2ME576872----
LPC 20:3LPC 20:3ME576883----
LPC 20:4LPC 20:4ME576884----
LPC 22:0/0:0LPC 22:0/0:0ME576885----
LPC 22:4LPC 22:4ME576873----
LPC 22:5LPC 22:5ME576886----
LPC 22:6LPC 22:6ME576874----
LPC 24:0/0:0LPC 24:0/0:0ME576887----
LPE 16:0LPE 16:0ME576888----
LPE 18:0LPE 18:0ME576889----
LPE 18:1LPE 18:1ME576890----
LPE 18:2LPE 18:2ME576891----
LPE 22:4LPE 22:4ME576892----
LPE 22:5LPE 22:5ME576893----
LPE 22:6LPE 22:6ME576894----
NAE 18:0Stearoyl-EAME576895----
NAE 6:0NAE 6:0*ME576896----
NAOrn 36:2;2O|NAOrn 18:0;O(FA 18:1)-ME576897----
NicotinamideNiacinamideME576898----
O1_Cer d38:1-ME576899----
O1_Cer d40:1-ME576900----
O1_Cer d41:1-ME576901----
O1_Cer d42:2-ME576902----
O1_GlcCer d40:1-ME576903----
O1_GlcCer d42:1-ME576904----
O1_GlcCer d42:2-ME576905----
O1_PC 34:1-ME576906----
O1_PC 34:3-ME576907----
O1_PC 36:2-ME576908----
O1_PC p-40:6/PC o-40:7-ME576909----
O1_SM d34:1-ME576910----
O1_SM d34:2-ME576911----
O1_SM d36:1-ME576912----
O1_TAG 51:1-ME576913----
O1_TAG 53:4-ME576914----
O1_TAG 55:1-ME576915----
O1_TAG 55:2-ME576916----
O3_LPC 20:2-ME576917----
PC 17:0PC 17:0ME576918----
PC 21:4PC 21:4ME576919----
PC 28:0PC 28:0ME576920----
PC 29:0PC 29:0ME576921----
PC 30:0PC 30:0ME576922----
PC 30:1PC 30:1ME576923----
PC 31:0PC 31:0ME576924----
PC 31:1PC 31:1ME576925----
PC 32:0|PC 16:0_16:0PC 16:0/16:0ME576926----
PC 32:1PC 32:1ME576927----
PC 32:2PC 32:2ME576928----
PC 32:3PC 32:3ME576929----
PC 33:0PC 33:0ME576930----
PC 33:1PC 33:1ME576931----
PC 33:2PC 33:2ME576932----
PC 34:0PC 34:0ME576933----
PC 34:1PC 34:1ME576934----
PC 34:2PC 34:2ME576935----
PC 34:3PC 34:3ME576936----
PC 34:4PC 34:4ME576937----
PC 35:0PC 35:0ME576938----
PC 35:1PC 35:1ME576939----
PC 35:2PC 35:2ME576940----
PC 35:3PC 35:3ME576941----
PC 35:4PC 35:4ME576942----
PC 36:0|PC 18:0_18:0PC 18:0/18:0ME576943----
PC 36:1PC 36:1ME576944----
PC 36:2PC 36:2ME576945----
PC 36:3PC 36:3ME576946----
PC 36:4PC 36:4ME576947----
PC 36:5PC 36:5ME576948----
PC 36:6PC 36:6ME576949----
PC 37:2PC 37:2ME576950----
PC 37:3PC 37:3ME576951----
PC 37:4PC 37:4ME576952----
PC 37:5PC 37:5ME576953----
PC 37:6PC 37:6ME576954----
PC 38:1PC 38:1ME576955----
PC 38:2PC 38:2ME576956----
PC 38:3PC 38:3ME576957----
PC 38:4PC 38:4ME576958----
PC 38:5PC 38:5ME576959----
PC 38:6PC 38:6ME576960----
PC 38:7PC 38:7ME576961----
PC 39:4PC 39:4ME576962----
PC 39:5PC 39:5ME576963----
PC 39:6PC 39:6ME576964----
PC 40:0PC 40:0ME576965----
PC 40:1PC 40:1ME576966----
PC 40:2PC 40:2ME576967----
PC 40:4PC 40:4ME576968----
PC 40:5PC 40:5ME576969----
PC 40:6PC 40:6ME576970----
PC 40:7PC 40:7ME576971----
PC 40:8PC 40:8ME576972----
PC 41:6PC 41:6ME576973----
PC 42:1PC 42:1ME576974----
PC 42:10PC 42:10ME576975----
PC 42:2PC 42:2ME576976----
PC 42:3PC 42:3ME576977----
PC 42:4PC 42:4ME576978----
PC 42:5PC 42:5ME576979----
PC 42:6PC 42:6ME576980----
PC 42:7PC 42:7ME576981----
PC 42:8|PC 20:4_22:4PC 20:4_22:4ME576982----
PC 42:9PC 42:9ME576983----
PC 44:10PC 44:10ME576984----
PC 44:12PC 44:12ME576985----
PC 44:5PC 44:5ME576986----
PC 44:8PC 44:8ME576987----
PC 44:9PC 44:9ME576988----
PC O-37:8PC O-37:8ME576989----
PC O-39:8PC O-39:8ME576990----
PC O-44:6PC O-44:6ME576991----
PC p-40:3/PC o-40:4PC P-40:3 or PC O-40:4ME576992----
PC p-42:4/PC o-42:5PC P-42:4 or PC O-42:5ME576993----
PC p-42:5/PC o-42:6PC P-42:5 or PC O-42:6ME576994----
PC p-44:4/PC o-44:5PC P-44:4 or PC O-44:5ME576995----
PE 19:1PE 19:1ME576996----
PE 32:0|PE 16:0_16:0PE 16:0/16:0ME576997----
PE 34:3PE 34:3ME576998----
PE 36:1PE 36:1ME576999----
PE 36:2PE 36:2ME577000----
PE 36:5PE 36:5ME577001----
PE 38:3|PE 18:0_20:3PE 18:0_20:3ME577002----
PE 38:4PE 38:4ME577003----
PE 38:6PE 38:6ME577004----
PE 39:6PE 39:6ME577005----
PE 40:4|PE 18:0_22:4PE 18:0_22:4ME577006----
PE 40:5PE 40:5ME577007----
PE 42:1PE 42:1ME577008----
PE O-38:8PE O-38:8ME577009----
PE P-34:0|PE P-18:0_16:0PE P-18:0/16:0ME577010----
PE p-34:1/PE o-34:2PE P-34:1 or PE O-34:2ME577011----
PE P-34:2|PE P-16:0_18:2PE P-16:0/18:2ME577012----
PE P-35:1|PE P-17:0_18:1PE P-17:0/18:1ME577013----
PE P-36:3|PE P-16:0_20:3PE P-16:0/20:3ME577014----
PE p-36:4/PE o-36:5PE P-36:4 or PE O-36:5ME577015----
PE P-37:4|PE P-17:0_20:4PE P-17:0/20:4ME577016----
PE P-38:3|PE P-18:0_20:3PE P-18:0/20:3ME577017----
PE p-38:5/PE o-38:6PE P-38:5 or PE O-38:6ME577018----
PE P-40:6|PE P-18:0_22:6PE P-18:0/22:6ME577019----
PE P-40:6|PE P-18:1_22:5PE P-18:1/22:5ME577020----
PE P-40:7|PE P-18:1_22:6PE P-18:1/22:6ME577021----
PE P-40:7|PE P-18:2_22:5PE P-18:2/22:5*ME577022----
PE P-40:8|PE P-18:2_22:6PE P-18:2/22:6ME577023----
PE P-42:4|PE P-20:0_22:4PE P-20:0/22:4ME577024----
PG 32:1PG 32:1ME577025----
PG 36:4|PG 16:0_20:4PG 16:0_20:4ME577026----
PG 38:6|PG 16:0_22:6PG 16:0_22:6ME577027----
PGPC [M+H]+-ME577028----
PI 34:2PI 34:2ME577029----
PI 36:1PI 36:1ME577030----
PI 36:2PI 36:2ME577031----
PI 36:3PI 36:3ME577032----
PI 36:4PI 36:4ME577033----
PI 38:3PI 38:3ME577034----
PI 38:5PI 38:5ME577035----
PI 38:6PI 38:6ME577036----
PI 40:4PI 40:4ME577037----
PI 40:5PI 40:5ME577038----
PI 40:6PI 40:6ME577039----
POVPC [M+H]+-ME577040----
PS 32:0PS 32:0ME577041----
PS 34:1PS 34:1ME577042----
PS 34:2PS 34:2ME577043----
PS 36:1|PS 18:0_18:1PS 18:0_18:1ME577044----
PS 36:2|PS 18:0_18:2PS 18:0_18:2ME577045----
PS 36:4PS 36:4ME577046----
PS 38:3|PS 18:0_20:3PS 18:0_20:3ME577047----
PS 38:6PS 38:6ME577048----
PS 40:1PS 40:1ME577049----
PS 40:2PS 40:2ME577050----
PS 40:4|PS 18:0_22:4PS 18:0_22:4ME577051----
PS 40:5PS 40:5ME577052----
PS 40:6|PS 18:0_22:6PS 18:0_22:6ME577053----
PS 40:7PS 40:7ME577054----
PS 42:1PS 42:1ME577055----
PS 42:2PS 42:2ME577056----
PS 42:4PS 42:4ME577057----
SM 41:0SM 41:0;O2ME577058----
SM 42:4SM 42:4;O2ME577059----
SM 44:1SM 44:1;O2ME577060----
SM 44:3SM 44:3;O2ME577061----
SM d32:1SM 32:1;O2ME577062----
SM d33:1SM 33:1;O2ME577063----
SM d34:0SM 34:0;O2ME577064----
SM d34:1SM 34:1;O2ME577065----
SM d34:2SM 34:2;O2ME577066----
SM d36:0SM 36:0;O2ME577067----
SM d36:1SM 36:1;O2ME577068----
SM d36:2SM 36:2;O2ME577069----
SM d37:1SM 37:1;O2ME577070----
SM d38:0SM 38:0;O2ME577071----
SM d38:1SM 38:1;O2ME577072----
SM d38:2SM 38:2;O2ME577073----
SM d39:1SM 39:1;O2ME577074----
SM d40:0SM 40:0;O2ME577075----
SM d40:1SM 40:1;O2ME577076----
SM d40:2SM 40:2;O2ME577077----
SM d41:1SM 41:1;O2ME577078----
SM d41:2SM 41:2;O2ME577079----
SM d42:0SM 42:0;O2ME577080----
SM d42:1SM 42:1;O2ME577081----
SM d42:2SM 42:2;O2ME577082----
SM d42:3SM 42:3;O2ME577083----
SM d43:1SM 43:1;O2ME577084----
SM d43:2SM 43:2;O2ME577085----
SM d44:2SM 44:2;O2ME577086----
TAG 40:0TG 40:0ME577087----
TAG 40:1TG 40:1ME577088----
TAG 42:0TG 42:0ME577089----
TAG 42:1TG 42:1ME577090----
TAG 42:2TG 42:2ME577091----
TAG 42:3TG 42:3ME577092----
TAG 44:0TG 44:0ME577093----
TAG 44:1TG 44:1ME577094----
TAG 44:2TG 44:2ME577095----
TAG 46:0TG 46:0ME577096----
TAG 46:1TG 46:1ME577097----
TAG 46:2TG 46:2ME577098----
TAG 46:3TG 46:3ME577099----
TAG 46:4TG 46:4ME577100----
TAG 48:0TG 48:0ME577101----
TAG 48:1TG 48:1ME577102----
TAG 48:2TG 48:2ME577103----
TAG 48:3TG 48:3ME577104----
TAG 48:4TG 48:4ME577105----
TAG 48:5TG 48:5ME577106----
TAG 49:0TG 49:0ME577107----
TAG 49:1TG 49:1ME577108----
TAG 49:2TG 49:2ME577109----
TAG 49:3TG 49:3ME577110----
TAG 50:0TG 50:0ME577111----
TAG 50:1TG 50:1ME577112----
TAG 50:2TG 50:2ME577113----
TAG 50:3TG 50:3ME577114----
TAG 50:4TG 50:4ME577115----
TAG 50:5TG 50:5ME577116----
TAG 50:6TG 50:6ME577117----
TAG 51:1TG 51:1ME577118----
TAG 51:2TG 51:2ME577119----
TAG 51:3TG 51:3ME577120----
TAG 51:4TG 51:4ME577121----
TAG 52:0TG 52:0ME577122----
TAG 52:1TG 52:1ME577123----
TAG 52:2TG 52:2ME577124----
TAG 52:3TG 52:3ME577125----
TAG 52:4TG 52:4ME577126----
TAG 52:5TG 52:5ME577127----
TAG 52:6TG 52:6ME577128----
TAG 53:0TG 53:0ME577129----
TAG 53:1TG 53:1ME577130----
TAG 53:2TG 53:2ME577131----
TAG 53:3TG 53:3ME577132----
TAG 53:4TG 53:4ME577133----
TAG 53:5TG 53:5ME577134----
TAG 54:0TG 54:0ME577135----
TAG 54:1TG 54:1ME577136----
TAG 54:2TG 54:2ME577137----
TAG 54:3TG 54:3ME577138----
TAG 54:4TG 54:4ME577139----
TAG 54:5TG 54:5ME577140----
TAG 54:6TG 54:6ME577141----
TAG 54:7TG 54:7ME577142----
TAG 54:8TG 54:8ME577143----
TAG 55:1TG 55:1ME577144----
TAG 55:2TG 55:2ME577145----
TAG 55:3TG 55:3ME577146----
TAG 56:0TG 56:0ME577147----
TAG 56:1TG 56:1ME577148----
TAG 56:3TG 56:3ME577149----
TAG 56:4TG 56:4ME577150----
TAG 56:5TG 56:5ME577151----
TAG 56:6TG 56:6ME577152----
TAG 56:7TG 56:7ME577153----
TAG 56:8TG 56:8ME577154----
TAG 56:9TG 56:9ME577155----
TAG 57:1TG 57:1ME577156----
TAG 57:2TG 57:2ME577157----
TAG 58:0TG 58:0ME577158----
TAG 58:1TG 58:1ME577159----
TAG 58:10TG 58:10ME577160----
TAG 58:2TG 58:2ME577161----
TAG 58:3TG 58:3ME577162----
TAG 58:4TG 58:4ME577163----
TAG 58:5TG 58:5ME577164----
TAG 58:6TG 58:6ME577165----
TAG 58:8TG 58:8ME577166----
TAG 58:9TG 58:9ME577167----
TAG 59:2TG 59:2ME577168----
TAG 59:3TG 59:3ME577169----
TAG 60:1TG 60:1ME577170----
TAG 60:11TG 60:11ME577171----
TAG 60:2TG 60:2ME577172----
TAG 60:3TG 60:3ME577173----
TAG 60:4TG 60:4ME577174----
TAG 60:5TG 60:5ME577175----
TAG 62:1TG 62:1ME577176----
TAG 62:2TG 62:2ME577177----
TAG 62:3TG 62:3ME577178----
TAG 62:4TG 62:4ME577179----
TAG 64:2TG 64:2ME577180----
TAG 64:3TG 64:3ME577181----
TAG 64:4TG 64:4ME577182----
TG 43:1|TG 9:0_16:0_18:1TG 9:0_16:0_18:1ME577183----
TG 43:2|TG 9:0_16:0_18:2TG (9:0_16:0_18:2)*ME577184----
TG 44:3|TG 8:0_18:1_18:2TG 8:0_18:1_18:2ME577185----
TG 45:0|TG 14:0_15:0_16:0TG 14:0_15:0_16:0ME577186----
TG 47:0|TG 15:0_16:0_16:0TG 15:0_16:0_16:0ME577187----
TG 47:2|TG 14:0_15:0_18:2TG 14:0_15:0_18:2ME577188----
TG 50:3TG 50:3ME577189----
TG 51:0|TG 16:0_17:0_18:0TG 16:0_17:0_18:0ME577190----
TG 52:2;1O|TG 16:0_18:1_18:1;1O-ME577191----
TG 52:3;1O|TG 16:0_18:1_18:2;1O-ME577192----
TG 52:4;1O|TG 16:0_18:1_18:3;1O-ME577193----
TG 52:4;2O|TG 16:0_18:1_18:3;2O-ME577194----
TG 52:7|TG 14:0_16:1_22:6TG 14:0_16:1_22:6ME577195----
TG 52:7|TG 14:0_18:2_20:5TG 14:0_18:2_20:5ME577196----
TG 52:7|TG 16:1_18:2_18:4TG 16:1_18:2_18:4ME577197----
TG 54:5;1O|TG 18:1_18:1_18:3;1O-ME577198----
TG 54:6|TG 16:0_16:0_22:6TG 16:0_16:0_22:6ME577199----
TG 54:7|TG 16:0_16:1_22:6TG 16:0_16:1_22:6ME577200----
TG 55:4|TG 18:1_19:1_18:2TG 18:1_18:2_19:1ME577201----
TG 55:5|TG 19:1_18:2_18:2TG 18:2_18:2_19:1ME577202----
TG 55:6|TG 16:0_18:1_21:5TG (16:0_18:1_21:5)*ME577203----
TG 55:7|TG 15:0_18:1_22:6TG 15:0_18:1_22:6ME577204----
TG 55:7|TG 16:0_18:2_21:5TG (16:0_18:2_21:5)*ME577205----
TG 57:0|TG 16:0_17:0_24:0TG 16:0_17:0_24:0ME577206----
TG 57:3|TG 18:1_19:1_20:1TG 18:1_19:1_20:1ME577207----
TG 57:4|TG 19:1_20:1_18:2TG 18:2_19:1_20:1ME577208----
TG 57:7|TG 17:0_18:1_22:6TG 17:0_18:1_22:6ME577209----
TG 57:7|TG 18:1_18:1_21:5TG (18:1_18:1_21:5)*ME577210----
TG 57:8|TG 18:1_18:2_21:5TG (18:1_18:2_21:5)*ME577211----
TG 58:10|TG 16:0_20:4_22:6TG 16:0_20:4_22:6ME577212----
TG 58:11|TG 18:2_18:3_22:6TG 18:2_18:3_22:6ME577213----
TG 58:7|TG 18:0_18:1_22:6TG 18:0_18:1_22:6ME577214----
TG 58:7|TG 18:1_18:1_22:5TG 18:1_18:1_22:5ME577215----
TG 59:1|TG 16:0_25:0_18:1TG 16:0_18:1_25:0ME577216----
TG 60:12|TG 16:0_22:6_22:6TG 16:0_22:6_22:6ME577217----
TG 60:8|TG 18:1_20:1_22:6TG 18:1_20:1_22:6ME577218----
TG 60:9|TG 18:0_20:4_22:5TG 18:0_20:4_22:5ME577219----
TG 60:9|TG 18:1_18:2_24:6TG (18:1_18:2_24:6)*ME577220----
TG 61:2|TG 23:0_18:1_20:1TG 18:1_20:1_23:0ME577221----
TG 61:3|TG 25:0_18:1_18:2TG 18:1_18:2_25:0ME577222----
TG 70:3;O2|TG 16:0_18:1_18:1;O(FA 18:0)-ME577223----


Analysis: Reversed phase NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Cer 34:1;2O|Cer 18:1;2O/16:0Cer 18:1;O2/16:0ME577224----
Cer 36:2;2O|Cer 18:2;2O/18:0Cer 18:2;O2/18:0ME577225----
Cer 42:1;2O|Cer 18:1;2O/24:0Cer 18:1;O2/24:0ME577226----
Cer 42:3;2O|Cer 18:2;2O/24:1Cer 18:2;O2/24:1ME577227----
Ceramide d32:1Cer 32:1;O2ME577228----
Ceramide d34:0Cer 34:0;O2ME577229----
Ceramide d39:1Cer 39:1;O2ME577230----
Ceramide d40:1Cer 40:1;O2ME577231----
Ceramide d40:2Cer 40:2;O2ME577232----
Ceramide d41:1Cer 41:1;O2ME577233----
Ceramide d42:2Cer 42:2;O2ME577234----
Ceramide d43:1Cer 43:1;O2ME577235----
CL 70:4|CL 16:0_18:1_18:1_18:2CL (16:0_18:1_18:1_18:2)*ME577236----
CL 70:7|CL 16:1_18:2_18:2_18:2CL 16:1_18:2_18:2_18:2ME577237----
CL 72:5|CL 18:1_18:1_18:1_18:2CL 18:1_18:1_18:1_18:2ME577238----
CL 72:6|CL 18:1_18:1_18:2_18:2CL 18:1_18:1_18:2_18:2ME577239----
CL 72:7|CL 18:1_18:2_18:2_18:2CL 18:1_18:2_18:2_18:2ME577240----
CL 72:8|CL 18:2_18:2_18:2_18:2CL 18:2/18:2/18:2/18:2ME577241----
CL 74:10|CL 18:2_18:2_18:2_20:4CL (18:2_18:2_18:2_20:4)*ME577242----
CL 74:7|CL 18:1_18:1_18:2_20:3CL (18:1_18:1_18:2_20:3)*ME577243----
CL 74:7|CL 18:1_18:2_18:1_20:3CL 18:1_18:1_18:2_20:3ME577244----
CL 74:9|CL 18:1_18:2_18:2_20:4CL (18:1_18:2_18:2_20:4)*ME577245----
CL 74:9|CL 18:2_18:2_18:2_20:3CL 18:2_18:2_18:2_20:3ME577246----
CL 76:11|CL 18:1_18:2_18:2_22:6CL (18:1_18:2_18:2_22:6)*ME577247----
FA 14:1Tetradecenoic acidME577248----
FA 16:1Hexadecenoic acidME577249----
FA 17:1Heptadecenoic acidME577250----
FA 17:3Heptadecatrienoic acidME577251----
FA 18:1Octadecenoic acidME577252----
FA 18:2Octadecadienoic acidME577253----
FA 18:3Octadecatrienoic acidME577254----
FA 18:5Octadecapentaenoic acidME577255----
FA 19:1Nonadecenoic acidME577256----
FA 20:1Eicosenoic acidME577257----
FA 20:3Eicosatrienoic acidME577258----
FA 20:4Arachidonic acidME577259----
FA 20:5Eicosapentaenoic acidME577260----
FA 21:0Heneicosylic acidME577261----
FA 22:1Docosenoic acidME577262----
FA 22:2Docosadienoic acidME577263----
FA 22:3Docosatrienoic acidME577264----
FA 22:4Docosatetraenoic acidME577265----
FA 22:5Docosapentaenoic acidME577266----
FA 24:1Tetracosenoic acidME577267----
FA 24:2Tetracosadienoic acidME577268----
FA 24:4Tetracosatetraenoic acidME577269----
FA 24:5Tetracosapentaenoic acidME577270----
GlcCer d40:1GlcCer 40:1;O2ME577271----
GlcCer d41:1GlcCer 41:1;O2ME577272----
Hex2Cer 34:1;2OHex2Cer 34:1;O2ME577273----
HexCer 40:1;3O|HexCer 16:1;2O/24:0;OHexCer 16:1;O2/24:0;OME577274----
LPC 16:1LPC 16:1ME577275----
LPC 17:0LPC 17:0ME577276----
LPC 20:0LPC 20:0ME577277----
LPC 20:4LPC 20:4ME577278----
LPC 24:0LPC 24:0ME577279----
LPC O-16:0LPC O-16:0ME577280----
LPE 16:0LPE 16:0ME577281----
LPE 18:0LPE 18:0ME577282----
LPE 18:1LPE 18:1ME577283----
LPE 20:4LPE 20:4ME577284----
LPE 22:4LPE 22:4ME577285----
LPE 22:6LPE 22:6ME577286----
LPG 16:0LPG 16:0ME577287----
LPI 18:0LPI 18:0ME577288----
LPI 20:4LPI 20:4ME577289----
LPS 18:0LPS 18:0ME577290----
O1_FA 18:3-ME577291----
O1_FA 22:6-ME577292----
O1_GlcCer d38:1-ME577293----
O1_GlcCer d40:1-ME577294----
O1_GlcCer d41:1-ME577295----
O1_GlcCer d42:1-ME577296----
O1_GlcCer d42:2-ME577297----
O1_PC 36:4-ME577298----
O1_PC p-38:4-ME577299----
O1_PE 36:4-ME577300----
O1_PE p-36:4-ME577301----
O1_SM d34:1-ME577302----
O2_FA 20:1-ME577303----
O2_FA 24:1-ME577304----
O3_PE p-40:6-ME577305----
PA 32:0|PA 16:0_16:0PA 16:0/16:0ME577306----
PA 32:1|PA 16:0_16:1PA 16:0_16:1ME577307----
PA 34:2|PA 16:0_18:2PA 16:0_18:2ME577308----
PA 36:4|PA 16:0_20:4PA 16:0_20:4ME577309----
PA 38:4|PA 18:0_20:4PA 18:0_20:4ME577310----
PC 33:1PC 33:1ME577311----
PC 35:1PC 35:1ME577312----
PC 35:2PC 35:2ME577313----
PC 35:4PC 35:4ME577314----
PC 36:4PC 36:4ME577315----
PC 36:5PC 36:5ME577316----
PC 37:4PC 37:4ME577317----
PC 38:3PC 38:3ME577318----
PC 38:4PC 38:4ME577319----
PC 38:5PC 38:5ME577320----
PC 38:6PC 38:6ME577321----
PC 40:4PC 40:4ME577322----
PC O-32:1|PC O-16:0_16:1PC O-16:0/16:1ME577323----
PC O-32:1|PC O-16:1_16:0PC O-16:1/16:0ME577324----
PC O-34:2|PC O-16:0_18:2PC O-16:0/18:2ME577325----
PC O-34:2|PC O-16:1_18:1PC O-16:1/18:1ME577326----
PC O-34:3|PC O-16:1_18:2PC O-16:1/18:2ME577327----
PC O-38:7|PC O-16:1_22:6PC O-16:1/22:6ME577328----
PC O-40:7|PC O-18:1_22:6PC O-18:1/22:6ME577329----
PE 32:0|PE 16:0_16:0PE 16:0/16:0ME577330----
PE 32:1|PE 16:0_16:1PE 16:0_16:1ME577331----
PE 34:0|PE 16:0_18:0PE 16:0_18:0ME577332----
PE 34:3|PE 16:0_18:3PE 16:0_18:3ME577333----
PE 34:3|PE 16:1_18:2PE 16:1_18:2ME577334----
PE 35:1|PE 17:0_18:1PE 17:0_18:1ME577335----
PE 35:2|PE 17:0_18:2PE 17:0_18:2ME577336----
PE 36:1|PE 18:0_18:1PE 18:0_18:1ME577337----
PE 36:2|PE 18:0_18:2PE 18:0_18:2ME577338----
PE 36:2|PE 18:1_18:1PE 18:1/18:1ME577339----
PE 36:3|PE 18:1_18:2PE 18:1_18:2ME577340----
PE 36:4|PE 16:0_20:4PE 16:0_20:4ME577341----
PE 36:5|PE 16:0_20:5PE 16:0_20:5ME577342----
PE 36:5|PE 16:1_20:4PE 16:1_20:4ME577343----
PE 38:1|PE 18:0_20:1PE 18:0_20:1ME577344----
PE 38:2|PE 18:0_20:2PE 18:0_20:2ME577345----
PE 38:3|PE 18:0_20:3PE 18:0_20:3ME577346----
PE 38:4|PE 18:0_20:4PE 18:0_20:4ME577347----
PE 38:5|PE 18:0_20:5PE 18:0_20:5ME577348----
PE 38:5|PE 18:1_20:4PE 18:1_20:4ME577349----
PE 38:6|PE 16:0_22:6PE 16:0_22:6ME577350----
PE 38:6|PE 18:2_20:4PE 18:2_20:4ME577351----
PE 39:4|PE 19:0_20:4PE 19:0_20:4ME577352----
PE 39:6|PE 17:0_22:6PE 17:0_22:6ME577353----
PE 40:1|PE 22:0_18:1PE 18:1_22:0ME577354----
PE 40:2|PE 18:1_22:1PE 18:1_22:1ME577355----
PE 40:3|PE 18:0_22:3PE 18:0_22:3ME577356----
PE 40:6|PE 18:0_22:6PE 18:0_22:6ME577357----
PE 42:1|PE 24:0_18:1PE 18:1_24:0ME577358----
PE 42:2|PE 18:1_24:1PE 18:1_24:1ME577359----
PE 42:4|PE 18:0_24:4PE 18:0_24:4ME577360----
PE 42:4|PE 22:0_20:4PE 20:4_22:0ME577361----
PE 42:5|PE 18:0_24:5PE (18:0_24:5)*ME577362----
PE O-32:2|PE O-16:1_16:1PE O-16:1/16:1ME577363----
PE O-34:1|PE O-16:0_18:1PE O-16:0/18:1ME577364----
PE O-34:1|PE O-18:1_16:0PE O-18:1/16:0ME577365----
PE O-34:2|PE O-16:1_18:1PE O-16:1/18:1ME577366----
PE O-34:5|PE O-14:1_20:4PE O-14:1/20:4ME577367----
PE O-36:6|PE O-16:1_20:5PE O-16:1/20:5ME577368----
PE O-36:6|PE O-16:2_20:4PE O-16:2/20:4ME577369----
PE O-37:5|PE O-17:1_20:4PE O-17:1/20:4ME577370----
PE O-38:7|PE O-18:3_20:4PE O-18:3/20:4ME577371----
PE O-39:5|PE O-17:1_22:4PE O-17:1/22:4ME577372----
PE O-39:5|PE O-19:1_20:4PE O-19:1/20:4*ME577373----
PE O-39:6|PE O-17:1_22:5PE O-17:1/22:5ME577374----
PE O-39:7|PE O-17:1_22:6PE O-17:1/22:6ME577375----
PE O-40:4|PE O-18:0_22:4PE O-18:0/22:4ME577376----
PE O-40:4|PE O-18:1_22:3PE O-18:1/22:3ME577377----
PE O-40:5|PE O-16:1_24:4PE O-16:1/24:4ME577378----
PE O-40:5|PE O-18:0_22:5PE O-18:0/22:5ME577379----
PE O-40:5|PE O-18:1_22:4PE O-18:1/22:4ME577380----
PE O-40:5|PE O-20:1_20:4PE O-20:1/20:4ME577381----
PE O-40:6|PE O-18:1_22:5PE O-18:1/22:5ME577382----
PE O-40:6|PE O-18:2_22:4PE O-18:2/22:4ME577383----
PE O-40:7|PE O-18:1_22:6PE O-18:1/22:6ME577384----
PE O-40:7|PE O-18:2_22:5PE O-18:2/22:5ME577385----
PE O-40:8|PE O-18:2_22:6PE O-18:2/22:6ME577386----
PE O-40:8|PE O-18:3_22:5PE O-18:3/22:5*ME577387----
PE O-40:9|PE O-18:3_22:6PE O-18:3/22:6ME577388----
PE O-41:7|PE O-19:1_22:6PE O-19:1/22:6*ME577389----
PE O-42:6|PE O-20:1_22:5PE O-20:1/22:5ME577390----
PE O-42:7|PE O-18:1_24:6PE O-18:1/24:6*ME577391----
PE O-42:7|PE O-20:1_22:6PE O-20:1/22:6ME577392----
PE O-42:9|PE O-20:3_22:6PE O-20:3/22:6*ME577393----
PG 30:0|PG 14:0_16:0_PG 30:0|PG 14:0_16:0PG 14:0_16:0ME577394----
PG 32:1|PG 16:0_16:1PG 16:0_16:1ME577395----
PG 34:1|PG 16:0_18:1PG 16:0_18:1ME577396----
PG 34:2|PG 16:0_18:2PG 16:0_18:2ME577397----
PG 34:2|PG 16:0_18:2_PG 34:2|PG 16:0_18:2PG 16:0_18:2ME577398----
PG 34:3|PG 16:0_18:3PG 16:0_18:3ME577399----
PG 35:1|PG 17:0_18:1PG 17:0_18:1ME577400----
PG 36:1|PG 18:0_18:1PG 18:0_18:1ME577401----
PG 36:2|PG 18:1_18:1PG 18:1/18:1ME577402----
PG 36:3|PG 18:1_18:2PG 18:1_18:2ME577403----
PG 36:4|PG 16:0_20:4_PG 36:4|PG 16:0_20:4PG 16:0_20:4ME577404----
PG 36:4|PG 18:2_18:2PG 18:2/18:2ME577405----
PG 36:5|PG 16:0_20:5_PG 36:5|PG 16:0_20:5PG 16:0_20:5ME577406----
PG 38:3|PG 18:0_20:3PG 18:0_20:3ME577407----
PG 38:4|PG 18:0_20:4PG 18:0_20:4ME577408----
PG 38:5|PG 16:0_22:5PG 16:0_22:5ME577409----
PG 38:5|PG 18:1_20:4_PG 38:5|PG 18:1_20:4PG 18:1_20:4ME577410----
PG 38:6|PG 16:0_22:6_PG 38:6|PG 16:0_22:6PG 16:0_22:6ME577411----
PG 40:6|PG 18:0_22:6PG 18:0_22:6ME577412----
PG 40:6|PG 18:1_22:5PG 18:1_22:5ME577413----
PG 40:7|PG 18:1_22:6_PG 40:7|PG 18:1_22:6PG 18:1_22:6ME577414----
PG 40:8|PG 18:2_22:6PG 18:2_22:6ME577415----
PG 42:10|PG 20:4_22:6PG 20:4_22:6ME577416----
PG 42:11|PG 20:5_22:6PG 20:5_22:6ME577417----
PG 42:9|PG 20:3_22:6PG 20:3_22:6ME577418----
PG 44:10|PG 22:4_22:6PG 22:4_22:6ME577419----
PG 44:11|PG 22:5_22:6PG 22:5_22:6ME577420----
PG 44:12|PG 22:6_22:6PG 22:6/22:6ME577421----
PI 32:0|PI 16:0_16:0_PI 32:0|PI 16:0_16:0PI 16:0/16:0ME577422----
PI 34:2|PI 16:0_18:2_PI 34:2|PI 16:0_18:2PI 16:0_18:2ME577423----
PI 36:3|PI 16:0_20:3PI 16:0_20:3ME577424----
PI 36:3|PI 18:1_18:2PI 18:1_18:2ME577425----
PI 36:4|PI 16:0_20:4_PI 36:4|PI 16:0_20:4PI 16:0_20:4ME577426----
PI 36:5|PI 16:0_20:5PI 16:0_20:5ME577427----
PI 37:4|PI 17:0_20:4PI 17:0_20:4ME577428----
PI 38:4|PI 16:0_22:4PI 16:0_22:4ME577429----
PI 38:4|PI 18:0_20:4_PI 38:4|PI 18:0_20:4PI 18:0_20:4ME577430----
PI 38:5|PI 18:0_20:5PI 18:0_20:5ME577431----
PI 38:5|PI 18:1_20:4PI 18:1_20:4ME577432----
PI 38:6|PI 16:0_22:6_PI 38:6|PI 16:0_22:6PI 16:0_22:6ME577433----
PI 40:4|PI 18:0_22:4PI 18:0_22:4ME577434----
PI 40:5|PI 18:0_22:5_PI 40:5|PI 18:0_22:5PI 18:0_22:5ME577435----
PI 40:6|PI 18:0_22:6PI 18:0_22:6ME577436----
PI 40:6|PI 18:1_22:5PI 18:1_22:5ME577437----
PI 40:7|PI 18:1_22:6PI 18:1_22:6ME577438----
PI O-36:4|PI O-16:0_20:4PI O-16:0/20:4ME577439----
PI O-38:4|PI O-18:0_20:4PI O-18:0/20:4ME577440----
PI O-38:5|PI O-18:1_20:4PI O-18:1/20:4ME577441----
PS 32:0|PS 16:0_16:0PS 16:0/16:0ME577443----
PS 32:1|PS 16:0_16:1PS 16:0_16:1ME577444----
PS 34:1|PS 16:0_18:1_PS 34:1|PS 16:0_18:1PS 16:0_18:1ME577445----
PS 34:2|PS 16:0_18:2PS 16:0_18:2ME577446----
PS 36:1|PS 18:0_18:1PS 18:0_18:1ME577447----
PS 36:2|PS 18:0_18:2PS 18:0_18:2ME577448----
PS 36:2|PS 18:0_18:2_PS 36:2|PS 18:0_18:2PS 18:0_18:2ME577449----
PS 36:3|PS 18:1_18:2PS 18:1_18:2ME577450----
PS 36:4|PS 16:0_20:4_PS 36:4|PS 16:0_20:4PS 16:0_20:4ME577451----
PS 38:2|PS 18:0_20:2PS 18:0_20:2ME577452----
PS 38:3|PS 18:0_20:3PS 18:0_20:3ME577453----
PS 38:4|PS 18:0_20:4PS 18:0_20:4ME577454----
PS 38:4|PS 18:0_20:4_PS 38:4|PS 18:0_20:4PS 18:0_20:4ME577455----
PS 38:5|PS 18:0_20:5_PS 38:5|PS 18:0_20:5PS 18:0_20:5ME577456----
PS 38:6|PS 16:0_22:6_PS 38:6|PS 16:0_22:6PS 16:0_22:6ME577457----
PS 40:1|PS 22:0_18:1PS 18:1_22:0ME577458----
PS 40:2|PS 18:1_22:1PS 18:1_22:1ME577459----
PS 40:4|PS 18:0_22:4PS 18:0_22:4ME577460----
PS 40:5|PS 18:0_22:5_PS 40:5|PS 18:0_22:5PS 18:0_22:5ME577461----
PS 40:6|PS 18:0_22:6PS 18:0_22:6ME577462----
PS 40:7|PS 18:1_22:6_PS 40:7|PS 18:1_22:6PS 18:1_22:6ME577463----
PS 40:8|PS 20:4_20:4PS 20:4/20:4ME577464----
PS 42:0|PS 18:0_24:0PS 18:0_24:0ME577465----
PS 42:1|PS 24:0_18:1PS 18:1_24:0ME577466----
SM 33:1SM 33:1;O2ME577467----
SM 34:0SM 34:0;O2ME577468----
SM 34:1SM 34:1;O2ME577469----
SM 34:2SM 34:2;O2ME577470----
SM 36:0SM 36:0;O2ME577471----
SM 36:1SM 36:1;O2ME577472----
SM 36:2SM 36:2;O2ME577473----
SM 38:2SM 38:2;O2ME577474----
SM 40:3SM 40:3;O2ME577475----
SM d37:1SM 37:1;O2ME577476----
SM d38:1SM 38:1;O2ME577477----
SM d39:2SM 39:2;O2ME577478----
SM d40:1SM 40:1;O2ME577479----
SM d40:2SM 40:2;O2ME577480----
SM d41:2SM 41:2;O2ME577481----
SM d43:2SM 43:2;O2ME577482----
ST 27:1-ME577483----
ST 28:1-ME577484----


Analysis: HILIC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1-(1Z-Hexadecenyl)-sn-glycero-3-phosphocholineLPC P-16:0 or LPC O-16:1ME577488----
1-(1Z-Octadecenyl)-sn-glycero-3-phosphocholineLPC P-18:0 or LPC O-18:1ME577489----
1,2,3,4-Tetrahydro-6-quinolinecarboxylic acid-ME577505----
1,2-dioleoyl-sn-glycero-3-phosphatidylcholinePC 18:1/18:1ME577504----
1_CUDA iSTD-ME577506----
1_D10-Leucine iSTD-ME577507----
1_D3-1-Methylnicotinamide iSTD-ME577508----
1_D3-AC(2:0) iSTD-ME577509----
1_D3-Aspartic Acid iSTD-ME577510----
1_D3-Creatinine iSTD-ME577511----
1_D3-DL-Alanine iSTD-ME577512----
1_D3-Histamine, N-methyl- iSTD-ME577513----
1_D3-L-Carnitine iSTD-ME577514----
1_D3-Serine iSTD_1_D3-Serine iSTD-ME577515----
1_D4-Cystine iSTD_1_D4-Cystine iSTD-ME577516----
1_D5-Histidine iSTD-ME577517----
1_D5-L-Glutamine iSTD-ME577518----
1_D5-Threonine iSTD-ME577519----
1_D7-Arginine iSTD_1_D7-Arginine iSTD-ME577520----
1_D7-Proline iSTD-ME577521----
1_D8-Lysine iSTD-ME577522----
1_D8-Methionine iSTD-ME577523----
1_D8-Phenylalanine iSTD-ME577524----
1_D8-Tryptophan iSTD-ME577525----
1_D9-Betaine iSTD-ME577526----
1_D9-Choline iSTD-ME577527----
1_D9-TMAO iSTD-ME577528----
1-Hexadecyl-sn-glycero-3-phosphocholineLPC O-16:0ME577490----
1-Methyladenosine1-MethyladenosineME577491----
1-Methylhistamine1-MethylhistamineME577492----
1-Methylnicotinamide1-Methyl nicotinamideME577493----
1-Oleoyl-2-myristoyl-sn-glycero-3-phosphocholine-ME577494----
1-Oleoyl-sn-glycero-3-phosphoethanolamineLPE 18:1/0:0ME577495----
1-Palmitoyl-2-docosahexaenoyl-sn-glycero-3-phospho...PC 16:0/22:6ME577496----
1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanola...LPE 16:0/0:0ME577497----
1-Palmitoyl-2-linoleoyl-sn-glycero-3-phosphocholin...PC 16:0/18:2ME577498----
1-Palmitoyl-sn-glycero-3-phosphocholineLPA 16:0/0:0ME577499----
1-Stearoyl-2-arachidonoyl-sn-glycero-3-phosphoseri...-ME577500----
1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholineLPC 18:0/0:0ME577501----
1-Stearoyl-2-hydroxy-sn-glycero-3-phosphoethanolam...LPE 18:0/0:0ME577502----
1-Stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-seri...-ME577503----
1_Val-Tyr-Val iSTDVal-Tyr-ValME577529----
2,3-Dioxoindoline-7-carboxylic acid-ME577534----
2'-DeoxycytidineDeoxycytidineME577530----
2-Docosahexaenoyl-1-stearoyl-sn-glycero-3-phosphos...-ME577531----
2-Oleoyl-1-palmitoyl-sn-glycero-3-phosphocholinePC 16:0/18:1ME577532----
2-Oleoyl-1-stearoyl-sn-glycero-3-phosphoserinePS 18:0/18:1ME577533----
(2R)-3-HydroxyisovaleroylcarnitineCAR 4:0;OH,MeME577485----
2S-Amino-4E-octadecene-1,3S-diolL-threo-SphingosineME577535----
3-Aminotyrosine-ME577536----
(3-Carboxypropyl)trimethylammonium cation3-DehydroxycarnitineME577486----
3-HydroxybutyrylcarnitineCAR 4:0;3OHME577537----
4-Aminobenzoic acidp-Aminobenzoic acidME577538----
5-(Galactosylhydroxy)-L-lysine5-(Galactosylhydroxy)-lysineME577540----
5-Methoxy-2-nitrophenylamine-ME577541----
5'-Methylthioadenosine5'-MethylthioadenosineME577539----
6-Aminoindazole-ME577542----
6-Ketoprostaglandin F1.alpha.6-Keto-PGF1alphaME577543----
6-Methylnicotinic acid-ME577544----
7,8-Dimethyl-4-hydroxy-3-quinolinecarboxylic acid-ME577545----
8(9)-Epoxy-5Z,11Z,14Z-eicosatrienoic acid, methyl ...-ME577546----
Acetyl-.beta.-alanine-ME577547----
Acetyl-DL-carnitineCAR 2:0ME577548----
AdenineAdenineME577549----
AdenosineAdenosineME577550----
Ala-AlaAla-AlaME577551----
Ala-ArgAla-ArgME577552----
alpha-Galactosamine-1-phosphate-ME577553----
AMPAMPME577554----
ArginineArginineME577555----
Aspartic acidAspartic acidME577556----
beta-Alaninebeta-AlanineME577557----
BetaineBetaineME577558----
Betaine aldehyde cationBetaineME577559----
CarnitineCarnitineME577560----
Choline [M]+CholineME577561----
CitrullineCitrullineME577562----
CreatineCreatineME577563----
CytarabineCytarabineME577564----
CytidineCytidineME577565----
Cytidine 2',3'-cyclic monophosphoric acid2',3' cyclic CMPME577566----
CytosineCytosineME577567----
DL-HomocysteineHomocysteineME577569----
D-Ribose 5-phosphateRibose 5-phosphateME577568----
ErgothioneineErgothioneineME577570----
EthanolamineEthanolamineME577571----
Ethyl 4-(1-hydroxy-1-methylethyl)-2-propyl-1H-imid...-ME577572----
Galacto-N-biose-ME577573----
gamma-Glutamylleucinegamma-GlutamylleucineME577574----
Glucose-1-phosphateGlucose 1-phosphateME577577----
Glucose-6-phosphateGlucose 6-phosphateME577578----
Glu-GlnGlu-GlnME577575----
Glu-SerGlu-SerME577576----
Glutamic acidGlutamic acidME577579----
GlutamineGlutamineME577580----
Glutathione (reduced)GlutathioneME577581----
Glycerol tricaprylate-ME577583----
Glycerophosphocholinesn-Glycero-3-phosphocholineME577584----
GlycineGlycineME577585----
Gly-valGly-ValME577582----
Guanidinoacetic acidGuanidoacetic acidME577586----
GuanineGuanineME577587----
GuanosineGuanosineME577589----
Guanosine 5'-monophosphateGMPME577588----
His-LeuHis-LeuME577590----
HistamineHistamineME577591----
HistidineHistidineME577592----
HypoxanthineHypoxanthineME577593----
InosineInosineME577594----
Inosine-5'-monophosphateIMPME577595----
L-CarnitineCarnitineME577597----
Leu-LeuLeu-LeuME577600----
L-.gamma.-Glutamyl-L-glutamic acidgamma-Glutamylglutamic acidME577596----
L-ProlineProlineME577598----
L-PropionylcarnitineCAR 3:0ME577599----
LysineLysineME577601----
Methacholine cation_Methacholine cationMethacholineME577602----
MethionineMethionineME577603----
Methioninesulfoxide A-ME577604----
N-(2-Chlorobenzyl)-2-propanamine-ME577605----
N8-AcetylspermidineN8-AcetylspermidineME577615----
N-Acetyl-D-glucosamineN-Acetyl-D-glucosamineME577608----
N-Acetyl-D-lactosamineN-AcetyllactosamineME577609----
N-.alpha.-Acetyl-L-ornithineN-AcetylornithineME577607----
NicotinamideNiacinamideME577616----
Nicotinamide riboside cationNicotinamide ribosideME577617----
N-Methylglutamic acidN-Methyl-glutamic acidME577610----
N-MethylhistidineN-MethylhistidineME577611----
N-Methylserine-ME577612----
N-MethylvalineN-Methyl-valineME577613----
N,N-DimethylarginineDimethylarginineME577614----
N-(Octadecanoyl)sphing-4-enine-1-phosphocholineSM 18:1;O2/18:0ME577606----
OrnithineOrnithineME577619----
O-t-Butyl-L-serine, methyl ester-ME577618----
PalmitoylcarnitineCAR 16:0ME577621----
Palmitoyl sphingomyelinSM 18:1;O2/16:0ME577620----
Pantothenic acidPantothenic acidME577622----
PhenylalaninePhenylalanineME577623----
Pro-LeuPro-LeuME577624----
Proline-hydroxyprolinePro-hydroxyProME577625----
Prostaglandin I2PGI2ME577626----
PutrescinePutrescineME577627----
(R)-ButyrylcarnitineCAR 4:0ME577487----
S-Adenosyl-homocysteineS-AdenosylhomocysteineME577628----
Ser-GlnSer-GlnME577630----
SerineSerineME577632----
SerotoninSerotoninME577633----
Ser-SerSer-SerME577631----
S-LactoylglutathioneS-LactoylglutathioneME577629----
SucroseSucroseME577634----
TaurineTaurineME577635----
Taurocholic acidTaurocholic acidME577636----
Thiamine cationThiamineME577637----
ThreonineThreonineME577638----
TMAOTrimethylamine N-oxideME577639----
TryptophanTryptophanME577640----
Tyr-ArgTyr-ArgME577641----
UMPUMPME577642----
UridineUridineME577644----
Uridine-5-diphosphoacetylgalactosamineUDP-N-acetylgalactosamineME577643----
XanthineXanthineME577645----


Analysis: HILIC NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
11-Hydroxyundecanoic acid-ME577649----
12R-Hydroxy-5Z,8Z,10E,14Z-eicosatetraenoic acid_Un...-ME577650----
1-(3-Pyridyl)-1-butanone-4-carboxylic acid-ME577646----
1,4-ButynediolBut-2-yne-1,4-diolME577647----
15(R),19(R)-Hydroxyprostaglandin E1-ME577651----
1-Methylxanthine1-MethylxanthineME577652----
1-Palmitoyl-2-hydroxy-sn-glycero-3-phospho-(1'-rac...-ME577653----
1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanola...LPE 16:0/0:0ME577654----
1-Palmitoyl-2-oleoyl-phosphatidylglycerol-ME577655----
1-Phenyl-1H-indole-2-carboxylic acid-ME577656----
1-Stearoyl-2-arachidonoyl-sn-glycero-3-phospho-(1'...PI 18:0/20:4ME577657----
1-Stearoyl-2-arachidonoyl-sn-glycero-3-phosphoseri...-ME577658----
2,3-Dihydroxypropyl dihydrogen phosphate-ME577659----
2-Amino-3-methoxybenzoic acid3-Methoxyanthranilic acidME577660----
2-Aminoethyl dihydrogen phosphatePhosphoethanolamineME577661----
2-Cyanoamino-4,6-dihydroxypyrimidine-ME577662----
2-Dec-9-enylpentanedioic acid-ME577663----
2-Deoxycytidine-5-monophosphoric acid_[M-H]-_NCMVO...-ME577665----
2-Docosahexaenoyl-1-stearoyl-sn-glycero-3-phosphos...-ME577666----
2-Furoic acid_[M-H]-_SMNDYUVBFMFKNZ-UHFFFAOYSA-N2-Furoic acidME577667----
2-Hydroxyquinoline_[M-H]-_LISFMEBWQUVKPJ-UHFFFAOYS...2-HydroxyquinolineME577668----
2-Keto-D-gluconic acid2-Dehydro-D-gluconic acidME577669----
2-Oleoyl-1-stearoyl-sn-glycero-3-phosphoserinePS 18:0/18:1ME577670----
2-Pyrimidinylacetic acid-ME577671----
3,5-Dihydroxyphenylglycine_[M-H]-_IFXDBKRFNXPGNO-U...-ME577673----
3-(Aminocarbonyl)benzoic acid-ME577672----
3-Hydroxy-3-methylglutaric acid3-Hydroxymethylglutaric acidME577674----
3-Hydroxybutyric acid_[M-H]-_WHBMMWSBFZVSSR-UHFFFA...3-Hydroxybutyric acidME577675----
4,5-Dimethyl-1,3-oxazole-2-thiol-ME577676----
4-Hydrazinobenzenesulfonic acid-ME577677----
4-Hydroxy-3-methoxymandelic acid_[M-H]-_CGQCWMIAEP...-ME577678----
4-Hydroxy-6-methyl-2-pyrone_[M-H]-_NSYSSMYQPLSPOD-...-ME577679----
4-Hydroxyhippuric acid_[M-H]-_ZMHLUFWWWPBTIU-UHFFF...4-Hydroxyhippuric acidME577680----
4-Ketopimelic acid-ME577681----
4-Nitrocatechol_[M-H]-_XJNPNXSISMKQEX-UHFFFAOYSA-N4-NitrocatecholME577682----
4-Nitrophenol_[M-H]-_BTJIUGUIPKRLHP-UHFFFAOYSA-N_3...4-NitrophenolME577683----
4-Pyridoxic acid4-Pyridoxic acidME577684----
5-Aminoisophthalic acid-ME577685----
8-Oxononanoic acid-ME577686----
Abscisic acid_[M-H]-_JLIDBLDQVAYHNE-LXGGSRJLSA-NAbscisic acidME577687----
Acetyl-.beta.-alanine-ME577688----
Acetyl-L-threonine-ME577689----
Adenosine 5'-diphosphoriboseADP-riboseME577690----
Adenosine 5'-monophosphate_[M-H]-_UDMBCSSLTHHNCD-K...AMPME577691----
Ala-Ala_[M-H]-_DEFJQIDDEAULHB-QWWZWVQMSA-NAla-AlaME577692----
Ala-SerAla-SerME577693----
Ala-ThrAla-ThrME577694----
Arginine_[M-H]-_ODKSFYDXXFIFQN-BYPYZUCNSA-NArginineME577696----
Aspartic acid_[M-H]-_CKLJMWTZIZZHCS-REOHCLBHSA-NAspartic acidME577697----
Asp-Glu_[M-H]-_CKAJHWFHHFSCDT-UHFFFAOYSA-NAsp-GluME577698----
Cellobiose B_[M-H]-_GUBGYTABKSRVRQ-QRZGKKJRSA-N_Ma...-ME577699----
Cholesterol 3-sulfateCholesterol sulfateME577700----
Citraconic acidCitraconic acidME577701----
CreatineCreatineME577702----
Cytarabine_[M-H]-_UHDGCWIWMRVCDJ-CCXZUQQUSA-NCytarabineME577703----
Cytidine 2',3'-cyclic monophosphoric acid2',3' cyclic CMPME577704----
Cytidine-5'-monophosphate_[M-H]-_IERHLVCPSMICTF-XV...CMPME577706----
D-2-Phosphoglyceric acid2-Phosphoglyceric acidME577707----
Dehydroascorbic acid?_[M-H]-_SBJKKFFYIZUCET-JLAZNS...L-Dehydroascorbic acidME577708----
Dihydroxyacetone phosphate_[M-H]-_GNGACRATGGDKBX-U...Dihydroxyacetone phosphateME577709----
Dodecanedioic acidDodecanedioic acidME577710----
D-PsicosePsicoseME577711----
D-RiboseRiboseME577712----
Ethyl-beta-glucuronide_[M-H]-_IWJBVMJWSPZNJH-UQGZV...Ethyl glucuronideME577714----
Ethylenediaminetetraacetic acidEdetic acidME577715----
Ferulic acid_[M-H]-_KSEBMYQBYZTDHS-HWKANZROSA-Ntrans-Ferulic acidME577716----
Gallic acidGallic acidME577718----
gamma-Glutamylleucine_[M-H]-_MYFMARDICOWMQP-YUMQZZ...gamma-GlutamylleucineME577719----
gamma-Glutamyltyrosine_[M-H]-_VVLXCWVSSLFQDS-QWRGU...gamma-GlutamyltyrosineME577720----
Glucose-1-phosphate_[M-H]-_HXXFSFRBOHSIMQ-VFUOTHLC...Glucose 1-phosphateME577721----
Glucose-6-phosphate_[M-H]-_NBSCHQHZLSJFNQ-GASJEMHN...Glucose 6-phosphateME577722----
Glu-Gln_[M-H]-_MGHKSHCBDXNTHX-UHFFFAOYSA-NGlu-GlnME577723----
Glutamine_[M-H]-_ZDXPYRJPNDTMRX-VKHMYHEASA-N_4-Ami...GlutamineME577724----
Glutathione (oxidized)_[M-H]-_YPZRWBKMTBYPTK-BJDJZ...GlutathioneME577725----
Glutathione (reduced)_[M-H]-_RWSXRVCMGQZWBV-WDSKDS...GlutathioneME577726----
Glutathionesulfonic acid-ME577727----
Glu-Thr_[M-H]-_JSIQVRIXMINMTA-ZDLURKLDSA-NGlu-ThrME577728----
Gly-AspGly-AspME577729----
Glyceric acidGlyceric acidME577730----
Glycolic acidGlycolic acidME577732----
Gly-Leu_[M-H]-_DKEXFJVMVGETOO-LURJTMIESA-NGly-LeuME577733----
Gly-ThrGly-ThrME577734----
Gly-Tyr-Ala_[M-H]-_UIQGJYUEQDOODF-KWQFWETISA-NGly-Tyr-AlaME577736----
Gly-Tyr_[M-H]-_XBGGUPMXALFZOT-VIFPVBQESA-NGly-TyrME577735----
Gly-Val_[M-H]-_STKYPAFSDFAEPH-UHFFFAOYSA-NGly-ValME577737----
Guanidinopropionic acid-ME577738----
Guanosine-5'-monophosphate_[M-H]-_RQFCJASXJCIDSX-U...GMPME577739----
Hexadecanedioic acidHexadecanedioic acidME577740----
Hypoxanthine_[M-H]-_FDGQSTZJBFJUBT-UHFFFAOYSA-NHypoxanthineME577741----
Indole-3-carboxaldehyde_[M-H]-_OLNJUISKUQQNIM-UHFF...1H-Indole-3-carboxaldehydeME577743----
Indole-3-carboxylic acid_[M-H]-_KMAKOBLIOCQGJP-UHF...Indole-3-carboxylic acidME577744----
Indoxyl sulfate_[M-H]-_BXFFHSIDQOFMLE-UHFFFAOYSA-NIndoxyl sulfateME577745----
Inosine-5-monophosphate_[M-H]-_GRSZFWQUAKGDAV-KQYN...IMPME577747----
Inosine_[M-H]-_UGQMRVRMYYASKQ-KQYNXXCUSA-NInosineME577746----
L-Cysteine-glutathione disulfide_L-Cysteine-glutat...-ME577749----
L-Cysteinesulfinic acid3-Sulfino-alanineME577750----
L-Cysteinesulfinic acid_L-Cysteinesulfinic acid-ME577751----
Leucine_[M-H]-_ROHFNLRQFUQHCH-YFKPBYRVSA-NLeucineME577752----
Leu-LeuLeu-LeuME577753----
L-.gamma.-Glutamyl-L-glutamic acidgamma-Glutamylglutamic acidME577748----
L-Gulono-1,4-lactone-ME577754----
Linoleic acid_[M-H]-_OYHQOLUKZRVURQ-HZJYTTRNSA-NLinoleic acidME577755----
Methioninesulfoxide_[M-H]-_QEFRNWWLZKMPFJ-YGVKFDHG...Methionine sulfoxideME577756----
Methylsuccinic acid_[M-H]-_WXUAQHNMJWJLTG-UHFFFAOY...Methylsuccinic acidME577757----
Mevalonic acidMevalonic acidME577758----
N-Acetylcysteine_[M-H]-_PWKSKIMOESPYIA-BYPYZUCNSA-...N-AcetylcysteineME577760----
N-Acetyl-D-galactosamine 4-sulfate-ME577761----
N-Acetyl-D-galactosamine-6-phosphate-ME577762----
N-Acetyl-D-lactosamineN-AcetyllactosamineME577763----
N-Acetyl-DL-valine-ME577764----
N-Acetylhistidine_[M-H]-_KBOJOGQFRVVWBH-ZETCQYMHSA...N-AcetylhistidineME577765----
N-Acetyl-L-alanineN-AcetylalanineME577766----
N-Acetyl-L-carnosineN-AcetylcarnosineME577767----
N-Acetylmannosamine_[M-H]-_OVRNDRQMDRJTHS-ZTVVOAFP...N-Acetyl-mannosamineME577769----
N-Acetylneuraminic acid_[M-H]-_SQVRNKJHWKZAKO-LUWB...N-Acetylneuraminic acidME577770----
N-epsilon-Acetyllysine_[M-H]-_DTERQYGMUDWYAZ-ZETCQ...N6-AcetyllysineME577771----
N-Formylmethionine_[M-H]-_PYUSHNKNPOHWEZ-YFKPBYRVS...N-FormylmethionineME577772----
N-gamma-Acetyl-N-2-formyl-5-methoxykynurenamine_[M...-ME577773----
N-Glycolylneuraminic acidN-Glycolylneuraminic acidME577774----
N-L-.gamma.-Glutamyl-L-leucine-ME577775----
N-Methylglutamic acid_[M-H]-_XLBVNMSMFQMKEY-UHFFFA...N-Methyl-glutamic acidME577776----
N-Methylvaline_[M-H]-_AKCRVYNORCOYQT-UHFFFAOYSA-NN-Methyl-valineME577777----
N,N-Dimethylarginine_[M-H]-_NWGZOALPWZDXNG-UHFFFAO...DimethylarginineME577759----
N-Phenyl-1H-pyrazole-3-carboxamide-ME577778----
Octadecanedioic acid_[M-H]-_BNJOQKFENDDGSC-UHFFFAO...Octadecanedioic acidME577779----
Ornithine_[M-H]-_AHLPHDHHMVZTML-BYPYZUCNSA-NOrnithineME577780----
Orotic acid_[M-H]-_PXQPEWDEAKTCGB-UHFFFAOYSA-NOrotic acidME577781----
OxypurinolOxypurinolME577782----
Palmitic acid_[M-H]-_IPCSVZSSVZVIGE-UHFFFAOYSA-NPalmitic acidME577783----
Pantothenic acidPantothenic acidME577784----
Phenaceturic acidPhenylacetylglycineME577785----
Phenylalanine_[M-H]-_COLNVLDHVKWLRT-QMMMGPOBSA-NPhenylalanineME577786----
Phosphoenolpyruvic acid_[M-H]-_DTBNBXWJWCWCIK-UHFF...Phosphoenolpyruvic acidME577787----
Propionic acidPropionic acidME577788----
Propionic acid_[M-H]-_XBDQKXXYIPTUBI-UHFFFAOYSA-NPropionic acidME577789----
Prostaglandin E1_[M-H]-_GMVPRGQOIOIIMI-DWKJAMRDSA-...PGE1ME577790----
Pyridine-3,4-dicarboxylic acid-ME577791----
Pyroglutamic acid_[M-H]-_ODHCTXKNWHHXJC-VKHMYHEASA...Pyroglutamic acidME577792----
Pyruvic acid_[M-H]-_LCTONWCANYUPML-UHFFFAOYSA-NPyruvic acidME577793----
Ribose-5-phosphate_[M-H]-_KTVPXOYAKDPRHY-AIHAYLRMS...Ribose 5-phosphateME577794----
Ribulose 5-phosphateRibulose 5-phosphateME577795----
S-Carboxymethyl-L-cysteineS-Carboxymethyl-cysteineME577798----
Ser-GluSer-GluME577800----
Serine_[M-H]-_MTCFGRXMJLQNBG-REOHCLBHSA-NSerineME577801----
Ser-SerSer-SerME577802----
Ser-ThrSer-ThrME577803----
S-Lactoylglutathione_S-Lactoylglutathione-ME577804----
Sucrose_[M-H]-_CZMRCDWAGMRECN-UGDNZRGBSA-N_D-(+)-T...SucroseME577805----
Taurine_[M-H]-_XOAAWQZATWQOTB-UHFFFAOYSA-NTaurineME577806----
Taurocholic acid_[M-H]-_WBWWGRHZICKQGZ-HZAMXZRMSA-...Taurocholic acidME577807----
Tetraazolo[1,5-a]pyridine-8-carboxylic acid-ME577808----
Tetradecanedioic acidTetradecanedioic acidME577809----
Theophylline_[M-H]-_ZFXYFBGIUFBOJW-UHFFFAOYSA-NTheophyllineME577810----
Threonic acidThreonic acidME577811----
Thr-ThrThr-ThrME577813----
Thymidine?5'-monophosphate_[M-H]-_GYOZYWVXFNDGLU-X...TMPME577814----
Trichloroacetic acid_[M-H]-_YNJBWRMUSHSURL-UHFFFAO...-ME577816----
Undecanedioic acidUndecanedioic acidME577817----
Uracil_[M-H]-_ISAKRJDGNUQOIC-UHFFFAOYSA-NUracilME577818----
Uridine-5-diphosphoacetylgalactosamine_[M-H]-_LFTY...UDP-N-acetylgalactosamineME577823----
Uridine 5'-monophosphate_[M-H]-_DJJCXFVJDGTHFX-XVF...UMPME577819----
Uridine diphosphate galactose_[M-H]-_HSCJRCZFDFQWR...Uridine diphosphategalactoseME577820----
Uridine diphosphate glucuronic acid_[M-H]-_HDYANYH...UDP-glucuronic acidME577821----
Xanthosine_[M-H]-_UBORTCNDUKBEOP-UUOKFMHZSA-NXanthosineME577825----
Xylose_Gly-Val_[M-H]-_STKYPAFSDFAEPH-UHFFFAOYSA-N-ME577827----


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