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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
BMP 32:0BMP 32:0ME420058----
BMP 32:1BMP 32:1ME420059----
BMP 34:0BMP 34:0ME420060----
BMP 34:1BMP 34:1ME420061----
BMP 34:2BMP 34:2ME420062----
BMP 36:0BMP 36:0ME420063----
BMP 36:1BMP 36:1ME420064----
BMP 36:2BMP 36:2ME420065----
BMP 36:3BMP 36:3ME420066----
BMP 38:3BMP 38:3ME420067----
BMP 38:4BMP 38:4ME420068----
BMP 38:5BMP 38:5ME420069----
GM3 16:0GM3 18:1;O2/16:0ME419941----
GM3 18:0GM3 18:1;O2/18:0ME419942----
GM3 18:1-ME419943----
GM3 20:0-ME419944----
GM3 22:0GM3 18:1;O2/22:0ME419945----
GM3 24:0-ME419946----
GM3 24:1GM3 18:1;O2/24:1ME419947----
LPE 16:0LPE 16:0ME420048----
LPE 18:0LPE 18:0ME420049----
LPE 18:1LPE 18:1ME420050----
LPE 20:4LPE 20:4ME420051----
LPEp 16:0LPE P-16:0 or LPE O-16:1ME420052----
LPEp 18:0LPE P-18:0 or LPE O-18:1ME420053----
LPEp 18:1LPE P-18:1 or LPE O-18:2ME420054----
LPI 16:0LPI 16:0ME420055----
LPI 18:0LPI 18:0ME420056----
LPI 20:4LPI 20:4ME420057----
NAPS 36:0-ME420070----
NAPS 36:1-ME420071----
NAPS 36:2-ME420072----
NAPS 38:2-ME420073----
NAPS 38:3-ME420074----
NAPS 38:4-ME420075----
NAPS 40:4-ME420076----
NAPS 40:5-ME420077----
NAPS 40:6-ME420078----
PA 32:0PA 32:0ME419948----
PA 32:1PA 32:1ME419949----
PA 34:0PA 34:0ME419950----
PA 34:1PA 34:1ME419951----
PA 34:2PA 34:2ME419952----
PA 36:0PA 36:0ME419953----
PA 36:1PA 36:1ME419954----
PA 36:2PA 36:2ME419955----
PA 38:1PA 38:1ME419956----
PA 38:2PA 38:2ME419957----
PA 38:3PA 38:3ME419958----
PA 38:4PA 38:4ME419959----
PA 40:5PA 40:5ME419960----
PA 40:6PA 40:6ME419961----
PE 30:0PE 30:0ME419962----
PE 32:0PE 32:0ME419963----
PE 32:1PE 32:1ME419964----
PE 34:0PE 34:0ME419965----
PE 34:1PE 34:1ME419966----
PE 34:2PE 34:2ME419967----
PE 36:0PE 36:0ME419968----
PE 36:1PE 36:1ME419969----
PE 36:2PE 36:2ME419970----
PE 36:3PE 36:3ME419971----
PE 36:4PE 36:4ME419972----
PE 38:1PE 38:1ME419973----
PE 38:2PE 38:2ME419974----
PE 38:3PE 38:3ME419975----
PE 38:4PE 38:4ME419976----
PE 38:5PE 38:5ME419977----
PE 38:6PE 38:6ME419978----
PE 40:3PE 40:3ME419979----
PE 40:4PE 40:4ME419980----
PE 40:5PE 40:5ME419981----
PE 40:6PE 40:6ME419982----
PE 42:5PE 42:5ME419983----
PE 42:6PE 42:6ME419984----
PEp 32:0PE P-32:0 or PE O-32:1ME419985----
PEp 32:1PE P-32:1 or PE O-32:2ME419986----
PEp 34:0PE P-34:0ME419987----
PEp 34:1PE P-34:1 or PE O-34:2ME419988----
PEp 34:2PE P-34:2 or PE O-34:3ME419989----
PEp 36:0PE P-36:0 or PE O-36:1ME419990----
PEp 36:1PE P-36:1ME419991----
PEp 36:2PE P-36:2 or PE O-36:3ME419992----
PEp 36:3PE P-36:3ME419993----
PEp 36:4PE P-36:4 or PE O-36:5ME419994----
PEp 38:2PE P-38:2 or PE O-38:3ME419995----
PEp 38:3PE P-38:3 or PE O-38:4ME419996----
PEp 38:4PE P-38:4 or PE O-38:5ME419997----
PEp 38:5PE P-38:5ME419998----
PEp 38:6PE P-38:6 or PE O-38:7ME419999----
PEp 40:3PE P-40:3 or PE O-40:4ME420000----
PEp 40:4PE P-40:4 or PE O-40:5ME420001----
PEp 40:5PE P-40:5 or PE O-40:6ME420002----
PEp 40:6PE P-40:6ME420003----
PEp 42:5PE P-42:5 or PE O-42:6ME420004----
PEp 42:6PE P-42:6 or PE O-42:7ME420005----
PG 32:0PG 32:0ME420006----
PG 32:1PG 32:1ME420007----
PG 34:0PG 34:0ME420008----
PG 34:1PG 34:1ME420009----
PG 34:2PG 34:2ME420010----
PG 36:0PG 36:0ME420011----
PG 36:1PG 36:1ME420012----
PG 36:2PG 36:2ME420013----
PG 36:3PG 36:3ME420014----
PG 38:3PG 38:3ME420015----
PG 38:4PG 38:4ME420016----
PG 38:5PG 38:5ME420017----
PI 34:0PI 34:0ME420018----
PI 34:1PI 34:1ME420019----
PI 36:1PI 36:1ME420020----
PI 36:2PI 36:2ME420021----
PI 36:3PI 36:3ME420022----
PI 36:4PI 36:4ME420023----
PI 38:3PI 38:3ME420024----
PI 38:4PI 38:4ME420025----
PI 38:5PI 38:5ME420026----
PI 38:6PI 38:6ME420027----
PI 40:4PI 40:4ME420028----
PI 40:5PI 40:5ME420029----
PI 40:6PI 40:6ME420030----
PS 32:0PS 32:0ME420031----
PS 32:1PS 32:1ME420032----
PS 34:0PS 34:0ME420033----
PS 34:1PS 34:1ME420034----
PS 36:0PS 36:0ME420035----
PS 36:1PS 36:1ME420036----
PS 36:2PS 36:2ME420037----
PS 38:1PS 38:1ME420038----
PS 38:2PS 38:2ME420039----
PS 38:3PS 38:3ME420040----
PS 38:4PS 38:4ME420041----
PS 40:3PS 40:3ME420042----
PS 40:4PS 40:4ME420043----
PS 40:5PS 40:5ME420044----
PS 40:6PS 40:6ME420045----
PS 42:4PS 42:4ME420046----
PS 42:5PS 42:5ME420047----
Sulf 16:0-ME419924----
Sulf 18:0-ME419925----
Sulf 18:1-ME419926----
Sulf 20:0-ME419927----
Sulf 22:0-ME419928----
Sulf 24:0-ME419929----
Sulf 24:1-ME419930----
Sulf 26:0-ME419931----
Sulf 26:1-ME419932----
Sulf(2OH) 18:0-ME419933----
Sulf(2OH) 20:0-ME419934----
Sulf(2OH) 22:0-ME419935----
Sulf(2OH) 22:1-ME419936----
Sulf(2OH) 24:0-ME419937----
Sulf(2OH) 24:1-ME419938----
Sulf(2OH) 26:0-ME419939----
Sulf(2OH) 26:1-ME419940----


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
Cer 16:0Cer 18:1;O2/16:0ME420079----
Cer 16:1Cer 18:1;O2/16:1ME420080----
Cer 18:0Cer 18:1;O2/18:0ME420081----
Cer 18:1Cer 18:1;O2/18:1ME420082----
Cer 20:0Cer 18:1;O2/20:0ME420083----
Cer 20:1Cer 18:1;O2/20:1ME420084----
Cer 22:0Cer 18:1;O2/22:0ME420085----
Cer 22:1Cer 18:1;O2/22:1ME420086----
Cer 24:0Cer 18:1;O2/24:0ME420087----
Cer 24:1Cer 18:1;O2/24:1ME420088----
dhSM 16:0SM 18:0;O2/16:0ME420098----
dhSM 16:1-ME420099----
dhSM 18:0SM 18:0;O2/18:0ME420100----
dhSM 18:1-ME420101----
dhSM 20:0SM 18:0;O2/20:0ME420102----
dhSM 20:1-ME420103----
dhSM 22:0SM 18:0;O2/22:0ME420104----
dhSM 22:1-ME420105----
dhSM 24:0-ME420106----
dhSM 24:1-ME420107----
dhSM 26:1-ME420108----
dhSM 26:2-ME420109----
HexCer 16:0HexCer 18:1;O2/16:0ME420110----
HexCer 16:1-ME420111----
HexCer 18:0HexCer 18:1;O2/18:0ME420112----
HexCer 18:1HexCer 18:1;O2/18:1ME420113----
HexCer 20:0HexCer 18:1;O2/20:0ME420114----
HexCer 20:1-ME420115----
HexCer 22:0HexCer 18:1;O2/22:0ME420116----
HexCer 22:1-ME420117----
HexCer 24:0HexCer 18:1;O2/24:0ME420118----
HexCer 24:1HexCer 18:1;O2/24:1ME420119----
HexCer 26:0HexCer 18:1;O2/26:0ME420120----
HexCer 26:1HexCer 18:1;O2/26:1ME420121----
LacCer 16:0-ME420122----
LacCer 18:0-ME420123----
LacCer 20:0-ME420124----
LacCer 22:0-ME420125----
LacCer 24:0-ME420126----
LacCer 24:1-ME420127----
LPC 16:0LPC 16:0ME420172----
LPC 18:0LPC 18:0ME420173----
LPC 18:1LPC 18:1ME420174----
LPC 20:3LPC 20:3ME420175----
LPC 20:4LPC 20:4ME420176----
LPCe 16:0LPC O-16:0ME420177----
LPCe 18:0LPC O-18:0ME420178----
LPCe 18:1LPC P-18:0 or LPC O-18:1ME420179----
LPCe 20:0LPC O-20:0ME420180----
PC 30:0PC 30:0ME420128----
PC 32:0PC 32:0ME420129----
PC 32:1PC 32:1ME420130----
PC 34:0PC 34:0ME420131----
PC 34:1PC 34:1ME420132----
PC 34:2PC 34:2ME420133----
PC 36:0PC 36:0ME420134----
PC 36:1PC 36:1ME420135----
PC 36:2PC 36:2ME420136----
PC 36:3PC 36:3ME420137----
PC 36:4PC 36:4ME420138----
PC 38:0PC 38:0ME420139----
PC 38:1PC 38:1ME420140----
PC 38:2PC 38:2ME420141----
PC 38:3PC 38:3ME420142----
PC 38:4PC 38:4ME420143----
PC 38:5PC 38:5ME420144----
PC 38:6PC 38:6ME420145----
PC 40:4PC 40:4ME420146----
PC 40:5PC 40:5ME420147----
PC 40:6PC 40:6ME420148----
PC 40:7PC 40:7ME420149----
PC 42:5PC 42:5ME420150----
PC 42:6PC 42:6ME420151----
PC 42:7PC 42:7ME420152----
PCe 30:0-ME420153----
PCe 32:0-ME420154----
PCe 32:1-ME420155----
PCe 34:0-ME420156----
PCe 34:1-ME420157----
PCe 34:2-ME420158----
PCe 36:0-ME420159----
PCe 36:1-ME420160----
PCe 36:2-ME420161----
PCe 36:3-ME420162----
PCe 38:2-ME420163----
PCe 38:3-ME420164----
PCe 38:4-ME420165----
PCe 38:5-ME420166----
PCe 40:4-ME420167----
PCe 40:5-ME420168----
PCe 40:6-ME420169----
PCe 42:5-ME420170----
PCe 42:6-ME420171----
SM 16:0SM 18:1;O2/16:0ME420089----
SM 18:0SM 18:1;O2/18:0ME420090----
SM 18:1SM 18:1;O2/18:1ME420091----
SM 20:0SM 18:1;O2/20:0ME420092----
SM 22:0SM 18:1;O2/22:0ME420093----
SM 24:0SM 18:1;O2/24:0ME420094----
SM 24:1SM 18:1;O2/24:1ME420095----
SM 26:0SM 18:1;O2/26:0ME420096----
SM 26:1SM 18:1;O2/26:1ME420097----


Analysis: Normal phase POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
CE 16:0CE 16:0ME420184----
CE 16:1CE 16:1ME420185----
CE 18:0CE 18:0ME420186----
CE 18:1CE 18:1ME420187----
CE 18:2CE 18:2ME420188----
CE 20:1CE 20:1ME420189----
CE 20:2CE 20:2ME420190----
CE 20:3CE 20:3ME420191----
CE 20:4CE 20:4ME420192----
CE 22:4CE 22:4ME420193----
CE 22:5CE 22:5ME420194----
CE 22:6CE 22:6ME420195----
Chol 24-OH-ME420182----
Chol 27-OH-ME420183----
DAG 28:0/14:0DG 14:0_28:0ME420196----
DAG 30:0/14:0DG 14:0_30:0ME420197----
DAG 30:1/14:0-ME420198----
DAG 32:0/16:0DG 16:0_32:0ME420199----
DAG 32:1/16:0-ME420200----
DAG 32:2/16:1-ME420201----
DAG 34:0/16:0DG 16:0_34:0ME420202----
DAG 34:1/16:0-ME420203----
DAG 34:2/16:0-ME420204----
DAG 34:2/16:1-ME420205----
DAG 36:1/18:0-ME420206----
DAG 36:2/18:0-ME420207----
DAG 36:2/18:1-ME420208----
DAG 36:3/18:1-ME420209----
DAG 38:1/18:0-ME420210----
DAG 38:2/18:0-ME420211----
DAG 38:2/18:1-ME420212----
DAG 38:3/18:0-ME420213----
DAG 38:3/18:1-ME420214----
DAG 38:4/18:0-ME420215----
DAG 38:4/18:1-ME420216----
DAG 40:4/18:0-ME420217----
DAG 40:5/18:0-ME420218----
DAG 40:5/18:1-ME420219----
DAG 40:6/18:0-ME420220----
DAG 40:6/18:1-ME420221----
FC-ME420181----
TAG 48:0/16:0TG 16:0_48:0ME420222----
TAG 48:1/16:0TG 16:0_48:1ME420223----
TAG 50:0/16:0TG 16:0_50:0ME420224----
TAG 50:1/16:1TG 16:1_50:1ME420225----
TAG 50:2/16:1TG 16:1_50:2ME420226----
TAG 50:3/16:1TG 16:1_50:3ME420227----
TAG 52:0/18:0TG 18:0_52:0ME420228----
TAG 52:1/18:0TG 18:0_52:1ME420229----
TAG 52:2/18:0TG 18:0_52:2ME420230----
TAG 52:3/18:1TG 18:1_52:3ME420231----
TAG 52:4/18:1TG 18:1_52:4ME420232----
TAG 52:5/18:1TG 18:1_52:5ME420233----
TAG 52:5/20:4TG 20:4_52:5ME420234----
TAG 54:0/18:0TG 18:0_54:0ME420235----
TAG 54:1/18:0TG 18:0_54:1ME420236----
TAG 54:2/18:0TG 18:0_54:2ME420237----
TAG 54:3/18:0TG 18:0_54:3ME420238----
TAG 54:4/18:1TG 18:1_54:4ME420239----
TAG 54:4/20:4TG 20:4_54:4ME420240----
TAG 54:5/18:1TG 18:1_54:5ME420241----
TAG 54:5/20:4TG 20:4_54:5ME420242----
TAG 54:6/18:1TG 18:1_54:6ME420243----
TAG 54:6/20:4TG 20:4_54:6ME420244----
TAG 54:7/18:1TG 18:1_54:7ME420245----
TAG 54:7/20:4TG 20:4_54:7ME420246----
TAG 56:3/18:1TG 18:1_56:3ME420247----
TAG 56:4/18:1TG 18:1_56:4ME420248----
TAG 56:4/20:4TG 20:4_56:4ME420249----
TAG 56:5/18:1TG 18:1_56:5ME420250----
TAG 56:5/20:4TG 20:4_56:5ME420251----
TAG 56:6/20:4TG 20:4_56:6ME420252----
TAG 56:7/20:4TG 20:4_56:7ME420253----
TAG 56:8/20:4TG 20:4_56:8ME420254----
TAG 58:5/20:4-ME420255----
TAG 58:8/22:6TG 22:6_58:8ME420256----
TAG 58:9/22:6TG 22:6_58:9ME420257----
TAG 60:7/22:6-ME420258----
TAG 60:8/22:6-ME420259----
TAG 60:9/22:6-ME420260----


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