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Analysis: NMR data

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
Ace-2_1-ME339592----
Ace-2_2-ME339593----
aGlc_1-ME339787----
aGlc 13C-A_1-ME339776----
aGlc 13C-A_2-ME339777----
aGlc 13C-A_3-ME339778----
aGlc 13C-A_4-ME339779----
aGlc 13C-A_5-ME339780----
aGlc 13C-B_1-ME339781----
aGlc 13C-B_2-ME339782----
aGlc 13C-B_3-ME339783----
aGlc 13C-B_4-ME339784----
aGlc 13C-B_5-ME339785----
aGlc 13C-B_6-ME339786----
aGlc_2-ME339788----
Ala13C-A_1AlanineME339597----
Ala13C-A_2AlanineME339598----
Ala13C-A_3AlanineME339599----
Ala13C-A_4AlanineME339600----
Ala13C-A_5AlanineME339601----
Ala13C-A_6AlanineME339602----
Ala13C-B_1AlanineME339603----
Ala13C-B_2AlanineME339604----
Ala13C-B_3AlanineME339605----
Ala13C-B_4AlanineME339606----
Ala13C-B_5AlanineME339607----
Ala13C-B_6AlanineME339608----
Ala-3_1AlanineME339594----
Ala-3_2AlanineME339595----
Ala-3_3AlanineME339596----
AXP-1'_1-ME339583----
AXP-1' 13C-B_1-ME339582----
AXP-1'_2-ME339584----
AXP-1'_3-ME339585----
AXP-1'_4-ME339586----
AXP-2_1-ME339587----
AXP-2_2-ME339588----
AXP-2_3-ME339589----
AXP-8_1-ME339590----
AXP-8_2-ME339591----
bGlc_1-ME339797----
bGlc 13C-A_1-ME339789----
bGlc 13C-A_2-ME339790----
bGlc 13C-A_3-ME339791----
bGlc 13C-A_4-ME339792----
bGlc 13C-B_1-ME339793----
bGlc 13C-B_2-ME339794----
bGlc 13C-B_3-ME339795----
bGlc 13C-B_4-ME339796----
bGlc_2-ME339798----
bGlc_3-ME339799----
Creat_1-ME339611----
Creat-P_1-ME339610----
CXP-6_1-ME339609----
Cys-3-GSH_1-ME339612----
Cys-3-GSH_2-ME339613----
Cys-3-GSH_3-ME339614----
Cys-3-GSH_4-ME339615----
Cys-3-GSH_5-ME339616----
DSS_1DapsoneME339617----
For_1-ME339618----
Fum_1Fumaric acidME339619----
Gln-3_1GlutamineME339654----
Gln-3_2GlutamineME339655----
Gln-4_1GlutamineME339656----
Gln-4_2GlutamineME339657----
Gln-4_3GlutamineME339658----
Gln-4_4GlutamineME339659----
Gln-4_5GlutamineME339660----
Gln-4_6GlutamineME339661----
Gln-4_7GlutamineME339662----
Gln-4_8GlutamineME339663----
Gln+Glu-2_1Gln-GluME339646----
Gln+Glu-2_2Gln-GluME339647----
Gln+Glu-2_3Gln-GluME339648----
Gln+Glu-2_4Gln-GluME339649----
Gln+Glu-2_5Gln-GluME339650----
Gln+Glu-2_6Gln-GluME339651----
Gln+Glu-2_7Gln-GluME339652----
Gln+Glu-2_8Gln-GluME339653----
Glu-3-b_1-ME339664----
Glu-3-b_2-ME339665----
Glu-3-b_3-ME339666----
Glu-3-b_4-ME339667----
Glu-3-b_5-ME339668----
Glu-4_1Glutamic acidME339669----
Glu-4_2Glutamic acidME339670----
Glu-4_3Glutamic acidME339671----
Glu-4_4Glutamic acidME339672----
Glu-4_5Glutamic acidME339673----
Glu-4_6Glutamic acidME339674----
Glu-4_7Glutamic acidME339675----
Glu-4_8Glutamic acidME339676----
Glu-4_9Glutamic acidME339677----
Gly_1GlycineME339678----
Glyco 13C-A_1-ME339679----
Glyco 13C-B_1-ME339680----
Glycogen_1GlycogenME339681----
Glycogen_2GlycogenME339682----
Glycogen_3GlycogenME339683----
Glycogen_4GlycogenME339684----
Glycogen_5GlycogenME339685----
Glycogen_6GlycogenME339686----
Glycogen_7GlycogenME339687----
GSH-8_1GlutathioneME339639----
GSH-8_2GlutathioneME339640----
GSH-8_3GlutathioneME339641----
GSH-8_4GlutathioneME339642----
GSH+GSSG-3_1GlutathioneME339620----
GSH+GSSG-3_2GlutathioneME339621----
GSH+GSSG-3_3GlutathioneME339622----
GSH+GSSG-3_4GlutathioneME339623----
GSH+GSSG-3_5-ME339624----
GSH+GSSG-3_6-ME339625----
GSH+GSSG-4_1GlutathioneME339626----
GSH+GSSG-4_10-ME339627----
GSH+GSSG-4_11-ME339628----
GSH+GSSG-4_12-ME339629----
GSH+GSSG-4_13-ME339630----
GSH+GSSG-4_2GlutathioneME339631----
GSH+GSSG-4_3GlutathioneME339632----
GSH+GSSG-4_4GlutathioneME339633----
GSH+GSSG-4_5GlutathioneME339634----
GSH+GSSG-4_6GlutathioneME339635----
GSH+GSSG-4_7GlutathioneME339636----
GSH+GSSG-4_8GlutathioneME339637----
GSH+GSSG-4_9-ME339638----
GSSG-12_1Oxidized glutathioneME339643----
GXP-1'_1-ME339644----
GXP-1'_2-ME339645----
Ile_1IsoleucineME339688----
Ile_2IsoleucineME339689----
Inosine-1'_1-ME339690----
Inosine-1'_2-ME339691----
Lac13C-A_1Lactic acidME339708----
Lac13C-A_2Lactic acidME339709----
Lac13C-A_3Lactic acidME339710----
Lac13C-A_4Lactic acidME339711----
Lac13C-A_5Lactic acidME339712----
Lac13C-A_6Lactic acidME339713----
Lac13C-A_7Lactic acidME339714----
Lac13C-A_8Lactic acidME339715----
Lac13C-B_1Lactic acidME339716----
Lac13C-B_2Lactic acidME339717----
Lac13C-B_3Lactic acidME339718----
Lac13C-B_4Lactic acidME339719----
Lac13C-B_5Lactic acidME339720----
Lac13C-B_6Lactic acidME339721----
Lac13C-B_7Lactic acidME339722----
Lac13C-B_8Lactic acidME339723----
Lac-2_1Lactic acidME339701----
Lac-2 13C-B_1-ME339692----
Lac-2 13C-B_2-ME339693----
Lac-2 13C-B_3-ME339694----
Lac-2 13C-B_4-ME339695----
Lac-2 13C-B_5-ME339696----
Lac-2 13C-B_6-ME339697----
Lac-2 13C-B_7-ME339698----
Lac-2 13C-B_8-ME339699----
Lac-2 13C-B_9-ME339700----
Lac-2_2Lactic acidME339702----
Lac-2_3Lactic acidME339703----
Lac-2_4Lactic acidME339704----
Lac-3_1Lactic acidME339705----
Lac-3_2Lactic acidME339706----
Lac-3_3Lactic acidME339707----
Me-His A_1-ME339724----
Me-His B_1-ME339725----
Me-His B_2-ME339726----
m-Ins-1,3_1-ME339800----
m-Ins-1,3_2-ME339801----
m-Ins-1,3_3-ME339802----
m-Ins-1,3_4-ME339803----
NAD+-A1'_1-ME339727----
NAD+-A1'_2-ME339728----
NAD+-N1'_1-ME339730----
NAD+-N1' 13C-B_1-ME339729----
NAD+-N1'_2-ME339731----
NAD-N2_1-ME339732----
NAD-N6_1-ME339733----
NAD-N6_2-ME339734----
NADP-N2_1-ME339735----
NADP-N6_1-ME339736----
NADP-N6_2-ME339737----
Nicotin-2_1NAD+ME339738----
Nicotin-2_2NAD+ME339739----
Nicotin-5_1NAD+ME339740----
Nicotin-5_2NAD+ME339741----
Nicotin-5_3NAD+ME339742----
Nicotin-5_4NAD+ME339743----
Nicotin-6_1NAD+ME339744----
Nicotin-6_2NAD+ME339745----
Nicotin-6_3NAD+ME339746----
Nicotin-6_4NAD+ME339747----
P-Cho A_1-ME339748----
P-Cho A_2-ME339749----
Phe-2,6_1-ME339750----
Phe-2,6_2-ME339751----
Phe-3,5_1-ME339752----
Phe-3,5_2-ME339753----
Phe-3,5_3-ME339754----
Succinate-2,3_1-ME339755----
Succinate-2,3_2-ME339756----
Tau-1 (SCH2)_1-ME339757----
Tau-1 (SCH2)_2-ME339758----
Tau-1 (SCH2)_3-ME339759----
Tau-2 (NCH2)_1-ME339760----
Tau-2 (NCH2)_2-ME339761----
Tau-2 (NCH2)_3-ME339762----
Tris_1-ME339763----
Trp-4_1TryptophanME339764----
Trp-4_2TryptophanME339765----
Tyr-2,6_1-ME339766----
Tyr-2,6_2-ME339767----
Tyr-3,5_1-ME339768----
Tyr-3,5_2-ME339769----
UXP-5_1-ME339770----
UXP-5_2-ME339771----
UXP-6_1-ME339772----
UXP-6_2-ME339773----
Val-B_1-ME339774----
Val-B_2-ME339775----


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