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Analysis: ESI negative ion mode

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
2 or 3-phosphoglycerate_13C_1Phosphoglyceric acidME696603724C00597--
2 or 3-phosphoglycerate_13C_2Phosphoglyceric acidME696604724C00597--
2 or 3-phosphoglycerate_13C_3Phosphoglyceric acidME696605724C00597--
2 or 3-phosphoglycerate_2PG/3PGPhosphoglyceric acidME696602724C00597--
3-Glycerophosphate3-Phosphoglyceric acidME696668754---
3-Glycerophosphate_13C_13-Phosphoglyceric acidME696669754---
3-Glycerophosphate_13C_23-Phosphoglyceric acidME696670754---
3-Glycerophosphate_13C_33-Phosphoglyceric acidME696671754---
3-phosphoglyceraldehydeGlyceraldehyde 3-phosphateME696657439168C00118--
3-phosphoglyceraldehyde_13C_1Glyceraldehyde 3-phosphateME696658439168C00118--
3-phosphoglyceraldehyde_13C_2Glyceraldehyde 3-phosphateME696659439168C00118--
3-phosphoglyceraldehyde_13C_3Glyceraldehyde 3-phosphateME696660439168C00118--
6-Phosphogluconate6-Phosphogluconic acidME69660691493C00345--
6-Phosphogluconate_13C_16-Phosphogluconic acidME69660791493C00345--
6-Phosphogluconate_13C_26-Phosphogluconic acidME69660891493C00345--
6-Phosphogluconate_13C_36-Phosphogluconic acidME69660991493C00345--
6-Phosphogluconate_13C_46-Phosphogluconic acidME69661091493C00345--
6-Phosphogluconate_13C_56-Phosphogluconic acidME69661191493C00345--
6-Phosphogluconate_13C_66-Phosphogluconic acidME69661291493C00345--
Acetyl-CoAAcetyl-CoAME696613444493C00024--
Acetyl-CoA_13C_1Acetyl-CoAME696614444493C00024--
Acetyl-CoA_13C_2Acetyl-CoAME696615444493C00024--
Adenosine diphosphateADPME6966166022C00008--
Adenosine diphosphate_13C_1ADPME6966176022C00008--
Adenosine diphosphate_13C_2ADPME6966186022C00008--
Adenosine diphosphate_13C_3ADPME6966196022C00008--
Adenosine diphosphate_13C_4ADPME6966206022C00008--
Adenosine diphosphate_13C_5ADPME6966216022C00008--
Adenosine monophosphateAMPME6966226083C00020--
Adenosine monophosphate_13C_1AMPME6966236083C00020--
Adenosine monophosphate_13C_2AMPME6966246083C00020--
Adenosine monophosphate_13C_3AMPME6966256083C00020--
Adenosine monophosphate_13C_4AMPME6966266083C00020--
Adenosine monophosphate_13C_5AMPME6966276083C00020--
Adenosine triphosphateATPME6966335957C00002--
Adenosine triphosphate_13C_1ATPME6966345957C00002--
Adenosine triphosphate_13C_2ATPME6966355957C00002--
Adenosine triphosphate_13C_3ATPME6966365957C00002--
Adenosine triphosphate_13C_4ATPME6966375957C00002--
Adenosine triphosphate_13C_5ATPME6966385957C00002--
AspartateAspartic acidME6966285960C00049--
Aspartate_13C_1Aspartic acidME6966295960C00049--
Aspartate_13C_2Aspartic acidME6966305960C00049--
Aspartate_13C_3Aspartic acidME6966315960C00049--
Aspartate_13C_4Aspartic acidME6966325960C00049--
Citrate or IsocitrateCitric acid/Isocitric acidME696639311C00158--
Citrate or Isocitrate_13C_1Citric acid/Isocitric acidME696640311C00158--
Citrate or Isocitrate_13C_2Citric acid/Isocitric acidME696641311C00158--
Citrate or Isocitrate_13C_3Citric acid/Isocitric acidME696642311C00158--
Citrate or Isocitrate_13C_4Citric acid/Isocitric acidME696643311C00158--
Citrate or Isocitrate_13C_5Citric acid/Isocitric acidME696644311C00158--
Citrate or Isocitrate_13C_6Citric acid/Isocitric acidME696645311C00158--
Erythrose 4-phosphateErythrose 4-phosphateME696646122357C00279--
Erythrose 4-phosphate_13C_1Erythrose 4-phosphateME696647122357C00279--
Erythrose 4-phosphate_13C_2Erythrose 4-phosphateME696648122357C00279--
Erythrose 4-phosphate_13C_3Erythrose 4-phosphateME696649122357C00279--
Erythrose 4-phosphate_13C_4Erythrose 4-phosphateME696650122357C00279--
Fructose 1,6-bisphosphateFructose 1,6-bisphosphateME696596172313C00354--
Fructose 1,6-bisphosphate_13C_1Fructose 1,6-bisphosphateME696651172313C00354--
Fructose 1,6-bisphosphate_13C_2Fructose 1,6-bisphosphateME696652172313C00354--
Fructose 1,6-bisphosphate_13C_3Fructose 1,6-bisphosphateME696653172313C00354--
Fructose 1,6-bisphosphate_13C_4Fructose 1,6-bisphosphateME696654172313C00354--
Fructose 1,6-bisphosphate_13C_5Fructose 1,6-bisphosphateME696655172313C00354--
Fructose 1,6-bisphosphate_13C_6Fructose 1,6-bisphosphateME696656172313C00354--
Glucose 6-phosphate or fructose-6-phosphateGlucose 6-phosphateME6966615958C00092--
Glucose 6-phosphate or fructose-6-phosphate_13C_1Glucose 6-phosphateME6966625958C00092--
Glucose 6-phosphate or fructose-6-phosphate_13C_2Glucose 6-phosphateME6966635958C00092--
Glucose 6-phosphate or fructose-6-phosphate_13C_3Glucose 6-phosphateME6966645958C00092--
Glucose 6-phosphate or fructose-6-phosphate_13C_4Glucose 6-phosphateME6966655958C00092--
Glucose 6-phosphate or fructose-6-phosphate_13C_5Glucose 6-phosphateME6966665958C00092--
Glucose 6-phosphate or fructose-6-phosphate_13C_6Glucose 6-phosphateME6966675958C00092--
GlutamateGlutamic acidME696672611---
Glutamate_13C_1Glutamic acidME696673611---
Glutamate_13C_2Glutamic acidME696674611---
Glutamate_13C_3Glutamic acidME696675611---
Glutamate_13C_4Glutamic acidME696676611---
Glutamate_13C_5Glutamic acidME696677611---
LactateLactic acidME696678107689C00186--
Lactate_13C_1Lactic acidME696679107689C00186--
Lactate_13C_2Lactic acidME696680107689C00186--
Lactate_13C_3Lactic acidME696681107689C00186--
MalateMalic acidME696597222656C00149--
Malate_13C_1Malic acidME696682222656C00149--
Malate_13C_2Malic acidME696683222656C00149--
Malate_13C_3Malic acidME696684222656C00149--
Malate_13C_4Malic acidME696685222656C00149--
Malonyl-CoAMalonyl-CoAME696686644066C00083--
Malonyl-CoA_13C_1Malonyl-CoAME696687644066C00083--
Malonyl-CoA_13C_2Malonyl-CoAME696688644066C00083--
Malonyl-CoA_13C_3Malonyl-CoAME696689644066C00083--
Nicotinamide Adenine Dinucleotide oxidizedNAD+ME69659810897651C00003--
Nicotinamide Adenine Dinucleotide oxidized_13C_1NAD+ME69669010897651C00003--
Nicotinamide Adenine Dinucleotide oxidized_13C_2NAD+ME69669110897651C00003--
Nicotinamide Adenine Dinucleotide oxidized_13C_3NAD+ME69669210897651C00003--
Nicotinamide Adenine Dinucleotide oxidized_13C_4NAD+ME69669310897651C00003--
Nicotinamide Adenine Dinucleotide oxidized_13C_5NAD+ME69669410897651C00003--
Nicotinamide Adenine Dinucleotide reducedNADHME696599439153C00004--
Nicotinamide Adenine Dinucleotide reduced_13C_1NADHME696695439153C00004--
Nicotinamide Adenine Dinucleotide reduced_13C_2NADHME696696439153C00004--
Nicotinamide Adenine Dinucleotide reduced_13C_3NADHME696697439153C00004--
Nicotinamide Adenine Dinucleotide reduced_13C_4NADHME696698439153C00004--
Nicotinamide Adenine Dinucleotide reduced_13C_5NADHME696699439153C00004--
PhosphoenolpyruvatePhosphoenolpyruvic acidME6966001005C00074--
Phosphoenolpyruvate_13C_1Phosphoenolpyruvic acidME6967001005C00074--
Phosphoenolpyruvate_13C_2Phosphoenolpyruvic acidME6967011005C00074--
Phosphoenolpyruvate_13C_3Phosphoenolpyruvic acidME6967021005C00074--
Ribose-5-phosphate or xylulose 5-phosphateRibose 5-phosphateME69670377982C00117--
Ribose-5-phosphate or xylulose 5-phosphate_13C_1Ribose 5-phosphateME69670477982C00117--
Ribose-5-phosphate or xylulose 5-phosphate_13C_2Ribose 5-phosphateME69670577982C00117--
Ribose-5-phosphate or xylulose 5-phosphate_13C_3Ribose 5-phosphateME69670677982C00117--
Ribose-5-phosphate or xylulose 5-phosphate_13C_4Ribose 5-phosphateME69670777982C00117--
Ribose-5-phosphate or xylulose 5-phosphate_13C_5Ribose 5-phosphateME69670877982C00117--
Sedoheptulose 7-phosphateSedoheptulose 7-phosphateME696709165007C05382--
Sedoheptulose 7-phosphate_13C_1Sedoheptulose 7-phosphateME696710165007C05382--
Sedoheptulose 7-phosphate_13C_2Sedoheptulose 7-phosphateME696711165007C05382--
Sedoheptulose 7-phosphate_13C_3Sedoheptulose 7-phosphateME696712165007C05382--
Sedoheptulose 7-phosphate_13C_4Sedoheptulose 7-phosphateME696713165007C05382--
Sedoheptulose 7-phosphate_13C_5Sedoheptulose 7-phosphateME696714165007C05382--
Sedoheptulose 7-phosphate_13C_6Sedoheptulose 7-phosphateME696715165007C05382--
Sedoheptulose 7-phosphate_13C_7Sedoheptulose 7-phosphateME696716165007C05382--
SucroseSucroseME6966015988C00089--
Sucrose_13C_1SucroseME6967175988C00089--
Sucrose_13C_2SucroseME6967185988C00089--
Sucrose_13C_3SucroseME6967195988C00089--
Sucrose_13C_4SucroseME6967205988C00089--


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