metabolite_name	S00017646	S00017647	S00017648
D-2-hydroxyglutarate	10177.9815	3358.08205	2486.28377
L-2-hydroxyglutarate	182.37969	182.01126	454.50883
2-Phosphoglycerate/3-Phosphoglycerate	6.9806871	1.143851	4.5894202
6-phosphogluconic acid	37.638728	4.0799159	3.6714762
Acetyl-CoA	1.0653526	0.5927918	0.5995497
Adenosine diphosphate	33.130553	40.394093	41.9677
Adenosine monophosphate	153.44076	28.144997	44.537019
Adenosine triphosphate	11.329268	60.98457	67.54665
Citrate/iso-citrate	39.284676	7.8404032	3.760665
Fructose-6-Phosphate/glucose-6-phosphate	8.5134921	8.0508339	9.8884122
Flavin adenine dinucleotide	1.3357146	0.9016864	0.7557498
Fructose 1,6 Bisphosphate	40.714398	83.385701	182.38143
Malate	51.030168	16.612637	9.7442914
Nicotinamide adenine dinucleotide_1	0.6017222	0.076668	0.1132844
Nicotinamide adenine dinucleotide, reduced	\N	\N	\N
Nicotinamide adenine dinucleotide phosphate	0.9081965	0.80392	0.6518834
Nicotinamide adenine dinucleotide phosphate, reduced	\N	\N	\N
Phosphoenolpyruvate	0.8181748	0.5428246	1.0626774
D-ribulose-5-phosphate/D-xylulose-5-phosphate	41.767487	9.6581304	12.04663
Sedoheptulose-7P	128.23932	31.777984	31.560467
Succinate	50.19386	4.2907129	1.698174
Nicotinic acid	\N	\N	\N
Nicotinamide adenine dinucleotide_2	0.4297534	0.1688857	0.2019378
Nicotinamide	5.6608956	20.430295	9.5880366
Nicotinic acid mononucleotide	0.1541794	0.155716	0.1544609
Nicotinamide mononucleotide	0.1721849	0.1247026	0.1338116
Quinolinic acid	0.1506504	0.1303641	0.1301834

metabolite_name	retention index	quantified m/z	PubChem ID	KEGG ID
D-2-hydroxyglutarate	\N	\N	439391	\N
L-2-hydroxyglutarate	\N	\N	439939	\N
2-Phosphoglycerate/3-Phosphoglycerate	\N	\N	724	\N
6-phosphogluconic acid	\N	\N	91493	\N
Acetyl-CoA	\N	\N	444493	\N
Adenosine diphosphate	\N	\N	6022	\N
Adenosine monophosphate	\N	\N	6083	\N
Adenosine triphosphate	\N	\N	5957	\N
Citrate/iso-citrate	\N	\N	311	\N
Fructose-6-Phosphate/glucose-6-phosphate	\N	\N	5958	\N
Flavin adenine dinucleotide	\N	\N	46906035	\N
Fructose 1,6 Bisphosphate	\N	\N	21125049	\N
Malate	\N	\N	525	\N
Nicotinamide adenine dinucleotide_1	\N	\N	15938971	\N
Nicotinamide adenine dinucleotide, reduced	\N	\N	439153	\N
Nicotinamide adenine dinucleotide phosphate	\N	\N	15938972	\N
Nicotinamide adenine dinucleotide phosphate, reduced	\N	\N	22833512	\N
Phosphoenolpyruvate	\N	\N	1005	\N
D-ribulose-5-phosphate/D-xylulose-5-phosphate	\N	\N	77982	\N
Sedoheptulose-7P	\N	\N	165007	\N
Succinate	\N	\N	1110	\N
Nicotinic acid	\N	\N	938	\N
Nicotinamide adenine dinucleotide_2	\N	\N	439153	\N
Nicotinamide	\N	\N	936	\N
Nicotinic acid mononucleotide	\N	\N	941	\N
Nicotinamide mononucleotide	\N	\N	14180	\N
Quinolinic acid	\N	\N	1066	\N