metabolite_name	SA001	SA002	SA003	SA004	SA005	SA006	SA007	SA008	SA009	SA010	SA011	SA012	SA013	SA014	SA015	SA016	SA017	SA018	SA019	SA020	SA021	SA022	SA023	SA024	SA025	SA026	SA027	SA028	SA029	SA030	SA031	SA032	SA033	SA034	SA035	SA036	SA037	SA038	SA039	SA040	SA041	SA042	SA043	SA044	SA045	SA046	SA047	SA048	SA049	SA050	SA051	SA052	SA053	SA054	SA055	SA056	SA057	SA058
Lactate	8.34	5.55	6.94	12.7	18.39	6.8	9.31	15.53	7.18	13.72	19.03		36.26	26.77	34.12	16.88	6.85		75.07	208.57	49.62	18.34	23.32	46.71	18.01	24.23	20.93	23.46	39.3	5.03	15.24	27.03	38.32	50.64	94.27	17.63	23.24	12.99	19.81	14.75	74.53	19.83	70.81	31.38	25.52	26.15	121.54	24.56	98.27	13.82	90.02	12.67	21.76		9.82	18.84	42.26	23.45
Pyruvate	3.37	2.99	5.9	4.02	5.45	3.54	3.55	5.88	3.64	4.04	5.39	7.27	12.72	12.29	9.27	5.42	1.95		16.79	40.39	12.22	4.63	9.32	15.74	9.77	11.3	8.33	7.93	13.47	2.43	15.31	12.43	22	16.59	15.85	2.07	8.17	5.95	7.07	5.98	15.22	10.39	9.02	11.4	12.12	8.96	21.37	11.09	9.84	6.26	7.23	7.92	7.13		7.8	7.72	13.45	8.36
_3_HBA	7.29	7.57	10.46	13.06	14.52	10.29	7.4	11.98	10.64	8.79	11.28	19.21	29.27	17.98	14.17	16.01	8.06		14.77	41.92	32.64	34.82	16.04	23.27	9.65	15.27	14.5	11.2	27.15	6.24	17.36	23.21	30.52	22.62	37.13	24.59	8.22	5.4	12.19	17.97	34.82	18.32	28.25	17.06	55.65	32.6	21.24	14.5	31.59	13.35	63.78	17.24	5.52		8.78	12.83	16.88	11.49
Succinate	3.03	1.76	2.01	18.83	3.77	4.25	6.94	3.37	3.67	8.35	1.63	1.92	9.57	5.16	5.26	16.7	3.1		6.66	13.57	6.74	4.66	4.52	2.82	6.17	14.85	4.37	3.23	14.54	1.93	1.98	9.29	10.02	9.35	2.45	46.47	9.2	1.06	3.85	3.77	14.1	5.04	52.98	3.59	5.77	2.66	2.33	8.2	17.14	2.9	3.11	5.84	1.15		1.77	1.63	7.15	3.46
Fumarate	0.22	0.23	0.39	1.43	0.28	0.31	0.42	0.53	0.9	0.63	0.51	0.95	3.24	1.73	3.61	0.8	0.23		1.37	5.47	1.48	0.69	0.82	1.68	1	1.29	0.47	0.6	1.72	0.16	0.64	0.74	4.36	9.64	1.39	0.58	0.71	0.35	0.54	0.69	4.12	1.27	2.49	0.79	1.25	0.9	0.37	0.88	1.51	0.55	3.51	0.6	0.42		0.5	0.23	0.71	0.61
Malate	0.66	0.92	0.95	3.8	1.17	1.33	1	1.81	1.82	2.36	1.29	3.62	8.65	4.2	7.93	2.37	0.67		3.56	13.84	5.75	2.04	2.87	5.19	2.02	3.7	1.79	4.96	5.1	0.55	1.62	1.82	12.84	16.82	5	2.63	1.95	1	1.85	2.06	10.82	2.51	6.96	2.27	2.28	2.54	1.75	2.09	3.63	1.86	9.18	2.28	1.05		1.09	0.93	2.58	1.31
a-KG	6.95	10.98	16.41	2.64	11.48	4.02	14.65	22.83	28.06	23.77	13.73	21.28	151.68	62.79	65.54	40.57	8.17		32.01	114.31	43.2	24.38	38.62	40	38.7	56.86	38.88	26.64	78.41	7.77	24.82	17	238.29	92.35	28.31	22.63	47.59	10.89	24.42	30.07	95.58	28.28	14.31	41.47	39.94	23.23	18.69	28.23	17.7	27.96	17.38	34.9	8.97		24.44	16.55	52.95	15.86
Citrate	400.44	350.49	256.04	638.98	457.95	155.51	378.47	376.3	365.7	424.89	266.5	218.68	1436.03	428.25	563.71	403.11	154.9		385.18	923.81	1336	593.32	604.95	682.81	906.13	1178.6	491.02	219.82	818.72	38.38	193.24	248.15		507.45	106.7	902.9	237.78	50.29	409.43	559.9	581.1	722.02	598.15	247.27	839.62	251	98.01	369.78	255.13	165.94	220.23	262.93	169.76		116.26	206.75	505.31	151.12

metabolite_name	Retention Index	Moverz Quant	PubChem CID
Lactate	3.98	196.1, 91.062	107689
Pyruvate	6.68	299.1, 91.186	1060
_3_HBA	4.21	210.1, 91.153	441
Succinate	5.44	329.1, 206.233	1110
Fumarate	5.59	327.1, 91.192	444972
Malate	5.28	345.1, 91.18	525
a-KG	6.59	462.2, 91.2	164533
Citrate	5.95	508.25, 385	311