metabolite_name	P1-50K_R14+	P2-50K_R6+	P3-50K_R7+	SK1-50K_R15+	SK2-50K_R10+	SK3-50K_R5+
L-alanine	1.67E+05	3.52E+05	1.70E+05	3.52E+05	3.78E+05	5.19E+05
L-arginine	1.02E+05	2.12E+05	1.95E+05	4.38E+05	1.53E+06	6.12E+05
L-asparagine	9.76E+03	6.88E+03	1.46E+04	7.10E+03	2.73E+04	8.59E+03
L-aspartate	8.88E+04	1.43E+05	9.42E+04	8.46E+04	1.09E+05	1.05E+05
L-cysteine	1.03E+04	2.16E+04	1.49E+04	2.66E+04	3.49E+04	3.98E+04
L-glutamate	9.38E+05	1.17E+06	8.68E+05	1.60E+06	1.06E+06	2.35E+06
glycine	2.09E+06	1.92E+06	2.15E+06	1.83E+06	2.06E+06	2.07E+06
L-histidine	1.10E+05	1.57E+05	1.08E+05	2.86E+05	3.16E+05	4.61E+05
L-leucine	2.06E+07	3.26E+07	1.94E+07	3.74E+07	4.69E+07	7.71E+07
L-isoleucine	1.24E+07	2.04E+07	1.23E+07	2.42E+07	1.34E+07	4.35E+07
L-lysine	1.56E+05	3.87E+05	2.00E+05	3.37E+05	6.55E+05	5.21E+05
L-methionine	3.56E+06	6.77E+06	3.98E+06	9.64E+06	1.19E+07	1.95E+07
L-phenylalanine	9.71E+06	1.99E+07	8.89E+06	1.98E+07	1.51E+07	2.99E+07
L-proline	7.63E+05	1.55E+06	8.87E+05	8.22E+05	8.00E+05	1.41E+06
L-serine	1.91E+04	1.04E+05	2.49E+04	2.66E+04	5.06E+04	5.86E+04
L-threonine	1.01E+05	2.03E+05	1.08E+05	1.98E+05	2.04E+05	2.99E+05
L-tryptophan	2.23E+06	5.60E+06	2.29E+06	4.33E+06	2.80E+06	5.61E+06
L-tyrosine	6.48E+06	1.08E+07	6.05E+06	1.13E+07	8.79E+06	2.11E+07
L-valine	5.73E+06	1.16E+07	6.67E+06	1.11E+07	7.03E+06	2.08E+07
Adenosine	1.91E+06	1.67E+06	1.48E+06	6.09E+06	3.09E+06	4.96E+06
Adenine	2.18E+05	2.54E+05	2.64E+05	1.33E+06	9.97E+05	1.15E+06
Guanosine	2.04E+06	2.90E+06	1.65E+06	1.21E+06	2.67E+06	2.05E+06
Guanine	8.16E+06	1.20E+07	7.08E+06	3.89E+06	4.82E+06	7.37E+06
Cytidine	2.51E+06	3.47E+06	1.65E+06	1.50E+06	2.58E+06	2.08E+06
Cytosine	1.01E+06	1.37E+06	6.73E+05	5.69E+05	1.00E+06	8.80E+05
Thymine	6.07E+04	9.17E+04	6.16E+04	5.89E+04	8.31E+04	8.83E+04
Uracil	1.38E+06	1.95E+06	1.23E+06	8.78E+05	2.32E+06	1.76E+06
Inosine	4.90E+06	6.40E+06	4.88E+06	4.31E+06	6.47E+06	5.64E+06
Hypoxanthine	4.51E+07	6.04E+07	4.04E+07	1.81E+07	2.76E+07	4.15E+07
Xanthosine	9.99E+03	6.64E+03	3.00E+03	8.93E+03	9.79E+03	9.21E+03
Xanthine	6.05E+04	1.15E+05	5.42E+04	8.31E+04	6.25E+04	1.50E+05
3',5'-Cyclic AMP	2.66E+04	6.10E+04	3.84E+04	1.83E+03	6.13E+03	0.00E+00
5-6-Dihydrothymine	4.62E+04	4.78E+04	4.85E+04	1.37E+05	5.97E+04	1.52E+05
Pyridoxal	2.59E+04	2.69E+04	3.01E+04	4.99E+04	6.05E+04	5.94E+04
Nicotinamide	1.06E+07	1.74E+07	1.28E+07	2.15E+07	2.75E+07	3.81E+07
Phosphate	4.42E+07	4.96E+07	4.79E+07	4.84E+07	4.86E+07	4.67E+07
Cys-Gly	2.20E+05	3.07E+05	2.02E+05	1.81E+05	1.00E+05	2.77E+05
gamma-L-Glutamyl-L-cysteine	1.23E+05	2.34E+05	1.37E+05	1.04E+05	1.06E+05	1.30E+05
gamma-L-Glutamyl-D-alanine	1.92E+04	2.38E+04	1.06E+04	3.74E+04	2.30E+04	5.16E+04
gamma-Glutamyl-gamma-aminobutyrate	2.22E+04	4.46E+04	3.92E+04	5.95E+04	8.76E+04	8.89E+04
gamma-L-Glutamylputrescine	0.00E+00	0.00E+00	0.00E+00	8.05E+03	5.78E+04	1.68E+04
L-Homocysteine	1.65E+03	4.37E+03	1.54E+03	1.54E+03	3.41E+03	9.37E+03
Cystathionine	0.00E+00	0.00E+00	1.34E+03	7.46E+03	5.93E+03	2.46E+04
Dimethylglycine	5.47E+04	5.85E+04	5.82E+04	5.86E+04	6.41E+04	1.13E+05
Betaine	7.33E+06	8.46E+06	6.67E+06	9.44E+06	6.67E+06	1.00E+07
S-Adenosyl-L-homocysteine	1.84E+05	2.83E+05	1.65E+05	1.72E+05	2.08E+05	3.46E+05
S-Adenosyl-L-methionine	1.22E+04	2.31E+04	2.51E+04	1.63E+04	1.78E+04	2.81E+04
Folate	1.22E+04	1.24E+04	1.10E+04	2.66E+04	3.24E+03	6.02E+04
Ornithine	6.27E+03	2.39E+05	1.82E+04	1.22E+04	9.58E+03	1.37E+04
5-Methylthioadenosine	1.85E+05	1.54E+05	1.36E+05	1.95E+05	9.41E+04	1.92E+05
Putrescine	1.76E+05	2.60E+05	1.94E+05	1.99E+05	9.28E+04	2.21E+05
Spermidine	2.83E+07	1.68E+07	1.08E+07	2.24E+07	4.39E+05	2.25E+07
Spermine	2.72E+06	1.20E+06	7.27E+05	2.48E+06	5.30E+04	2.10E+06
N1-Acetylspermidine	1.22E+05	1.98E+05	1.48E+05	7.15E+04	1.76E+05	7.00E+04
N-Acetylneuraminate	1.56E+04	3.67E+04	3.88E+04	3.23E+04	1.12E+05	4.71E+04
D-Glucosamine	5.48E+03	2.35E+04	1.02E+04	7.08E+03	1.00E+04	2.48E+04
Asymmetric dimethyl arginine	6.02E+03	1.24E+04	6.11E+03	1.33E+04	7.99E+04	4.88E+04
Creatine	6.76E+06	6.03E+06	4.86E+06	1.71E+07	5.16E+06	1.94E+07
Taurine	1.35E+05	1.81E+05	1.28E+05	2.56E+05	2.01E+05	2.64E+05
Hypotaurine	1.08E+04	1.10E+04	0.00E+00	3.91E+04	0.00E+00	4.99E+04
L-Methionine S-oxide	4.37E+04	5.55E+04	3.91E+04	6.87E+04	7.50E+04	9.86E+04
Kynurenine	7.34E+03	1.05E+04	5.62E+03	1.48E+04	6.36E+03	2.66E+04
Diethanolamine	1.37E+06	1.31E+06	1.30E+06	9.86E+05	1.99E+06	1.14E+06
Triethanolamine	1.07E+07	9.73E+06	8.99E+06	8.19E+06	5.58E+06	1.04E+07
N-Methylethanolamine phosphate	1.30E+04	1.04E+04	2.54E+04	2.35E+04	4.35E+04	2.52E+04
L-Carnitine	1.31E+06	1.54E+06	1.19E+06	2.10E+06	9.66E+05	2.55E+06
Acetylcarnitine	8.79E+05	1.06E+06	8.69E+05	1.86E+06	9.91E+05	2.76E+06
Butyrylcarnitine	5.80E+05	4.59E+05	4.74E+05	1.75E+06	5.74E+05	2.26E+06
Valerylcarnitine	2.98E+05	2.77E+05	2.00E+05	1.77E+05	1.68E+05	2.44E+05
Malonylcarnitine	1.18E+04	8.27E+03	8.31E+03	8.71E+03	9.13E+03	1.23E+04
Hexanoylcarnitine	5.74E+04	7.90E+04	7.66E+04	3.93E+04	6.59E+04	8.59E+04

metabolite_name	CmpdID	parent	medRt
L-alanine	C00041	90.0550	0.67
L-arginine	C00062	175.1190	0.74
L-asparagine	C00152	133.0608	0.89
L-aspartate	C00049	134.0448	0.66
L-cysteine	C00097	122.0270	0.69
L-glutamate	C00025	148.0604	0.67
glycine	C00037	76.0393	0.85
L-histidine	C00135	156.0768	0.86
L-leucine	C00123	132.1019	1.03
L-isoleucine	C00407	132.1019	0.97
L-lysine	C00047	147.1128	0.62
L-methionine	C00073	150.0584	0.88
L-phenylalanine	C00079	166.0863	1.39
L-proline	C00148	116.0706	0.70
L-serine	C00065	106.0499	0.66
L-threonine	C00188	120.0655	0.67
L-tryptophan	C00078	205.0972	1.72
L-tyrosine	C00082	182.0812	0.91
L-valine	C00183	118.0862	0.83
Adenosine	C00212	268.1035	0.91
Adenine	C00147	136.0619	0.83
Guanosine	C00387	284.0985	0.94
Guanine	C00242	152.0567	0.82
Cytidine	C00475	244.0925	0.81
Cytosine	C00380	112.0505	0.84
Thymine	C00178	127.0502	1.44
Uracil	C00106	113.0350	0.90
Inosine	C00294	269.0876	0.95
Hypoxanthine	C00262	137.0459	0.90
Xanthosine	C01762	285.0826	1.06
Xanthine	C00385	153.0407	0.89
3',5'-Cyclic AMP	C00575	330.0601	0.91
5-6-Dihydrothymine	C00906	129.0658	0.73
Pyridoxal	C00250	168.0657	0.90
Nicotinamide	C00153	123.0552	0.89
Phosphate	C00009	98.9841	0.69
Cys-Gly	C01419	179.0484	0.89
gamma-L-Glutamyl-L-cysteine	C00669	251.0695	0.90
gamma-L-Glutamyl-D-alanine	C03738	219.0975	0.86
gamma-Glutamyl-gamma-aminobutyrate	C15767	233.1132	0.87
gamma-L-Glutamylputrescine	C15699	218.1499	0.71
L-Homocysteine	C00155	136.0429	0.75
Cystathionine	C00542	223.0744	1.00
Dimethylglycine	C01026	104.0706	0.77
Betaine	C00719	118.0861	0.68
S-Adenosyl-L-homocysteine	C00021	385.1282	0.89
S-Adenosyl-L-methionine	C00019	399.1441	0.66
Folate	C00504	442.1470	1.71
Ornithine	C01602	133.0972	0.60
5-Methylthioadenosine	C00170	298.0970	1.70
Putrescine	C00134	89.1073	0.61
Spermidine	C00315	146.1652	0.59
Spermine	C00750	203.2229	0.60
N1-Acetylspermidine	C00612	188.1756	0.65
N-Acetylneuraminate	C00270	310.1127	0.71
D-Glucosamine	C00329	180.0874	0.79
Asymmetric dimethyl arginine	C03626	203.1503	0.76
Creatine	C00300	132.0768	0.69
Taurine	C00245	126.0219	0.68
Hypotaurine	C00519	110.0269	0.67
L-Methionine S-oxide	C02989	166.0533	0.87
Kynurenine	C00328	209.0918	1.36
Diethanolamine	C06772	106.0862	0.67
Triethanolamine	C06771	150.1125	0.70
N-Methylethanolamine phosphate	C01210	156.0421	0.64
L-Carnitine	C00318	162.1124	0.68
Acetylcarnitine	HMDB0000201	204.1230	0.91
Butyrylcarnitine	HMDB0002013	232.1542	1.73
Valerylcarnitine	HMDB0013128	246.1697	1.81
Malonylcarnitine	HMDB0062592	248.1125	1.11
Hexanoylcarnitine	HMDB0000705	260.1853	1.85