Metabolite_name	RefMet_name	LPS_JX06_ATP_1	LPS_JX06_ATP_2	LPS_JX06_ATP_3	LPS_1	LPS_2	LPS_3	LPS_ATP_1	LPS_ATP_2	LPS_ATP_3	Ctrl_C_1	Ctrl_C_2	Ctrl_C_3
Factors	-	Treatment:JPS+JX06+ATP	Treatment:JPS+JX06+ATP	Treatment:JPS+JX06+ATP	Treatment:LPS	Treatment:LPS	Treatment:LPS	Treatment:LPS+ATP	Treatment:LPS+ATP	Treatment:LPS+ATP	Treatment:No treatment	Treatment:No treatment	Treatment:No treatment
10[13C]adenosine											0.0001		
10[13C]glutathione													
10[13C]glutathione disulfide_pos													
10[13C]heptadecanoyl carnitine													
10[13C]NAD+					0.0089	0.0077	0.0104				0.0006	0.0013	0.0010
10[13C]S-adenosyl-L-methionine													
10[13C]S-methyl-5-thioadenosine							0.0002					0.0002	
11[13C]glutathione disulfide_pos													
11[13C]heptadecanoyl carnitine													
11[13C]NAD+													
11[13C]S-adenosyl-L-methionine													
11[13C]S-methyl-5-thioadenosine													
1[13C]adenine													
1[13C]adenosine													
1[13C]betaine													
1[13C]carnitine			0.0007				0.0002				0.0002		
1[13C]choline													
1[13C]glutamine		0.0023	0.0016	0.0019	0.0016	0.0022	0.0014	0.0026	0.0022	0.0030	0.0009	0.0019	0.0010
1[13C]glutathione		0.0053	0.0008	0.0026		0.0004	0.0003	0.0008		0	0.0009	0.0001	
1[13C]glutathione disulfide_pos		0.0319	0.0335	0.0303	0.0238	0.0262	0.0258	0.0249	0.0375	0.0259	0.0279	0.0204	0.0281
1[13C]glycine													
1[13C]heptadecanoyl carnitine					0.0151								
1[13C]methionine		0.0004											
1[13C]N6N6N6-Trimethyl-L-lysine													
1[13C]NAD+		0.0210	0.0168	0.0146	0.0173	0.0227	0.0071	0.0162	0.0210	0.0150	0.0162	0.0192	0.0232
1[13C]proline		0.0021	0.0023	0.0019	0.0011	0.0015	0.0017	0.0019	0.0020	0.0025	0.0023	0.0025	0.0034
1[13C]S-adenosyl-L-methionine													
1[13C]serine													
1[13C]S-methyl-5-thioadenosine													
12[13C]glutathione disulfide_pos													
12[13C]heptadecanoyl carnitine													
12[13C]NAD+		0											
12[13C]S-adenosyl-L-methionine													
13[13C]glutathione disulfide_pos													
13[13C]heptadecanoyl carnitine								0					
13[13C]NAD+		0.0004											
13[13C]S-adenosyl-L-methionine									0				
14[13C]glutathione disulfide_pos													
14[13C]heptadecanoyl carnitine								0.0089					
14[13C]NAD+													
14[13C]S-adenosyl-L-methionine									0.0020				
15[13C]glutathione disulfide_pos													
15[13C]heptadecanoyl carnitine													
15[13C]NAD+													
15[13C]S-adenosyl-L-methionine													
16[13C]glutathione disulfide_pos													
16[13C]heptadecanoyl carnitine						0							
16[13C]NAD+													
17[13C]glutathione disulfide_pos													
17[13C]heptadecanoyl carnitine						0.0861							
17[13C]NAD+													
18[13C]glutathione disulfide_pos													
18[13C]heptadecanoyl carnitine													
18[13C]NAD+													
19[13C]glutathione disulfide_pos													
19[13C]heptadecanoyl carnitine													
19[13C]NAD+													
20[13C]glutathione disulfide_pos													
20[13C]heptadecanoyl carnitine													
20[13C]NAD+													
21[13C]heptadecanoyl carnitine													
21[13C]NAD+													
2[13C]adenine													
2[13C]adenosine		0.0026	0.0023	0.0032	0.0029	0.0037	0.0029	0.0027	0.0028	0.0030	0.0029	0.0020	0.0021
2[13C]betaine													
2[13C]carnitine													
2[13C]choline													
2[13C]glutamine		0.0012	0.0013	0.0013	0.0017	0.0015	0.0018	0.0002	0.0005	0.0004	0.0057	0.0055	0.0052
2[13C]glutathione		0.0587	0.0554	0.0576	0.0402	0.0389	0.0421	0.0392	0.0344	0.0391	0.0337	0.0309	0.0333
2[13C]glutathione disulfide_pos		0.0983	0.0950	0.0930	0.0675	0.0667	0.0679	0.0653	0.0537	0.0682	0.0292	0.0312	0.0455
2[13C]glycine		0.0038		0.0009		0.0012						0.0011	
2[13C]heptadecanoyl carnitine													
2[13C]methionine													
2[13C]N6N6N6-Trimethyl-L-lysine									0.0097	0.0040			
2[13C]NAD+		0.0306	0.0319	0.0296	0.0240	0.0247	0.0306	0.0439	0.0447	0.0440	0.0297	0.0282	0.0263
2[13C]proline		0.0019	0.0029	0.0028	0.0055	0.0044	0.0050	0.0016	0.0023	0.0021	0.0109	0.0107	0.0077
2[13C]S-adenosyl-L-methionine													
2[13C]serine		0.0033	0.0013	0.0012	0.0008	0.0006	0.0017	0.0138	0.0106	0.0110	0.0027		0.0023
2[13C]S-methyl-5-thioadenosine			0.0006	0.0002	0.0018	0.0024	0.0020				0.0009	0.0014	0.0010
22[13C]heptadecanoyl carnitine													
23[13C]heptadecanoyl carnitine													
24[13C]heptadecanoyl carnitine													
3[13C]adenine		0.0001						0			0		
3[13C]adenosine					0.0012	0.0019	0.0016		0.0001		0.0008	0.0003	0.0003
3[13C]betaine													
3[13C]carnitine													
3[13C]choline													
3[13C]glutamine		0.0004	0.0004	0.0003	0.0004	0.0003	0.0005	0.0001	0.0001	0	0.0022	0.0018	0.0021
3[13C]glutathione		0.0117	0.0105	0.0110	0.0055	0.0052	0.0058	0.0055	0.0059	0.0064	0.0052	0.0047	0.0056
3[13C]glutathione disulfide_pos		0.0261	0.0225	0.0257	0.0125	0.0097	0.0095	0.0112	0.0132	0.0108	0.0181	0.0119	0.0129
3[13C]heptadecanoyl carnitine													
3[13C]methionine													
3[13C]N6N6N6-Trimethyl-L-lysine		0.0002	0.0002			0.0005	0.0010	0.0004			0.0004		0.0005
3[13C]NAD+		0.0062	0.0086	0.0086	0.0130	0.0112	0.0124	0.0086	0.0089	0.0110	0.0083	0.0080	0.0084
3[13C]proline		0.0004	0.0007	0.0008	0.0014	0.0011	0.0013	0.0004	0.0006	0.0005	0.0034	0.0039	0.0030
3[13C]S-adenosyl-L-methionine					0.0001								
3[13C]serine		0.0076	0.0076	0.0066	0.0130	0.0141	0.0125	0.0021	0.0018	0.0019	0.0112	0.0074	0.0137
3[13C]S-methyl-5-thioadenosine				0	0.0019	0.0011	0.0016						0
3-Hydroxybutyrylcarnitine	CAR 4:0;3OH	0.8020	0.7444	0.7471	0.6000	0.5599	0.5744	0.9728	0.9699	0.9470	0.6252	0.6419	0.6508
3-Hydroxybutyrylcarnitine-1	CAR 4:0;3OH			0.0033								0.0496	
3-Hydroxybutyrylcarnitine-10				0.0231									
3-Hydroxybutyrylcarnitine-11													
3-Hydroxybutyrylcarnitine-2	CAR 4:0;3OH	0.1368	0.1723	0.1468	0.1556	0.1770	0.1549	0.0199	0.0251	0.0335	0.1806	0.1228	0.1615
3-Hydroxybutyrylcarnitine-3						0.0059	0.0514				0.0119	0.0093	0.0076
3-Hydroxybutyrylcarnitine-4		0.0572	0.0833	0.0798	0.2444	0.2572	0.2126			0.0120	0.1823	0.1765	0.1801
3-Hydroxybutyrylcarnitine-5													
3-Hydroxybutyrylcarnitine-6													
3-Hydroxybutyrylcarnitine-7								0	0				
3-Hydroxybutyrylcarnitine-8		0.0040					0.0067	0.0073	0.0050	0.0075			
3-Hydroxybutyrylcarnitine-9				0									
4[13C]adenine													
4[13C]adenosine					0.0030	0.0037	0.0021		0		0.0022	0.0003	0.0014
4[13C]betaine													
4[13C]carnitine													
4[13C]choline										0			
4[13C]glutamine		0.0004	0.0002	0.0003	0.0005	0.0004	0.0005		0	0	0.0020	0.0017	0.0021
4[13C]glutathione		0.0109	0.0100	0.0103	0.0071	0.0068	0.0074	0.0039	0.0042	0.0054	0.0061	0.0056	0.0064
4[13C]glutathione disulfide_pos		0.0203	0.0224	0.0215	0.0130	0.0152	0.0174	0.0074	0.0058	0.0100	0.0138	0.0109	0.0138
4[13C]heptadecanoyl carnitine													
4[13C]methionine		0.0008	0.0007	0.0008	0.0006	0.0013	0.0020	0.0009	0.0007	0.0008	0.0010	0.0014	0.0030
4[13C]N6N6N6-Trimethyl-L-lysine													
4[13C]NAD+		0.0037	0.0032	0.0029	0.0208	0.0217	0.0233	0.0066	0.0061	0.0023	0.0197	0.0193	0.0185
4[13C]proline		0.0004	0.0006	0.0007	0.0018	0.0013	0.0017	0.0003	0.0004	0.0003	0.0042	0.0040	0.0033
4[13C]S-adenosyl-L-methionine													
4[13C]S-methyl-5-thioadenosine					0.0021	0.0019	0.0023				0.0004	0.0002	
5[13C]adenine		0.0003	0.0005	0.0006	0.0001	0.0001	0	0.0001	0.0004	0.0006	0.0001	0.0001	0
5[13C]adenosine		0.0019	0.0030	0.0027	0.0707	0.0744	0.0719	0.0023	0.0041	0.0038	0.0287	0.0318	0.0308
5[13C]betaine													
5[13C]carnitine													
5[13C]choline													0
5[13C]glutamine			0	0	0.0001	0.0001		0			0.0003	0.0003	0.0004
5[13C]glutathione		0.0029	0.0028	0.0032	0.0016	0.0017	0.0019		0.0008	0.0016	0.0013	0.0010	0.0015
5[13C]glutathione disulfide_pos		0.0068	0.0065	0.0068	0.0013	0.0016	0.0030	0.0002	0.0013	0.0021	0.0013	0.0009	0.0020
5[13C]heptadecanoyl carnitine													
5[13C]methionine													
5[13C]N6N6N6-Trimethyl-L-lysine													
5[13C]NAD+		0.0248	0.0261	0.0243	0.2687	0.2562	0.2690	0.0399	0.0374	0.0379	0.1720	0.1603	0.1718
5[13C]proline		0	0.0001	0	0.0005	0.0015	0.0009	0.0001			0.0012	0.0012	0.0019
5[13C]S-adenosyl-L-methionine		0.0009	0.0005	0.0005	0.0182	0.0193	0.0207		0.0048		0.0068	0.0033	0.0056
5[13C]S-methyl-5-thioadenosine					0.0315	0.0301	0.0327				0.0114	0.0122	0.0114
6[13C]adenosine													
6[13C]carnitine													
6[13C]glutathione													
6[13C]glutathione disulfide_pos		0.0004	0.0015	0.0017		0.0005							
6[13C]heptadecanoyl carnitine													
6[13C]N6N6N6-Trimethyl-L-lysine													
6[13C]NAD+					0.0037	0.0038	0.0054			0.0010	0.0021	0.0019	0.0023
6[13C]S-adenosyl-L-methionine										0			
6[13C]S-methyl-5-thioadenosine			0.0013	0.0002	0.0003	0.0004	0.0004		0.0006			0	
7[13C]adenosine			0										
7[13C]carnitine													
7[13C]glutathione													
7[13C]glutathione disulfide_pos													
7[13C]heptadecanoyl carnitine		0		0.0001		0.0007		0.0010	0.0008	0.0007	0.0004	0.0009	0.0001
7[13C]N6N6N6-Trimethyl-L-lysine													
7[13C]NAD+					0.0072	0.0055	0.0057		0.0002		0.0045	0.0025	0.0040
7[13C]S-adenosyl-L-methionine		0.0149	0.0082	0.0045	0.0019	0.0020	0.0004	0.0206	0.0181	0.0162	0.0048		0.0014
7[13C]S-methyl-5-thioadenosine												0.0001	
8[13C]adenosine													
8[13C]glutathione			0.0001	0		0		0.0002		0.0002	0		
8[13C]glutathione disulfide_pos													
8[13C]heptadecanoyl carnitine		0.0152		0.0251		0.2591	0.0004	0.3620	0.2814	0.2495	0.1478	0.3337	0.0348
8[13C]N6N6N6-Trimethyl-L-lysine													
8[13C]NAD+						0.0009							
8[13C]S-adenosyl-L-methionine								0.0012					
8[13C]S-methyl-5-thioadenosine													
9[13C]adenosine													
9[13C]glutathione													
9[13C]glutathione disulfide_pos													
9[13C]heptadecanoyl carnitine							0.1798						
9[13C]N6N6N6-Trimethyl-L-lysine													
9[13C]NAD+						0.0003	0.0013						
9[13C]S-adenosyl-L-methionine													
9[13C]S-methyl-5-thioadenosine													
adenine	Adenine	0.9997	0.9995	0.9994	0.9999	0.9999	1	0.9998	0.9996	0.9994	0.9998	0.9999	1
adenosine	Adenosine	0.9954	0.9947	0.9941	0.9222	0.9163	0.9214	0.9950	0.9931	0.9932	0.9654	0.9656	0.9654
Betaine	Betaine	1	1	1	1	1	1	1	1	1	1	1	1
carnitine	Carnitine	1	0.9993	1	1	1	0.9998	1	1	1	0.9998	1	1
choline	Choline	1	1	1	1	1	1	1	1	1	1	1	1
glutamine	Glutamine	0.9956	0.9965	0.9962	0.9957	0.9955	0.9959	0.9970	0.9972	0.9965	0.9888	0.9887	0.9892
glycine	Glycine	0.9962	1	0.9991	1	0.9988	1	1	1	1	1	0.9989	1
GSH	Glutathione	0.9105	0.9204	0.9152	0.9456	0.9470	0.9426	0.9504	0.9546	0.9473	0.9528	0.9577	0.9532
GSSG	Oxidized glutathione	0.8163	0.8185	0.8210	0.8819	0.8801	0.8763	0.8910	0.8886	0.8831	0.9098	0.9247	0.8977
heptadecanoyl carnitine	CAR 17:0	0.9847	1	0.9748	0.9849	0.6541	0.8198	0.6281	0.7178	0.7497	0.8518	0.6653	0.9651
methionine	Methionine	0.9987	0.9993	0.9992	0.9994	0.9987	0.9980	0.9991	0.9993	0.9992	0.9990	0.9986	0.9970
N6N6N6-Trimethyl-L-lysine	N-6-Trimethyllysine	0.9998	0.9998	1	1	0.9995	0.9990	0.9996	0.9903	0.9960	0.9996	1	0.9995
N-acetylneuraminic acid	N-Acetylneuraminic acid	0.9728	0.9761	0.9750	0.9676	0.9709	0.9687	0.9603	0.9632	0.9628	0.9627	0.9654	0.9654
N-acetylneuraminic acid-1		0.0012	0.0002										
N-acetylneuraminic acid-10		0.0003	0.0003	0.0004	0.0002		0.0004	0.0012			0.0006	0.0008	
N-acetylneuraminic acid-11					0.0006	0.0004					0.0002		
N-acetylneuraminic acid-2	N-Acetylneuraminic acid	0.0139	0.0127	0.0126	0.0123	0.0127	0.0116	0.0273	0.0284	0.0282	0.0120	0.0112	0.0128
N-acetylneuraminic acid-3		0.0112	0.0098	0.0107	0.0174	0.0152	0.0182	0.0060	0.0047	0.0060	0.0167	0.0165	0.0173
N-acetylneuraminic acid-4													
N-acetylneuraminic acid-5									0.0013		0.0004		0.0005
N-acetylneuraminic acid-6				0.0003	0.0008	0.0002		0.0041	0.0006	0.0009	0.0035	0.0028	0.0014
N-acetylneuraminic acid-7								0.0003	0.0009	0.0011	0.0002	0.0001	0.0004
N-acetylneuraminic acid-8		0.0002				0.0002		0.0008		0.0005	0.0024	0.0018	0.0009
N-acetylneuraminic acid-9		0.0004	0.0009	0.0010	0.0011	0.0004	0.0011		0.0009	0.0004	0.0014	0.0012	0.0014
NAD+	NAD	0.9134	0.9133	0.9199	0.6363	0.6454	0.6348	0.8849	0.8816	0.8889	0.7470	0.7593	0.7446
O-acetylcarnitine	CAR 2:0	0.5841	0.5623	0.5697	0.3100	0.3081	0.3085	0.7932	0.7942	0.7874	0.4780	0.4723	0.4769
O-acetylcarnitine-1		0.0136	0.0145	0.0146	0.0277	0.0270	0.0270	0.0061	0.0055	0.0065	0.0314	0.0314	0.0313
O-acetylcarnitine-2	CAR 2:0	0.4023	0.4231	0.4157	0.6623	0.6649	0.6645	0.2006	0.2003	0.2061	0.4906	0.4963	0.4918
O-acetylcarnitine-3													
O-acetylcarnitine-4													
O-acetylcarnitine-5			0				0	0.0001	0.0001	0			
O-acetylcarnitine-6													
O-acetylcarnitine-7									0				
O-acetylcarnitine-8													
O-acetylcarnitine-9													
proline	Proline	0.9952	0.9934	0.9939	0.9898	0.9900	0.9893	0.9957	0.9948	0.9945	0.9780	0.9777	0.9806
propionyl-carnitine	CAR 3:0	0.9979	0.9988	0.9988	0.9950	0.9955	0.9953	0.9980	0.9990	0.9978	0.9745	0.9738	0.9756
propionyl-carnitine-1		0.0010	0.0007	0.0003	0.0039	0.0018	0.0010	0.0004			0.0153	0.0146	0.0132
propionyl-carnitine-10													
propionyl-carnitine-2		0.0004				0.0016	0.0026		0	0.0010	0.0067	0.0078	0.0079
propionyl-carnitine-3		0	0.0002	0.0001	0.0011	0.0011	0.0011				0.0034	0.0035	0.0033
propionyl-carnitine-4													
propionyl-carnitine-5		0.0006	0.0003	0.0007		0.0001	0	0.0015	0.0009	0.0011	0.0002	0.0003	0.0001
propionyl-carnitine-6													
propionyl-carnitine-7				0.0001				0.0001					
propionyl-carnitine-8													
propionyl-carnitine-9													
S-adenosyl-L-methionine	S-Adenosylmethionine	0.9842	0.9913	0.9950	0.9798	0.9787	0.9789	0.9782	0.9751	0.9838	0.9885	0.9967	0.9930
serine	Serine	0.9892	0.9912	0.9922	0.9862	0.9852	0.9858	0.9841	0.9876	0.9871	0.9861	0.9926	0.9840
S-methyl-5-thioadenosine	5'-Methylthioadenosine	1	0.9982	0.9996	0.9625	0.9640	0.9607	1	0.9994	1	0.9874	0.9858	0.9875