Data for (Study ST003927)

(Analysis AN006450)

Values for each metabolite have been scaled by dividing by the mean across all factors

Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

Metabolite	F1	F2	F3	F4
10-heptadecenoate (17:1n7)	0.7833	1.3077	1.0217	0.7876
10-nonadecenoate (19:1n9)	0.8351	1.3591	0.9938	0.7118
1-(1-enyl-oleoyl)-GPE (P-18:1)*	1.5857	1.2004	0.5161	0.6982
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20:4)*	0.7760	1.3332	0.4440	1.1763
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20:4)*	0.7445	1.1127	0.9300	1.1037
1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2)*	0.6135	1.4264	0.4340	1.1930
1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)*	0.7170	1.0715	0.8325	1.2401
1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1)*	0.8688	1.5058	0.4616	0.9002
1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1)*	0.8341	1.1093	0.7882	1.1449
1-(1-enyl-palmitoyl)-2-palmitoleoyl-GPC (P-16:0/16:1)*	0.9176	1.2146	0.6111	1.0914
1-(1-enyl-palmitoyl)-2-palmitoyl-GPC (P-16:0/16:0)*	0.7269	1.1258	0.6592	1.2947
1-(1-enyl-palmitoyl)-GPC (P-16:0)*	0.7866	1.2317	0.4184	1.2199
1-(1-enyl-palmitoyl)-GPE (P-16:0)*	1.3487	1.0075	0.6674	0.9800
1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:4)*	0.6180	1.1783	0.7743	1.2303
1-(1-enyl-stearoyl)-2-oleoyl-GPE (P-18:0/18:1)	0.9352	1.0451	0.7425	1.1787
1-(1-enyl-stearoyl)-GPE (P-18:0)*	1.2845	1.0811	0.5997	0.9900
12,13-DiHOME	0.8120	0.8654	1.0684	1.2393
1,2,3-benzenetriol sulfate (2)	1.2383	1.3216	0.4351	0.9367
12-dehydrocholate	1.0000	NA	NA	NA
1,2-dilinoleoyl-GPC (18:2/18:2)	0.7755	1.1456	1.0127	0.9849
1,2-dilinoleoyl-GPE (18:2/18:2)*	0.8044	1.0206	1.2444	0.9416
1,2-dioleoyl-GPC (18:1/18:1)	0.8675	1.4780	0.6559	0.7941
1,2-dioleoyl-GPE (18:1/18:1)	1.0926	1.2721	0.7400	0.8085
1,2-dioleoyl-GPS (18:1/18:1)	1.0610	1.1521	0.7694	0.9473
1,2-dipalmitoyl-GPC (16:0/16:0)	1.1858	0.8164	1.2509	0.8979
1,2-dipalmitoyl-GPE (16:0/16:0)*	1.1562	1.1741	0.8217	0.6305
12-HETE	0.5283	1.1523	0.7408	1.2653
12-HHTrE	NA	NA	NA	1.0000
13-HODE + 9-HODE	0.8801	1.1906	0.9994	0.8682
14-HDoHE/17-HDoHE	0.4761	0.7668	1.2511	1.1442
(14 or 15)-methylpalmitate (a17:0 or i17:0)	0.7831	0.9955	1.2234	1.0005
1,5-anhydroglucitol (1,5-AG)	1.1320	1.2368	0.7093	0.8428
15-HETE	1.2016	1.1752	0.5647	0.8962
(16 or 17)-methylstearate (a19:0 or i19:0)	0.7417	1.0433	1.0809	1.0772
1-arachidonoyl-GPC* (20:4)*	1.0690	1.0371	1.1903	0.7724
1-arachidonoyl-GPE (20:4n6)*	0.8779	0.9196	1.2494	1.0010
1-arachidonoyl-GPI* (20:4)*	0.8123	1.3956	0.8076	0.8194
1-arachidonylglycerol (20:4)	0.5063	1.1351	0.6478	1.4498
1-carboxyethylhistidine	NA	1.0000	NA	NA
1-carboxyethylisoleucine	0.2087	2.1928	0.1548	0.8057
1-carboxyethylleucine	0.2570	1.9815	0.2174	0.9680
1-carboxyethylphenylalanine	0.2960	2.0841	0.2299	0.8140
1-carboxyethyltyrosine	0.2723	2.8319	0.2262	0.5023
1-carboxyethylvaline	0.3000	1.8766	0.2834	1.0100
1-dihomo-linolenylglycerol (20:3)	0.5582	1.1718	0.7375	1.3068
1-dihomo-linoleoylglycerol (20:2)	0.3455	0.8680	0.9571	1.3866
1-docosahexaenoylglycerol (22:6)	0.5332	1.0809	0.8236	1.3670
1-eicosapentaenoylglycerol (20:5)*	NA	0.5744	0.6072	1.4092
1-heptadecenoylglycerol (17:1)*	NA	1.0964	1.0038	0.9011
1-lignoceroyl-GPC (24:0)	1.3134	1.0634	0.7021	0.9613
1-linolenoylglycerol (18:3)	0.9032	0.5643	1.6162	1.1269
1-linolenoyl-GPC (18:3)*	1.1602	0.6743	1.5546	0.8152
1-linoleoyl-2-arachidonoyl-GPC (18:2/20:4n6)*	0.8653	1.0129	0.9647	1.1067
1-linoleoyl-2-linolenoyl-GPC (18:2/18:3)*	1.1176	0.7688	1.3874	0.9035
1-linoleoylglycerol (18:2)	0.9726	0.9087	1.1897	0.9885
1-linoleoyl-GPC (18:2)	1.2007	0.9774	0.9715	0.9029
1-linoleoyl-GPE (18:2)*	1.4352	0.8754	0.7951	0.9780
1-linoleoyl-GPG (18:2)*	0.8856	1.0492	0.6235	1.2426
1-linoleoyl-GPI* (18:2)*	0.7446	1.5174	0.6199	0.7971
1-linoleoyl-GPS (18:2)*	1.0274	NA	NA	0.9452
1-methyl-4-imidazoleacetate	0.4123	1.5265	0.2229	1.3732
1-methyl-5-imidazoleacetate	1.1416	1.2194	0.3896	1.1472
1-methyladenosine	0.5456	1.1209	0.4661	1.5677
1-methylguanidine	0.8897	1.0580	0.8748	1.1019
1-methylhistamine	0.6135	1.8654	0.3580	0.7456
1-methylhistidine	0.6588	1.2000	0.6250	1.2830
1-methylnicotinamide	0.6374	1.0735	0.6353	1.1445
1-myristoyl-2-arachidonoyl-GPC (14:0/20:4)*	1.0465	0.6913	1.3913	1.0402
1-myristoyl-2-palmitoyl-GPC (14:0/16:0)	1.3395	0.7362	1.3407	0.8155
1-myristoylglycerol (14:0)	0.9419	0.9016	1.2006	1.0107
1-oleoyl-2-arachidonoyl-GPE (18:1/20:4)*	1.0026	0.9126	1.2570	0.9144
1-oleoyl-2-arachidonoyl-GPI (18:1/20:4)*	0.9226	1.2962	0.9372	0.7616
1-oleoyl-2-docosahexaenoyl-GPC (18:1/22:6)*	0.8390	1.5082	0.5270	0.8721
1-oleoyl-2-docosahexaenoyl-GPE (18:1/22:6)*	0.9314	1.2536	0.8246	0.8844
1-oleoyl-2-linoleoyl-GPC (18:1/18:2)*	0.8554	1.4013	0.7410	0.8297
1-oleoyl-2-linoleoyl-GPE (18:1/18:2)*	0.9938	1.1557	1.0660	0.7793
1-oleoylglycerol (18:1)	0.9660	1.0251	1.0154	0.9847
1-oleoyl-GPC (18:1)	1.2745	1.3265	0.6476	0.6825
1-oleoyl-GPE (18:1)	1.5776	1.1222	0.5697	0.7551
1-oleoyl-GPG (18:1)*	1.1120	1.2957	0.6629	0.7933
1-oleoyl-GPI (18:1)	0.4060	1.7564	0.5388	0.5009
1-oleoyl-GPS (18:1)	1.3189	0.4882	NA	0.7478
1-palmitoleoyl-2-linolenoyl-GPC (16:1/18:3)*	1.1579	0.8048	1.4350	0.7996
1-palmitoleoylglycerol (16:1)*	0.9149	0.8418	1.3714	0.9763
1-palmitoleoyl-GPC* (16:1)*	1.2360	1.1101	0.8764	0.7762
1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6)	0.9050	0.8766	1.1755	1.0835
1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4)*	0.7994	0.7951	1.3193	1.1494
1-palmitoyl-2-arachidonoyl-GPI (16:0/20:4)*	1.0026	0.7685	1.6393	0.8061
1-palmitoyl-2-dihomo-linolenoyl-GPC (16:0/20:3n3 or 6)*	1.0217	0.9088	1.2569	0.9052
1-palmitoyl-2-docosahexaenoyl-GPC (16:0/22:6)	1.0374	1.0037	1.0005	0.9687
1-palmitoyl-2-docosahexaenoyl-GPE (16:0/22:6)*	1.1779	0.9706	1.0813	0.8485
1-palmitoyl-2-gamma-linolenoyl-GPC (16:0/18:3n6)*	1.0101	0.7201	1.5373	0.9289
1-palmitoyl-2-linoleoyl-GPC (16:0/18:2)	0.9007	0.9937	1.1503	0.9707
1-palmitoyl-2-linoleoyl-GPE (16:0/18:2)	1.0426	0.9897	1.1945	0.8424
1-palmitoyl-2-linoleoyl-GPG (16:0/18:2)	1.3390	0.7025	1.5295	0.7196
1-palmitoyl-2-linoleoyl-GPI (16:0/18:2)	1.1765	0.8194	1.3442	0.8345
1-palmitoyl-2-oleoyl-GPC (16:0/18:1)	1.0680	1.0876	0.9615	0.8788
1-palmitoyl-2-oleoyl-GPE (16:0/18:1)	1.2264	1.1001	0.9100	0.7881
1-palmitoyl-2-oleoyl-GPG (16:0/18:1)	1.2346	0.8084	1.3317	0.8144
1-palmitoyl-2-oleoyl-GPI (16:0/18:1)*	0.8456	1.1297	0.8838	1.0450
1-palmitoyl-2-oleoyl-GPS (16:0/18:1)	0.8842	1.5021	0.7645	0.6233
1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1)*	1.2659	0.9298	1.1599	0.7761
1-palmitoyl-2-stearoyl-GPC (16:0/18:0)	1.1572	1.0038	0.9361	0.9290
1-palmitoyl-2-stearoyl-GPE (16:0/18:0)*	0.8602	1.3430	0.5501	0.8394
1-palmitoylglycerol (16:0)	0.7900	0.8786	1.4177	0.9903
1-palmitoyl-GPC (16:0)	1.2576	0.8841	1.0017	0.9472
1-palmitoyl-GPE (16:0)	1.7860	0.7495	0.8613	0.8239
1-palmitoyl-GPG (16:0)*	1.8506	0.6736	1.0939	0.6984
1-palmitoyl-GPI* (16:0)	0.8988	1.0043	1.2375	0.8977
1-palmitoyl-GPS (16:0)*	1.8892	0.2197	NA	0.3375
1-pentadecanoylglycerol (15:0)	0.9854	0.9962	1.0411	0.9855
1-ribosyl-imidazoleacetate*	0.3321	1.1039	NA	1.3067
1-stearoyl-2-arachidonoyl-GPC (18:0/20:4)	0.8942	0.9671	1.0239	1.0960
1-stearoyl-2-arachidonoyl-GPE (18:0/20:4)	0.6069	0.8516	1.0884	1.3872
1-stearoyl-2-arachidonoyl-GPI (18:0/20:4)	0.8666	1.1604	0.8280	1.0349
1-stearoyl-2-arachidonoyl-GPS (18:0/20:4)	0.6908	1.2143	0.7865	1.1284
1-stearoyl-2-docosahexaenoyl-GPC (18:0/22:6)	0.9384	1.0451	0.9187	1.0505
1-stearoyl-2-docosahexaenoyl-GPE (18:0/22:6)*	0.7987	1.0201	0.9468	1.1588
1-stearoyl-2-linoleoyl-GPC (18:0/18:2)*	0.8719	1.0770	1.0030	1.0013
1-stearoyl-2-linoleoyl-GPE (18:0/18:2)*	0.7708	1.0579	1.0219	1.0819
1-stearoyl-2-linoleoyl-GPS (18:0/18:2)	0.6931	1.2143	0.9324	1.0225
1-stearoyl-2-oleoyl-GPC (18:0/18:1)	1.0206	1.1390	0.8890	0.9057
1-stearoyl-2-oleoyl-GPE (18:0/18:1)	1.0312	1.1404	0.8066	0.9553
1-stearoyl-2-oleoyl-GPG (18:0/18:1)	0.8364	1.3497	0.6136	0.9932
1-stearoyl-2-oleoyl-GPS (18:0/18:1)	0.9187	1.2003	0.8598	0.9292
1-stearoyl-GPC (18:0)	0.9890	1.0862	0.8053	1.0483
1-stearoyl-GPE (18:0)	1.3388	0.8813	0.7151	1.0972
1-stearoyl-GPG (18:0)	1.9263	0.8989	0.3587	0.8873
1-stearoyl-GPI (18:0)	0.6020	1.3962	0.5999	1.1173
1-stearoyl-GPS (18:0)*	2.4865	0.4043	0.2639	1.1448
2,3-dihydroxy-5-methylthio-4-pentenoate (DMTPA)*	0.5623	1.2031	0.4150	1.4840
2,3-dihydroxyisovalerate	0.7796	1.0741	0.5909	1.3650
2,4-dihydroxybutyrate	0.8599	1.0966	0.8253	1.1145
2,4-di-tert-butylphenol	1.0760	1.0140	1.2272	0.7674
2,6-dihydroxybenzoic acid	1.0705	1.2788	0.5429	0.9575
2,8-quinolinediol sulfate	0.8324	1.1715	0.6109	0.9718
2-aminoadipate	0.9403	1.0520	0.9825	1.0106
2-aminoheptanoate	0.8713	1.0372	0.7417	1.1377
2-aminooctanoate	0.8814	1.1243	0.9746	0.9927
2-aminophenol sulfate	1.3503	1.1096	0.5416	0.9520
2^-AMP	0.7501	NA	NA	1.2499
2-arachidonoylglycerol (20:4)	0.5013	1.0084	0.8486	1.4547
2-butenoylglycine	1.1952	1.1135	0.7815	0.8753
2^-deoxyadenosine	0.4655	1.5893	0.1924	0.6776
2^-deoxyadenosine 5^-monophosphate	0.3656	0.9706	NA	1.1563
2^-deoxycytidine	0.6423	1.2142	0.8833	1.0941
2^-deoxyguanosine	0.6714	1.1695	0.8671	1.1360
2^-deoxyinosine	0.8294	1.1284	0.7409	1.1358
2^-deoxyuridine	0.6922	0.9644	1.0443	1.2289
2-docosahexaenoylglycerol (22:6)*	0.5223	0.9854	0.9793	1.3727
2-hydroxy-3-methylvalerate	0.3153	1.2515	0.3169	1.6896
2-hydroxy-4-(methylthio)butanoic acid	0.8430	1.0686	1.1290	0.9513
2-hydroxyadipate	0.9496	1.2121	0.8231	0.9199
2-hydroxyarachidate*	0.8249	1.2402	0.8785	0.9602
2-hydroxybehenate	0.7796	1.4767	0.7858	0.7656
2-hydroxybutyrate/2-hydroxyisobutyrate	0.2437	1.7742	0.2510	1.1905
2-hydroxydecanoate	1.1657	0.9895	0.9154	0.9540
2-hydroxyglutarate	1.2143	0.9227	1.0475	0.9013
2-hydroxyheptanoate*	1.0887	1.0632	1.1010	0.7922
2-hydroxyhippurate (salicylurate)	1.9217	1.1746	0.4484	0.6124
2-hydroxyoctanoate	1.0779	0.9788	1.0260	0.9499
2-hydroxysebacate	0.6791	1.1616	0.8052	1.0366
2-isopropylmalate	NA	1.2251	NA	0.3247
2-linoleoylglycerol (18:2)	0.9898	0.7750	1.3766	0.9954
2-methylbutyrylcarnitine (C5)	0.4555	1.2973	0.5026	1.4045
2-methylbutyrylglycine (C5)	1.1866	1.2379	0.5327	0.8700
2-methylcitrate	0.4712	1.2919	0.5499	1.3656
2-myristoylglycerol (14:0)	0.9086	0.8435	1.4553	0.9190
2-oleoylglycerol (18:1)	1.0312	0.9328	1.0899	0.9902
2-O-methylascorbic acid	1.0166	1.3538	0.6358	0.8440
2^-O-methylcytidine	0.6953	1.1688	0.8532	1.1983
2^-O-methyluridine	1.0710	1.0019	0.9262	0.9996
2-oxindole-3-acetate	1.1486	0.4728	1.0909	1.1332
2-oxoarginine*	0.7776	1.1905	0.8197	1.0699
2-palmitoleoylglycerol (16:1)*	0.8666	0.8022	1.5349	0.9110
2-palmitoleoyl-GPC* (16:1)*	1.4155	0.9962	1.0299	0.6862
2-palmitoylglycerol (16:0)	0.8482	0.8227	1.3202	1.0823
2-palmitoyl-GPC* (16:0)*	1.2196	0.9240	1.2318	0.7643
2R,3R-dihydroxybutyrate	0.7892	1.1686	0.8083	1.0949
2S,3R-dihydroxybutyrate	0.6373	1.5161	0.5715	0.9752
2-stearoyl-GPE (18:0)*	1.1631	0.7724	0.9735	1.1625
3-(3-hydroxyphenyl)propionate sulfate	1.4530	1.0132	0.6183	0.9988
3,4-dihydroxybutyrate	0.6957	1.3065	0.6373	1.1261
3-(4-hydroxyphenyl)lactate (HPLA)	0.8040	1.1291	0.8892	1.0716
3-acetylphenol sulfate	1.8919	0.9933	0.5146	0.6559
3-amino-2-piperidone	0.7687	1.3817	0.6410	0.9854
3-aminoisobutyrate	1.2382	1.0089	0.5818	1.1238
3^-AMP	1.1742	1.2247	0.6883	0.5322
3^-dephospho-CoA-glutathione*	0.7691	1.6620	0.8932	0.7592
3^-dephosphocoenzyme A	0.6554	0.8377	1.0360	1.2565
3-formylindole	0.9948	1.2025	0.9301	0.8223
3-hydroxy-2-methylpyridine sulfate	1.3103	1.2869	0.5441	0.6864
3-hydroxy-3-methylglutarate	0.8179	1.3490	0.7160	0.9340
3-hydroxyadipate	0.6641	1.8006	0.5179	0.6668
3-hydroxybutyrate (BHBA)	0.4497	1.7165	0.6460	0.8271
3-hydroxydecanoate	0.8277	0.9697	1.0689	1.1085
3-hydroxydecanoylcarnitine	1.0662	0.7659	1.0847	1.1597
3-hydroxyhexanoate	0.8273	1.1389	0.9446	1.0049
3-hydroxyhexanoylcarnitine (1)	0.5867	2.0287	1.0112	0.7642
3-hydroxyisobutyrate	0.5094	1.2747	0.7547	1.2117
3-hydroxylaurate	0.7935	1.0401	1.0665	1.0542
3-hydroxymyristate	0.7856	0.9430	1.1820	1.0882
3-hydroxyoctanoate	1.0313	0.9851	1.0351	0.9697
3-hydroxyoctanoylcarnitine (1)	1.1713	0.7472	1.3535	0.9141
3-hydroxyoctanoylcarnitine (2)	0.7985	0.9545	1.2780	0.9968
3-hydroxyoleate*	0.7036	1.1415	1.0950	0.9821
3-hydroxyoleoylcarnitine	0.9216	0.9648	1.1608	0.9814
3-hydroxypalmitoylcarnitine	0.9057	0.6956	1.6497	0.9511
3-hydroxypyridine sulfate	1.0324	1.3507	0.6203	0.8472
3-indoleglyoxylic acid	0.9337	1.3315	0.8947	0.7277
3-indoxyl sulfate	1.3700	1.1336	0.6220	0.8531
3-methyl-2-oxobutyrate	1.1471	0.7955	1.0580	1.0873
3-methyl-2-oxovalerate	0.9451	0.9158	1.0237	1.1065
3-methylcytidine	NA	0.7946	NA	1.2739
3-methylglutaconate	0.7332	1.5924	0.4225	0.9365
3-methylhistidine	1.0978	1.2884	0.5007	0.9149
3-phenylpropionate (hydrocinnamate)	1.0962	0.6728	1.4870	0.7188
3-phosphoglycerate	2.1613	0.3602	1.6778	0.4176
3-ureidopropionate	0.7403	1.2569	1.0583	0.8502
4-acetamidobutanoate	1.3509	1.3041	0.6147	0.9057
4-acetylphenyl sulfate	1.2173	1.2054	0.8417	0.6241
4-cholesten-3-one	1.0605	1.2377	0.9724	0.6557
4-guanidinobutanoate	1.0753	1.1572	0.9251	0.8200
4-hydroxybutyrate (GHB)	1.3213	0.9247	1.0721	0.7600
4-hydroxycinnamate sulfate	0.8563	1.3649	0.5204	0.8915
4-hydroxyglutamate	0.7624	NA	1.3325	0.6439
4-hydroxyhippurate	1.2674	1.0434	0.4508	1.1733
4-hydroxy-nonenal-glutathione	1.4744	0.7612	1.1971	0.7933
4-hydroxyphenylacetate	1.2061	0.9796	1.2224	0.8566
4-hydroxyphenylpyruvate	0.9140	0.9149	1.2143	1.0056
4-imidazoleacetate	0.9505	1.0631	0.8394	1.0350
4-methyl-2-oxopentanoate	0.9208	0.9951	0.8325	1.1811
4-methylcatechol sulfate	1.2811	1.4160	0.4674	0.7042
4-vinylphenol sulfate	0.3086	1.3839	0.1750	1.3838
5,6-dihydrothymine	0.7810	1.1477	1.4279	0.8930
5,6-dihydrouridine	0.4840	0.8924	0.8390	1.5912
5-aminovalerate	0.9141	0.8200	1.7681	0.6058
5-dodecenoate (12:1n7)	1.0972	0.9110	0.9504	1.0677
5-dodecenoylcarnitine (C12:1)	1.0414	0.7842	1.0810	1.1592
5-(galactosylhydroxy)-L-lysine	0.7646	0.8747	1.1854	1.1789
5^- GMP	0.8212	1.1009	0.9735	1.0313
5-HETE	NA	1.0000	NA	NA
5-hydroxylysine	0.8067	0.8559	1.4942	0.8720
5-methyl-2^-deoxycytidine	0.7778	1.2495	0.7343	1.0414
5-methylcytidine	NA	1.4287	0.4601	0.9175
5-methylthioadenosine (MTA)	0.9422	1.0271	0.8607	1.1098
5-methyluridine (ribothymidine)	1.3199	1.0654	0.4959	0.9681
5-oxoproline	0.6864	1.3062	0.8233	1.0003
6-beta-hydroxylithocholate	1.0423	NA	0.9153	NA
6-keto prostaglandin F1alpha	0.4066	1.1602	0.4790	1.2981
6-phosphogluconate	1.1347	0.6887	1.3904	0.9807
7-ketodeoxycholate	1.5699	0.3584	1.0654	0.1187
7-methylguanine	0.7560	1.0823	0.4735	1.4563
8-hydroxyoctanoate	0.6396	1.2560	0.9241	0.9933
acetylcarnitine (C2)	1.0692	0.8765	1.1115	1.0121
acetyl-CoA	1.1316	1.1568	1.0491	0.8225
acetylphosphate	1.6920	0.5984	1.2060	0.7202
adenine	0.2613	1.9971	0.2205	0.9449
adenosine	0.6717	2.1048	0.4615	0.3564
adenosine 3^,5^-cyclic monophosphate (cAMP)	1.0080	1.0032	0.9957	0.9937
adenosine 3^,5^-diphosphate	1.3698	0.8691	1.2406	0.7136
adenosine 5^-diphosphoribose (ADP-ribose)	1.0312	0.8670	1.0795	1.0730
adenylosuccinate	0.8974	0.7438	1.2277	1.2034
ADP	0.9047	1.1000	0.8492	1.0615
adrenate (22:4n6)	0.9903	0.9636	1.0964	0.9797
adrenoylcarnitine (C22:4)*	0.4753	1.0714	0.5153	1.6394
AICA ribonucleotide	0.6917	1.0274	0.5788	1.6966
alanine	0.9664	0.9338	1.1416	0.9986
alanylleucine	2.6115	0.4948	NA	0.3989
allantoic acid	0.5393	1.7900	0.3720	0.5678
allantoin	0.7499	1.1203	0.6577	1.2857
alpha-hydroxyisocaproate	0.5939	1.2138	0.4867	1.4123
alpha-hydroxyisovalerate	0.4027	1.0869	0.5085	1.6784
alpha-ketoglutarate	2.0925	0.5251	1.3049	0.5447
alpha-muricholate	2.5901	0.2739	0.1820	NA
alpha-tocopherol	0.5887	1.4111	0.6192	1.0959
AMP	0.7350	1.4518	0.6750	0.9051
anserine	1.1108	1.2069	0.7673	0.8506
arabitol/xylitol	0.7799	1.3736	0.7389	0.9167
arabonate/xylonate	0.7603	1.3995	0.5291	1.0594
arachidate (20:0)	0.8302	0.9860	1.1232	1.0493
arachidonate (20:4n6)	0.6497	1.1426	0.7599	1.2587
arachidonoylcarnitine (C20:4)	0.3854	1.5568	0.5103	1.1524
arachidoylcarnitine (C20)*	0.5482	0.9877	0.6779	1.5668
argininate*	0.6493	1.2639	0.3899	1.2475
arginine	0.6851	1.1198	0.9387	1.1317
argininosuccinate	0.5594	1.0641	0.8301	1.3629
ascorbate (Vitamin C)	1.0977	0.9675	1.0620	0.9230
ascorbic acid 2-sulfate	0.4909	1.1063	NA	0.9955
ascorbic acid 3-sulfate*	0.5641	1.2207	0.4459	1.4549
asparagine	0.6980	1.0236	1.0117	1.1804
aspartate	0.3052	1.2223	0.4548	1.6316
ATP	1.9953	0.5822	1.2185	0.3367
azelate (C9-DC)	0.8324	1.2592	0.8650	0.9199
behenoylcarnitine (C22)*	0.3460	1.2284	0.2926	1.6429
behenoyl dihydrosphingomyelin (d18:0/22:0)*	0.7299	0.9455	1.0392	1.1772
behenoyl sphingomyelin (d18:1/22:0)*	0.8401	1.1117	0.8485	1.0948
benzoate	1.2878	1.0887	0.8553	0.7964
beta-alanine	0.9707	1.0053	1.0131	1.0055
beta-citrylglutamate	1.3098	0.9234	0.8194	0.9952
beta-hydroxyisovalerate	0.5396	1.3884	0.5407	1.2486
beta-hydroxyisovaleroylcarnitine	0.7782	0.9327	0.9888	1.2434
betaine	0.9161	0.9573	1.2310	0.9437
beta-muricholate	2.8574	0.3168	0.9171	0.1907
betonicine	0.9988	1.0819	0.9345	0.9657
bilirubin	0.8236	0.4200	1.2211	1.5428
biliverdin	0.8382	1.2564	0.5972	1.1250
biopterin	1.1276	1.0112	1.0176	0.9050
branched-chain, straight-chain, or cyclopropyl 12:1 fatty acid*	0.7043	1.1199	0.5940	1.1499
butenoylcarnitine (C4:1)	1.2041	1.0723	1.0179	0.7547
butyrate/isobutyrate (4:0)	0.8310	1.4514	0.7737	1.0193
butyrylcarnitine (C4)	1.0769	0.7427	1.2409	1.0670
butyrylglycine (C4)	1.1386	1.0847	0.5758	1.1072
caprate (10:0)	0.9676	1.1397	0.9956	0.8667
caproate (6:0)	1.1839	1.1168	0.8117	0.8360
caprylate (8:0)	0.9386	1.4157	0.7744	0.7299
carboxyethyl-GABA	0.7318	1.2377	0.9265	0.9454
carnitine	1.0713	0.8058	1.1636	1.0542
carnosine	0.9686	1.0969	0.9403	0.9543
catechol sulfate	1.0543	1.2955	0.5746	0.9274
CDP-choline	0.1868	2.0642	0.2288	0.9155
CDP-ethanolamine	0.5307	1.4764	0.6367	1.0503
ceramide (d18:1/14:0, d16:1/16:0)*	0.8051	1.2838	0.8080	0.8617
ceramide (d18:1/17:0, d17:1/18:0)*	0.6695	1.4894	0.5261	1.0153
ceramide (d18:2/24:1, d18:1/24:2)*	0.6167	1.0816	0.6190	1.5281
C-glycosyltryptophan	0.7274	1.1244	1.1164	0.9694
chenodeoxycholate	1.3432	0.5103	0.4601	NA
chiro-inositol	0.8261	1.0570	0.9157	1.0944
cholate	2.7643	0.3127	1.0761	0.1664
cholate sulfate	1.0000	NA	NA	NA
cholesterol	0.9225	1.0994	0.9220	0.9974
cholesterol sulfate	0.9529	1.0894	0.9114	1.0009
choline	0.4047	1.6478	0.4896	1.0494
cinnamoylglycine	1.5903	0.6237	1.1556	0.8973
cis-3,4-methyleneheptanoylcarnitine	0.6202	1.3734	0.9661	0.8688
cis-4-decenoate (10:1n6)*	0.6390	1.2271	0.8855	0.8939
cis-4-decenoylcarnitine (C10:1)	0.7772	1.1452	0.8177	1.1234
citraconate/glutaconate	1.4279	0.5771	1.1022	1.1046
citrate	0.8626	1.0447	0.9666	1.0709
citrulline	0.9950	1.0205	1.1076	0.9032
CMP	0.6161	1.1427	0.8009	1.2534
CoA	1.0399	0.7060	1.2062	1.1602
CoA-glutathione*	1.3159	1.0517	1.0945	0.6477
corticosterone	NA	0.6432	0.1803	1.6420
creatine	0.9648	0.9799	1.0007	1.0476
creatine phosphate	2.1614	0.6700	1.0952	0.4796
creatinine	0.9473	1.0042	0.9939	1.0373
cystathionine	0.6995	0.8568	1.0922	1.3125
cysteine	0.5367	1.5883	0.6679	0.8958
cysteine-glutathione disulfide	0.7167	1.3911	0.6590	0.9990
cysteinylglycine	1.1544	0.7277	1.2846	0.9976
cytidine	0.5573	1.7533	0.4324	0.8607
cytidine 5^-monophospho-N-acetylneuraminic acid	0.9074	0.9901	0.8577	1.1791
cytidine diphosphate	1.2442	0.9131	1.1032	0.8388
cytidine triphosphate	1.5143	0.5718	1.1468	0.7671
cytosine	0.8509	1.0405	0.5677	1.3956
daidzein	0.8866	1.4869	0.6780	0.7948
daidzein sulfate (2)	1.2633	0.6747	1.0065	1.1326
dCMP	1.0000	NA	NA	NA
decanoylcarnitine (C10)	1.0288	0.8191	1.0159	1.1748
dehydroascorbate	1.0675	1.1377	0.8991	0.8664
deoxycarnitine	0.8552	0.8966	1.1232	1.1336
deoxycholate	1.3141	0.4943	2.1345	0.3605
diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1])*	1.1246	0.6461	1.8140	0.6329
dihomolinoleate (20:2n6)	0.7915	1.0757	1.0020	1.0610
dihomolinolenate (20:3n3 or 3n6)	0.8995	0.9965	1.0306	1.0539
dihomo-linolenoylcarnitine (C20:3n3 or 6)*	0.7021	0.9757	0.9798	1.2550
dihomo-linoleoylcarnitine (C20:2)*	0.5981	1.0421	0.9253	1.2923
dihydroxyacetone phosphate (DHAP)	1.6680	0.5514	1.4451	0.7176
dimethylarginine (ADMA + SDMA)	0.5201	1.2910	0.8034	1.1507
dimethylglycine	0.5693	1.0635	0.7664	1.4020
dimethyl sulfone	1.0915	1.6204	0.8266	0.4616
docosadienoate (22:2n6)	0.5042	1.4290	0.6731	1.0973
docosadienoylcarnitine (C22:2)*	0.6300	1.1127	0.3624	1.5909
docosahexaenoate (DHA; 22:6n3)	0.9437	0.9594	0.5941	1.3766
docosahexaenoylcarnitine (C22:6)*	0.1934	1.9446	0.2446	1.0362
docosapentaenoate (DPA; 22:5n3)	0.9099	1.0106	0.8788	1.1388
docosapentaenoate (n6 DPA; 22:5n6)	0.9942	0.8749	0.8387	1.2624
docosapentaenoylcarnitine (C22:5n3)*	0.2397	1.6137	0.3963	1.2730
docosatrienoate (22:3n3)	0.8569	1.0939	0.4224	1.3286
docosatrienoate (22:3n6)*	2.0162	1.6221	0.1001	0.4231
docosatrienoylcarnitine (C22:3)*	0.8530	0.8244	0.7869	1.4579
dodecadienoate (12:2)*	0.9357	1.0045	0.8742	1.1425
dodecanedioate (C12)	1.3345	0.8269	1.0319	1.0457
eicosanoylsphingosine (d20:1)*	2.3212	0.2242	NA	0.8182
eicosapentaenoate (EPA; 20:5n3)	0.7433	0.6940	1.4338	1.2233
eicosenoate (20:1n9 or 1n11)	0.7519	1.3879	0.9697	0.7556
eicosenoylcarnitine (C20:1)*	0.5367	1.3358	0.7005	1.1611
enterolactone sulfate	0.7340	0.6844	NA	1.2908
equol	NA	1.0000	NA	NA
equol glucuronide	1.0209	1.2118	0.7402	0.9873
equol sulfate	1.3500	0.5876	1.3880	0.9442
ergothioneine	1.0620	1.1004	0.9187	0.8990
erucate (22:1n9)	0.8112	1.1313	0.9627	1.0115
erucoylcarnitine (C22:1)*	0.3129	1.7990	0.1928	1.1542
erythritol	0.6535	1.1130	0.4635	1.6194
erythronate*	0.7436	1.1468	0.6975	1.2315
ethyl beta-glucopyranoside	1.0152	0.8840	0.9942	1.1259
ethylmalonate	0.6754	1.1820	0.6685	1.2606
FAD	1.1504	0.9672	1.1146	0.8483
ferulic acid 4-sulfate	0.9888	1.2432	0.6119	1.0471
FMN	1.1706	0.8953	1.2299	0.8335
formiminoglutamate	0.2559	0.8308	0.5897	1.8430
fructose	0.8223	1.1503	0.8571	1.0573
fructosyllysine	0.6975	0.8915	0.9132	1.4020
fumarate	0.9280	0.8782	1.1467	1.0858
galactitol (dulcitol)	0.9594	1.3860	0.6786	0.8175
galactonate	0.7126	0.8681	1.3036	1.1391
galactose 1-phosphate	1.0240	0.8150	1.2353	1.0263
galacturonate 1-phosphate	NA	1.1125	1.0814	0.7090
gamma-glutamyl-alpha-lysine	1.0352	1.0476	0.9326	0.9686
gamma-glutamylcysteine	0.8563	0.9034	1.0874	1.1355
gamma-glutamyl-epsilon-lysine	0.5288	1.3237	0.8071	1.1044
gamma-glutamylglutamate	0.3251	0.8471	0.6785	2.4629
gamma-glutamylglutamine	0.9357	0.6621	1.4442	1.1148
gamma-glutamylglycine	0.7225	0.9441	1.3982	0.9331
gamma-glutamylhistidine	0.8115	1.2687	0.7666	0.9943
gamma-glutamylleucine	0.8637	1.0552	0.7050	1.2449
gamma-glutamylmethionine	0.7791	1.1842	1.0368	NA
gamma-glutamylphenylalanine	0.7899	1.1229	0.7135	1.2004
gamma-glutamylserine	0.5976	0.9028	1.1033	1.4206
gamma-glutamylthreonine	1.1536	0.8708	1.0627	0.9967
gamma-glutamyltryptophan	0.7049	NA	NA	1.2951
gamma-glutamyltyrosine	NA	NA	0.9672	1.0656
gamma-glutamylvaline	0.9312	1.0161	1.0716	0.9796
genistein	NA	0.9658	NA	1.0342
genistein sulfate*	1.2776	0.4616	1.0366	1.4126
gluconate	0.5454	1.5517	0.5981	0.9812
glucosamine-6-phosphate	1.2338	0.3606	1.7428	0.8505
glucose	1.0424	0.6550	1.4035	1.0759
glucose 6-phosphate	1.2855	0.4194	1.5325	0.9134
glucuronate	0.4537	0.9116	0.5082	2.0173
glutamate	1.2111	0.9948	1.0328	0.8317
glutamate, gamma-methyl ester	1.0369	0.7646	1.3696	0.9787
glutamine	1.0104	0.9732	1.1344	0.9272
glutarate (C5-DC)	0.9611	1.0989	1.0325	0.9057
glutarylcarnitine (C5-DC)	NA	NA	1.0000	NA
glutathione, oxidized (GSSG)	1.2511	0.9680	1.2460	0.6814
glutathione, reduced (GSH)	1.3028	0.7444	1.2458	0.9002
glycerate	1.2223	0.7295	1.2003	1.0073
glycerol	0.5896	1.4171	0.6595	1.0596
glycerol 3-phosphate	1.6244	0.6166	1.2916	0.7838
glycerophosphoethanolamine	1.3375	1.2041	0.7010	0.7392
glycerophosphoglycerol	1.0489	1.0714	0.8755	0.9724
glycerophosphoinositol*	0.9455	1.4174	0.5349	0.8941
glycerophosphorylcholine (GPC)	1.1502	1.0997	0.7850	0.9323
glycerophosphoserine*	1.0689	1.6473	NA	0.2149
glycine	0.9439	0.8173	1.6196	0.8063
glycine conjugate of C6H10O2 (2)*	1.9681	0.8455	0.7330	0.9000
glycine conjugate of C6H10O2 (3)*	1.9140	0.8005	1.0051	0.8057
glycitein sulfate (2)	1.1588	0.6820	0.6466	1.3465
glycocholate	NA	NA	0.5966	1.1345
glycosyl-N-arachidoyl-sphingosine (d18:1/20:0)*	1.1586	1.1931	0.7939	0.8133
glycosyl-N-palmitoyl-sphingosine (d18:1/16:0)	0.7527	1.2954	0.8710	0.9312
glycosyl-N-stearoyl-sphingosine (d18:1/18:0)	0.6065	1.4596	0.4995	1.1134
glycosyl-N-tetracosadienoyl-sphingosine (d18:1/24:2)*	1.1558	1.2712	0.6525	0.8270
glycylisoleucine	2.6039	0.9336	NA	0.5317
glycylleucine	2.4787	0.8978	0.3381	0.8688
glycylvaline	1.0721	0.9969	0.6802	1.1805
guaiacol sulfate	0.4851	1.3041	0.5003	1.2325
guanidinoacetate	1.1714	0.7623	1.5875	0.7296
guanine	0.5067	1.2599	0.8998	1.1641
guanosine	0.6774	1.5713	0.5777	0.8792
gulonate*	0.9140	0.9601	0.9502	1.1426
heme	0.7360	1.1904	NA	0.8390
heneicosapentaenoate (21:5n3)	0.8637	0.9510	1.2497	0.8712
heptadecasphingosine (d17:1)	0.5215	1.3442	0.6164	1.1540
heptanoate (7:0)	1.1403	0.9619	0.9623	0.9702
hexadecadienoate (16:2n6)	0.5736	1.2935	1.0281	0.9490
hexadecanedioate (C16)	1.1544	0.9768	0.9655	0.9498
hexadecatrienoate (16:3n3)	0.7414	0.9767	1.3584	0.9520
hexanoylcarnitine (C6)	0.9444	0.9585	1.0001	1.0870
hexanoylglycine (C6)	1.3907	0.9550	0.9509	0.8074
hippurate	1.1138	0.7156	0.5511	1.5643
histamine	0.8782	1.6348	0.5678	0.6703
histidine	0.7030	1.2119	0.8337	1.0888
homocitrulline	0.9393	1.0919	0.8901	1.0169
homostachydrine*	1.2421	0.8902	1.1840	0.8212
hydroxyasparagine	0.6579	0.8051	0.8393	1.8354
hydroxy-N6,N6,N6-trimethyllysine*	0.5789	1.0211	0.7878	1.4281
hydroxypalmitoyl sphingomyelin (d18:1/16:0(OH))	0.4777	0.9514	1.1320	1.2040
hydroxyproline	1.1632	0.4416	2.3549	0.5538
hyocholate	1.0000	NA	NA	NA
hypotaurine	1.0230	0.4721	2.4445	0.5551
hypoxanthine	0.2081	1.6936	0.3587	1.2311
imidazole lactate	1.0869	0.8994	1.2763	0.8556
imidazole propionate	1.3831	1.2053	0.7695	0.6564
indole-3-carboxylate	0.9389	1.1373	1.0746	0.7497
indoleacetate	0.6630	0.5556	NA	2.6702
indoleacetylglycine	1.6199	1.0700	0.5093	0.9140
indolelactate	0.5191	1.3815	0.5075	1.2593
indolepropionate	1.1355	1.1699	0.9460	0.7282
indoxyl glucuronide	1.3282	0.9921	1.2249	0.5205
inosine	0.7497	1.5962	0.4462	0.8930
inosine 5^-monophosphate (IMP)	0.9273	0.9595	1.0172	1.0859
inositol 1-phosphate (I1P)	0.9733	1.3375	0.6571	0.8294
Isobar: hexose diphosphates	2.2637	0.3407	1.5047	0.4903
isobutyrylcarnitine (C4)	0.4112	1.4381	0.4964	1.2796
isocaproylglycine	1.0348	1.1136	0.6505	1.0999
isocitric lactone	1.0810	1.0237	0.8937	0.9896
isoleucine	0.5871	1.2585	0.5743	1.3036
isoleucylglycine	0.9363	1.0376	0.3782	1.4467
isoleucylhydroxyproline*	0.9220	1.1087	0.7523	0.9995
isovalerylcarnitine (C5)	0.2549	1.7336	0.2513	1.2286
isovalerylglycine	0.9985	1.3832	0.3956	0.9948
itaconate	1.1410	0.9274	1.0722	0.9306
kynurenate	1.0839	1.1723	0.6774	0.9831
kynurenine	0.4491	1.3710	0.4470	1.3646
lactate	1.0609	0.7972	1.1911	1.0518
lanthionine	0.6045	1.2405	0.5787	1.2640
laurylcarnitine (C12)	0.8429	0.9263	1.0083	1.1905
leucine	0.5266	1.3236	0.4670	1.3489
leucylalanine	0.7062	2.0270	0.5270	0.8068
leucylglutamine*	1.4648	0.9796	0.7525	0.8682
leucylglycine	1.2417	0.9022	0.7406	1.1244
leucylhydroxyproline*	NA	0.9318	NA	1.0682
lignoceroylcarnitine (C24)*	0.6995	1.2984	0.5981	1.1699
lignoceroyl sphingomyelin (d18:1/24:0)	0.7787	1.0769	0.8944	1.1457
linoleate (18:2n6)	0.7078	1.2133	1.2013	0.8212
linolenate (18:3n3 or 3n6)	0.7363	0.7184	1.8377	0.9118
linolenoylcarnitine (C18:3)*	0.7346	0.6706	1.6340	1.1132
linoleoyl-arachidonoyl-glycerol (18:2/20:4) [1]*	NA	0.9201	0.9048	1.1352
linoleoyl-arachidonoyl-glycerol (18:2/20:4) [2]*	0.5602	0.8540	1.0285	1.4607
linoleoylcarnitine (C18:2)*	0.4988	0.9755	1.0902	1.3216
linoleoylcholine*	0.1800	1.4735	0.2190	0.8446
linoleoyl-docosahexaenoyl-glycerol (18:2/22:6) [2]*	0.4496	1.0775	0.8568	1.4070
linoleoyl ethanolamide	0.4316	1.7828	0.7651	0.6792
linoleoyl-linolenoyl-glycerol (18:2/18:3) [2]*	1.0887	0.4580	1.9569	0.7951
linoleoyl-linoleoyl-glycerol (18:2/18:2) [1]*	0.8733	1.0655	1.0231	0.9991
linoleoyl-linoleoyl-glycerol (18:2/18:2) [2]*	1.0283	0.8592	1.2810	0.9401
lysine	0.6579	1.1524	0.8774	1.1578
lyxonate	0.9043	1.2252	0.8115	0.9240
malate	0.9470	0.9239	1.0293	1.1039
maleate	0.7795	0.7405	1.4640	1.1226
malonylcarnitine	1.0106	1.0197	0.9268	1.0221
maltol sulfate	0.8891	1.2479	0.6365	0.9059
maltose	1.4984	1.0962	0.8020	0.6892
maltotetraose	1.9732	0.9712	0.6942	0.4631
maltotriose	2.0652	0.7808	0.9171	0.5175
mannitol/sorbitol	0.8479	1.3368	0.5998	1.0096
mannonate*	0.9853	1.2675	0.8166	0.8358
mannose	0.6497	1.1795	0.9191	1.3954
mannose 6-phosphate	1.1753	0.4055	1.7076	0.8789
margarate (17:0)	0.8287	1.0810	1.0800	0.9726
margaroylcarnitine (C17)*	0.5351	1.1238	0.8862	1.2718
mead acid (20:3n9)	0.8684	1.1912	1.0072	0.8703
mesaconate (methylfumarate)	1.3614	0.6564	0.9640	1.0152
methionine	0.7630	1.1669	0.7843	1.1327
methionine sulfone	0.6713	0.9618	0.9477	1.3104
methionine sulfoxide	1.2149	0.8412	1.3133	0.8042
methyl glucopyranoside (alpha + beta)	1.3746	0.8463	1.2333	0.7414
methylmalonate (MMA)	0.5246	1.2868	0.9634	1.0379
methylphosphate	1.4307	1.0599	0.9023	0.6937
methylsuccinate	0.9381	1.2096	0.7295	0.9979
myo-inositol	0.4916	1.1562	0.7558	1.3591
myristate (14:0)	0.8723	0.9040	1.3431	0.9558
myristoleate (14:1n5)	0.7766	1.0901	1.1055	0.9813
myristoleoylcarnitine (C14:1)*	0.8711	0.9783	0.9244	1.1709
myristoylcarnitine (C14)	0.7143	0.8740	1.1676	1.2284
N(^1)-acetylspermidine	0.5720	1.1964	0.4199	1.0699
N1-Methyl-2-pyridone-5-carboxamide	0.6024	1.4691	0.4117	1.1681
N1-Methyl-4-pyridone-3-carboxamide	0.5935	1.3416	0.3848	1.3394
N1-methylinosine	0.3818	0.9582	0.2783	1.6072
N2-acetyllysine	NA	0.9986	NA	1.0021
N-(2-furoyl)glycine	1.7564	1.2300	0.4163	0.7138
N-(2-hydroxypalmitoyl)-sphingosine (d18:1/16:0(2OH))	0.8379	1.3451	0.5987	0.8615
N2,N2-dimethylguanosine	0.5422	1.7727	NA	0.6375
N2,N5-diacetylornithine	0.5261	1.4894	0.3174	1.1015
N4-acetylcytidine	0.4704	0.6761	NA	1.4661
N6-acetyllysine	0.7965	0.9519	1.0652	1.1538
N6-carbamoylthreonyladenosine	NA	1.0556	NA	0.9583
N6-carboxymethyllysine	1.1940	1.3246	0.6020	0.7747
N6-methyllysine	0.6661	0.8487	1.2472	1.2348
N6,N6-dimethyllysine	0.9791	0.8826	1.1074	1.0509
N6,N6,N6-trimethyllysine	0.4406	1.1833	0.4660	1.5715
N6-succinyladenosine	0.4919	1.1799	0.5784	1.4842
N-acetyl-1-methylhistidine*	0.8334	1.3616	0.3126	1.2421
N-acetyl-2-aminoadipate	0.4991	1.5510	0.6168	0.9364
N-acetyl-2-aminooctanoate*	0.7426	1.4561	0.6572	1.0377
N-acetyl-3-methylhistidine*	NA	1.0878	NA	0.9122
N-acetylalanine	0.8150	1.3596	0.6507	0.9707
N-acetylarginine	0.8561	1.1277	0.7233	1.1545
N-acetylasparagine	0.9459	1.1058	0.8183	1.0626
N-acetylaspartate (NAA)	1.1973	1.0094	0.8844	0.9309
N-acetyl-aspartyl-glutamate (NAAG)	0.5862	1.1875	0.5159	1.4271
N-acetyl-beta-alanine	0.7160	1.0905	1.0630	1.0673
N-acetylcarnosine	1.1969	1.4403	0.6053	0.6380
N-acetylcitrulline	0.2771	1.4128	0.4052	0.8888
N-acetylcysteine	0.9020	1.1180	0.3723	1.0277
N-acetyl-glucosamine 1-phosphate	NA	1.0000	NA	NA
N-acetylglucosamine 6-phosphate	0.4063	0.9984	0.6153	1.6322
N-acetylglucosamine/N-acetylgalactosamine	0.5682	2.5957	0.2341	0.8785
N-acetylglucosaminylasparagine	0.8321	0.9435	0.9965	1.1869
N-acetylglutamate	1.0698	1.0953	0.8225	0.9679
N-acetylglutamine	1.0820	0.9976	0.8770	1.0320
N-acetylglycine	0.6854	1.3910	0.8107	0.9132
N-acetylhistamine	1.6481	0.9928	NA	0.8470
N-acetylhistidine	0.6661	1.0687	0.6342	1.2304
N-acetylisoleucine	0.9028	1.2682	0.6008	1.0480
N-acetylleucine	0.6259	1.4712	0.4868	1.0953
N-acetylmethionine	0.7131	1.2747	0.5689	1.1988
N-acetylmethionine sulfoxide	1.3165	0.9787	0.7473	0.9402
N-acetylneuraminate	0.5366	1.2310	0.6652	1.3061
N-acetylphenylalanine	0.4387	1.4316	0.4256	1.3180
N-acetylputrescine	0.8278	1.1133	0.3746	1.4403
N-acetylpyrraline	1.0718	1.6161	0.3880	0.6414
N-acetylserine	0.7054	1.4380	0.5367	1.0408
N-acetyltaurine	0.9313	1.1487	0.8997	0.9507
N-acetylthreonine	0.8798	1.1636	0.9105	0.9629
N-acetyltryptophan	0.8133	1.1730	0.5942	1.1142
N-acetyltyrosine	0.5587	1.5952	0.7013	0.8484
N-acetylvaline	0.8376	1.3382	0.6540	0.9657
NAD+	1.0893	0.8186	1.3310	0.9071
NADH	2.3186	0.2626	1.6403	0.4436
NADHX*	0.2111	1.6500	0.2931	1.5113
N-arachidonoyltaurine	NA	1.1058	NA	0.8942
N-carbamoylaspartate	0.6409	1.3810	0.9112	0.7413
N-carboxymethylalanine	0.8945	0.9976	1.0080	1.0724
N-delta-acetylornithine	1.1130	0.5992	1.6079	0.9432
nervonoylcarnitine (C24:1)*	0.1386	1.6081	0.0641	0.8897
N-formylanthranilic acid	1.2532	1.2347	0.9083	0.6759
N-formylmethionine	1.2112	1.0967	0.9470	0.7765
N-formylphenylalanine	1.0158	1.1372	0.9277	0.8936
N-glycolylneuraminate	0.2964	1.1423	0.5036	1.6945
nicotinamide	1.0347	0.9313	1.0631	1.0087
nicotinamide N-oxide	1.6282	0.9364	1.0209	0.6091
nicotinamide ribonucleotide (NMN)	0.9890	0.7198	1.0156	1.3169
nicotinamide riboside	0.0531	0.9351	0.0476	2.3419
nicotinate	1.0502	1.2115	NA	0.2148
nisinate (24:6n3)	0.7602	1.1035	1.0493	1.0326
N-linoleoyltaurine*	0.8152	1.1343	0.9541	1.0132
N-methylalanine	1.2325	0.6173	1.6453	0.5236
N-methyl-GABA	1.0675	0.8780	1.3012	0.8761
N-methylproline	1.4420	0.6721	1.4037	0.7707
N-monomethylarginine	0.5642	0.9811	1.2393	1.1620
N,N-dimethylalanine	1.6657	1.0278	0.7052	0.7033
N,N-dimethyl-pro-pro	0.7899	1.0387	0.8339	1.2245
N,N,N-trimethyl-5-aminovalerate	1.0425	0.8031	1.0751	1.1410
N,N,N-trimethyl-alanylproline betaine (TMAP)	0.7120	1.1184	0.6451	1.3239
N-oleoyltaurine	0.8468	1.4555	0.7041	0.8002
nonadecanoate (19:0)	0.7602	1.0701	1.0759	1.0370
N-palmitoylglycine	0.8885	0.7979	1.2442	1.0272
N-palmitoyl-sphingadienine (d18:2/16:0)*	0.8537	1.4202	0.5863	0.9197
N-palmitoyl-sphinganine (d18:0/16:0)	0.6787	1.1680	0.9029	1.0711
N-palmitoyl-sphingosine (d18:1/16:0)	0.7839	1.2379	0.8787	0.9692
N-palmitoyltaurine	1.0924	1.1141	1.0378	0.7766
N-stearoyl-sphinganine (d18:0/18:0)*	0.7064	1.0288	0.9866	1.1444
N-stearoyl-sphingosine (d18:1/18:0)*	0.6726	1.3177	0.5880	1.1650
N-stearoyltaurine	1.0239	1.1317	0.8688	0.9262
octadecenedioate (C18:1-DC)	1.1731	0.8269	NA	NA
octanoylcarnitine (C8)	0.9707	0.8756	1.0949	1.0954
oleate/vaccenate (18:1)	0.7633	1.5710	0.9284	0.5676
oleoyl-arachidonoyl-glycerol (18:1/20:4) [1]*	0.4196	1.7784	0.7945	0.6401
oleoyl-arachidonoyl-glycerol (18:1/20:4) [2]*	0.7398	0.9147	1.3152	1.0581
oleoylcarnitine (C18:1)	0.5542	1.1385	0.9090	1.2251
oleoylcholine	NA	1.4025	0.2213	0.6602
oleoyl ethanolamide	0.5538	1.1328	0.9243	1.2210
oleoyl-linolenoyl-glycerol (18:1/18:3) [2]*	1.2266	0.6491	1.1428	0.8387
oleoyl-linoleoyl-glycerol (18:1/18:2) [1]	0.7878	1.4487	0.8176	0.7305
oleoyl-linoleoyl-glycerol (18:1/18:2) [2]	1.0320	1.1318	1.0038	0.8238
O-methyltyrosine	1.1001	0.8666	1.1944	0.9421
ophthalmate	0.7779	2.0508	0.9187	0.4856
ornithine	1.0222	0.7617	1.3716	0.9910
orotate	0.7051	1.3165	0.6882	1.0715
orotidine	0.9233	0.8861	1.5533	0.7898
O-sulfo-L-tyrosine	0.3007	1.3950	0.3464	0.9432
oxalate (ethanedioate)	1.2183	1.2495	0.7589	0.7311
oxindolylalanine	0.5236	1.3245	0.5841	1.1984
palmitate (16:0)	0.9099	1.0305	1.1619	0.9139
palmitoleate (16:1n7)	0.7201	1.2909	1.3190	0.6397
palmitoleoylcarnitine (C16:1)*	0.6650	0.9974	1.0381	1.2150
palmitoleoyl ethanolamide*	0.3635	1.6753	0.4590	0.9966
palmitoloelycholine	NA	1.0794	NA	0.7619
palmitoyl-arachidonoyl-glycerol (16:0/20:4) [1]*	NA	1.0000	NA	NA
palmitoyl-arachidonoyl-glycerol (16:0/20:4) [2]*	0.5213	0.7419	0.8810	1.5482
palmitoylcarnitine (C16)	0.5200	1.0555	1.1445	1.1763
palmitoylcholine	NA	1.0244	NA	0.9593
palmitoyl dihydrosphingomyelin (d18:0/16:0)*	0.8522	1.1279	0.9092	1.0243
palmitoyl-docosahexaenoyl-glycerol (16:0/22:6) [1]*	0.5576	1.1988	0.9613	1.1164
palmitoyl-docosahexaenoyl-glycerol (16:0/22:6) [2]*	0.6882	0.8166	1.3864	1.1564
palmitoyl ethanolamide	0.5439	1.4218	0.7787	1.0018
palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]*	0.8425	0.7481	1.5034	1.0409
palmitoyl sphingomyelin (d18:1/16:0)	0.8653	1.0885	0.9563	1.0263
pantetheine	0.9136	0.8936	1.1100	1.1048
pantoate	1.1887	1.1052	0.5365	1.1642
pantothenate (Vitamin B5)	1.1302	1.0437	1.0540	0.8185
p-cresol glucuronide*	1.0758	1.3781	0.2119	0.4921
p-cresol sulfate	1.2992	1.8461	0.2011	0.3900
pentadecanoate (15:0)	0.9349	1.0064	1.1174	0.9552
pentadecanoylcarnitine (C15)*	0.5837	1.0549	1.0924	1.1686
perfluorooctanesulfonate (PFOS)	0.7493	1.5790	0.4938	0.7293
phenol glucuronide	0.9634	1.1501	0.9794	0.8413
phenol sulfate	1.1225	1.2912	0.5525	0.8994
phenylacetylglycine	1.5274	1.1414	0.4889	0.8268
phenylalanine	0.6589	1.2836	0.6406	1.1763
phenylalanylalanine	1.0015	0.9603	0.8447	1.1274
phenylalanylglycine	1.6733	1.5562	0.5266	1.0663
phenyllactate (PLA)	0.8076	1.3641	0.4726	1.0981
phenylpyruvate	NA	0.4972	0.7941	1.6058
phosphate	0.9857	1.0032	1.0255	0.9883
phosphocholine	0.8382	1.3928	0.9241	0.7208
phosphoenolpyruvate (PEP)	2.1680	0.4183	1.1129	0.4173
phosphoethanolamine (PE)	0.8878	1.0246	1.1664	0.9332
phosphopantetheine	0.9259	0.7924	1.2035	1.1448
phytosphingosine	0.8554	1.2110	0.5378	1.1262
picolinate	0.3031	1.1528	NA	0.9832
pipecolate	1.0979	0.9737	0.9947	0.9639
proline	0.5866	1.2993	0.7642	1.1216
prolylglycine	0.3522	1.7546	0.3222	1.0845
prolylhydroxyproline	NA	0.8301	0.6301	1.6248
propionylcarnitine (C3)	0.7024	1.0374	1.3371	0.9290
prostaglandin E2	NA	0.9456	0.9098	1.1146
prostaglandin F2alpha	NA	1.2914	NA	0.9272
pseudouridine	0.6252	1.0444	0.6090	1.4963
putrescine	0.3265	0.9718	0.2950	2.0168
pyridoxal	0.6555	1.1779	0.5806	1.1619
pyridoxal phosphate	1.0972	1.2630	0.7150	0.8443
pyridoxamine	0.2112	2.6648	0.1184	0.4488
pyridoxamine phosphate	0.9789	0.9334	1.0139	1.0813
pyridoxate	0.9202	1.2336	0.5803	1.0898
pyrraline	0.6206	1.0930	1.1291	1.1466
pyruvate	1.3235	0.6893	0.9725	1.1437
quinate	0.3724	1.4350	0.3027	0.9809
quinolinate	NA	1.1035	0.6625	1.2340
(R)-3-hydroxybutyrylcarnitine	1.0536	1.0452	1.1873	0.7763
raffinose	0.3618	2.0337	0.1405	0.5765
retinol (Vitamin A)	1.2081	1.0125	1.2450	0.6621
ribitol	0.3161	2.0820	0.3335	0.7280
riboflavin (Vitamin B2)	0.5595	1.2565	0.7033	1.2228
ribonate	0.9737	1.2814	0.7388	0.8837
ribose	NA	1.3490	NA	0.4765
ribose 1-phosphate	0.5112	1.4330	0.6211	1.1249
ribulose/xylulose	NA	2.2248	NA	0.3876
S-(1,2-dicarboxyethyl)glutathione	0.9251	0.6570	1.5241	1.0712
S-1-pyrroline-5-carboxylate	NA	0.8488	NA	1.2269
(S)-3-hydroxybutyrylcarnitine	1.3497	0.7224	1.5020	0.7089
S-(3-hydroxypropyl)mercapturic acid (HPMA)	1.0429	1.1267	0.7956	0.9728
S-adenosylhomocysteine (SAH)	0.7269	1.2893	0.8705	0.9569
S-adenosylmethionine (SAM)	0.8622	0.9577	0.8633	1.2444
salicylate	0.9334	1.1499	0.8870	0.9569
sarcosine	1.1574	0.4581	2.2125	0.5634
S-carboxymethyl-L-cysteine	NA	0.9554	NA	1.0891
sebacate (C10-DC)	0.8554	1.0040	0.9647	1.1238
sedoheptulose	NA	1.0000	NA	NA
sedoheptulose-7-phosphate	NA	1.8740	NA	0.5630
serine	0.7830	1.1605	0.9648	0.9968
serotonin	1.0227	1.1816	1.0033	0.7740
S-methylcysteine	0.7882	1.4059	0.7027	0.9577
S-methylglutathione	0.5678	1.2161	NA	NA
spermidine	0.4276	0.8987	0.9734	1.5437
spermine	1.0832	0.9263	1.5609	0.6242
sphingadienine	0.6330	1.6352	0.4207	0.9500
sphinganine	0.4205	1.2814	0.6573	1.3371
sphingomyelin (d17:1/16:0, d18:1/15:0, d16:1/17:0)*	0.7144	1.3551	0.7829	0.9532
sphingomyelin (d18:0/18:0, d19:0/17:0)*	0.7963	0.9393	1.0429	1.1842
sphingomyelin (d18:0/20:0, d16:0/22:0)*	0.7098	1.1624	0.8744	1.1628
sphingomyelin (d18:1/14:0, d16:1/16:0)*	0.8661	1.0546	1.0377	1.0063
sphingomyelin (d18:1/17:0, d17:1/18:0, d19:1/16:0)	0.9002	1.2715	0.7811	0.9174
sphingomyelin (d18:1/18:1, d18:2/18:0)	0.8644	0.9754	0.9577	1.1552
sphingomyelin (d18:1/19:0, d19:1/18:0)*	0.8928	1.3605	0.7206	0.8641
sphingomyelin (d18:1/20:0, d16:1/22:0)*	0.8706	1.1195	0.8924	1.0328
sphingomyelin (d18:1/20:1, d18:2/20:0)*	0.9412	0.9594	0.9483	1.1254
sphingomyelin (d18:1/21:0, d17:1/22:0, d16:1/23:0)*	0.7055	1.5453	0.5781	0.8885
sphingomyelin (d18:1/22:1, d18:2/22:0, d16:1/24:1)*	0.8922	1.1711	0.8588	0.9822
sphingomyelin (d18:1/22:2, d18:2/22:1, d16:1/24:2)*	NA	1.1283	0.7598	1.0345
sphingomyelin (d18:1/24:1, d18:2/24:0)*	0.8355	1.1834	0.8413	1.0212
sphingomyelin (d18:2/16:0, d18:1/16:1)*	0.8818	1.0801	0.8656	1.0888
sphingomyelin (d18:2/23:0, d18:1/23:1, d17:1/24:1)*	0.6639	1.3067	0.7511	0.8960
sphingomyelin (d18:2/23:1)*	0.7635	1.2596	0.6822	0.9562
sphingomyelin (d18:2/24:1, d18:1/24:2)*	0.8055	1.0861	0.9738	1.0593
sphingomyelin (d18:2/24:2)*	NA	1.0752	0.7596	1.1652
sphingosine	0.4756	1.6594	0.4987	0.9791
stachydrine	1.1417	0.9569	0.9812	0.9614
stearate (18:0)	0.8648	0.9878	1.1266	1.0201
stearidonate (18:4n3)	0.7223	0.8873	1.3909	1.0318
stearoyl-arachidonoyl-glycerol (18:0/20:4) [1]*	NA	1.7089	0.1429	0.5054
stearoyl-arachidonoyl-glycerol (18:0/20:4) [2]*	0.4342	1.5563	0.5524	1.0881
stearoylcarnitine (C18)	0.4578	1.1492	0.8723	1.3080
stearoyl-docosahexaenoyl-glycerol (18:0/22:6) [1]*	0.2922	1.6615	0.2410	0.7257
stearoyl-docosahexaenoyl-glycerol (18:0/22:6) [2]*	0.4255	1.6502	0.4144	1.0856
stearoyl ethanolamide	0.7467	1.0268	0.9626	1.1770
stearoyl sphingomyelin (d18:1/18:0)	0.8396	1.1112	0.8543	1.0915
suberate (C8-DC)	0.7870	1.0833	0.9393	1.0815
succinate	1.0396	0.8898	1.0917	1.0322
succinoyltaurine	0.9407	0.7820	1.2441	1.1171
succinylcarnitine (C4-DC)	0.6811	1.0234	1.0301	1.1795
sucrose	0.5167	1.2276	0.3194	1.5712
sulfate*	0.8233	1.2663	0.6779	1.0521
tartronate (hydroxymalonate)	1.5933	0.9447	0.8773	0.5223
taurine	0.9897	1.0275	0.9608	1.0039
tauro-beta-muricholate	0.3577	0.1632	0.3736	2.8626
taurochenodeoxycholate	0.5689	0.2461	1.1125	1.8851
taurocholate	0.2394	0.1307	0.4145	2.9549
taurocyamine	0.8823	0.9993	0.9821	1.0977
taurodeoxycholate	0.5797	0.2713	1.4319	1.0951
taurohyodeoxycholic acid	0.4408	NA	0.7924	1.2955
tauroursodeoxycholate	0.2816	NA	0.5427	1.7022
tetracosadienoylcarnitine (C24:2)*	0.2427	1.4518	0.0505	1.2309
tetradecadienoate (14:2)*	0.7030	1.1382	0.9453	1.0933
tetradecanedioate (C14)	1.0757	1.0307	1.0395	0.8808
thiamin monophosphate	NA	0.2667	NA	1.3667
thiamin (Vitamin B1)	0.3020	1.8602	NA	1.0099
thioproline	0.7281	1.3665	0.5051	1.1288
threonate	0.9981	1.1126	0.9514	0.9074
threonine	0.7411	1.1499	0.8061	1.1521
threonylphenylalanine	0.9568	1.0634	0.4775	1.2633
thymidine	0.7585	1.0641	0.9581	1.1292
thymine	2.5568	0.7000	0.4678	0.8877
tiglyl carnitine (C5)	0.7707	0.8842	1.0191	1.2659
TMP	NA	NA	0.8444	1.4668
trans-2-hexenoylglycine	1.7300	0.9937	0.7975	0.6950
trans-urocanate	0.7919	1.4385	0.6553	0.8938
tricarballylate	0.7066	1.5827	0.4310	0.9501
tricosanoyl sphingomyelin (d18:1/23:0)*	0.7749	1.1919	0.7819	1.0972
trigonelline (N^-methylnicotinate)	0.8818	1.0274	0.9350	1.0995
trimethylamine N-oxide	0.8658	1.2996	0.5495	1.0753
tryptophan	0.5726	1.3756	0.5987	1.1626
tyramine	2.4610	0.3269	NA	0.3518
tyrosine	0.7820	1.1783	0.9323	1.0003
tyrosol	NA	0.9147	NA	1.0284
tyrosylglycine	0.7058	1.3179	0.3286	1.1464
UDP-galactose	0.0983	1.5300	0.5440	0.8483
UDP-glucose	0.6114	1.3976	0.6770	1.0753
UDP-glucuronate	0.5137	1.1371	0.8175	1.3341
UDP-N-acetylglucosamine/galactosamine	0.6667	1.0451	0.9720	1.2130
UMP	0.4067	1.0159	0.9006	1.4767
uracil	0.6632	1.1077	0.5224	1.4586
urate	0.4818	1.3106	0.6015	1.2999
urea	0.5805	1.3882	0.5181	1.2003
uric acid ribonucleoside*	NA	1.3465	NA	0.6535
uridine	0.6285	1.4328	0.6568	1.0159
uridine-2^,3^-cyclic monophosphate	NA	1.0000	NA	NA
uridine 5^-diphosphate (UDP)	0.9858	0.7939	1.3068	0.9971
uridine 5^-triphosphate (UTP)	1.3132	0.5644	1.5140	0.7203
ursocholate	1.7388	NA	0.5833	0.6780
ursodeoxycholate	1.3889	0.3334	1.0831	NA
valerate (5:0)	NA	1.1982	0.7009	0.9027
valerylglycine (C5)	1.4425	1.1101	0.6834	0.7842
valine	0.5920	1.3164	0.6005	1.2152
valylglutamine	4.9433	0.7245	0.3814	0.9772
valylglycine	0.8779	1.0730	0.3209	1.4888
valylleucine	1.7097	0.3161	NA	0.7549
xanthine	0.5017	1.4367	0.5181	1.2011
xanthosine	0.3904	1.6366	0.1877	1.2011
xanthosine 5^-monophosphate (xmp)	NA	NA	NA	1.0000
xanthurenate	1.2419	1.0233	1.4060	0.6644
ximenoylcarnitine (C26:1)*	NA	1.3309	NA	0.6691

Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

Factors:

F1	Age:78 weeks | Condition:Control | Sample source:Gastrocnemius Muscle
F2	Age:78 weeks | Condition:KPC | Sample source:Gastrocnemius Muscle
F3	Age:8 weeks | Condition:Control | Sample source:Gastrocnemius Muscle
F4	Age:8 weeks | Condition:KPC | Sample source:Gastrocnemius Muscle