Data for (Study ST002088)

(Analysis AN003409)

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	F5	F6	F7	F8	F9	F10	F11	F12	F13	F14	F15	F16	F17	F18	F19	F20	F21	F22	F23	F24	F25	F26	F27	F28	F29	F30	F31	F32	F33	F34	F35	F36	F37	F38	F39	F40	F41	F42	F43	F44	F45	F46	F47	F48	F49	F50	F51	F52	F53	F54	F55	F56	F57	F58	F59	F60	F61	F62	F63	F64	F65	F66	F67	F68	F69	F70	F71	F72	F73	F74	F75	F76	F77	F78	F79	F80	F81	F82	F83	F84	F85	F86	F87	F88	F89	F90	F91	F92	F93	F94	F95	F96	F97	F98	F99	F100	F101	F102	F103	F104	F105	F106	F107	F108	F109	F110	F111	F112
1,6-anhydroglucose	0.8257	0.8330	1.1763	0.7564	0.3180	2.4159	1.0063	1.4710	0.5070	0.2026	0.9565	0.4325	1.1312	1.3263	0.4189	0.5119	1.0141	1.5043	0.9501	2.2318	0.6161	0.8893	1.2126	0.7204	1.6384	1.0059	0.8643	0.9602	0.7780	0.9904	1.1549	1.0086	0.6692	1.6096	0.4790	1.6657	0.2941	0.4305	0.8851	1.0300	1.4731	0.3472	2.3218	0.2172	1.3563	1.4543	0.1215	0.6596	0.8457	0.6244	1.7717	0.1625	0.1065	0.8348	0.5546	0.5836	0.4563	1.5192	0.8926	1.2406	1.3441	1.6932	0.1844	1.0210	2.4136	2.5169	0.6102	1.5111	0.7202	0.4904	0.8178	2.0139	0.5914	0.5911	2.3468	0.8926	0.7675	0.6588	1.0582	0.6752	0.7032	0.7994	0.7837	1.8763	1.4445	0.4420	1.2061	0.9885	0.6835	0.4809	2.3646	0.3285	0.4787	1.5702	1.2758	0.7309	0.6214	0.6602	0.8309	0.5701	0.8402	1.3485	0.5549	0.8707	0.6976	1.2578	0.4463	2.4967	1.4800	0.6008	0.2676	0.8108
2,3-dihydroxyisovalerate	0.3060	0.1394	0.2469	1.5602	3.1289	0.1775	0.3713	0.3030	0.3067	0.3503	0.1040	0.1143	0.1572	0.2517	0.3818	0.1717	0.5100	0.1975	0.2489	1.2771	0.1811	0.3425	0.6503	0.2618	0.4043	0.6185	0.4928	2.9619	2.9578	2.1642	0.6643	1.2611	1.9808	0.1560	0.2514	0.9264	0.1922	5.3765	0.3574	0.3064	1.9221	0.1310	0.8097	0.2773	2.4016	0.2077	0.1503	0.2221	0.1740	0.1454	0.2969	1.7009	0.2033	0.1531	0.1075	0.2844	0.7340	0.6010	0.7152	1.4106	0.1069	0.8673	0.1226	0.3023	0.1663	0.4954	0.1386	1.4810	0.5158	0.1147	0.3048	2.6107	0.1251	0.6623	0.3243	0.4924	0.2886	0.4422	0.4620	0.4252	0.9537	1.4152	2.6447	2.7231	1.2584	1.0037	1.3221	0.4761	1.1332	0.3696	0.3445	0.2725	0.5616	0.9530	2.0967	0.3813	0.7300	0.3648	2.9887	0.2480	0.3763	0.7568	0.4147	2.6501	0.9832	0.1859	0.2856	0.3529	0.2627	0.1053	0.1937	0.3077
2,4,6-trihydroxybenzoate	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA
2-aminoadipate	0.7852	0.7298	0.8286	0.9181	0.9218	0.7089	0.9195	1.1307	1.0933	0.8595	0.5534	0.8660	0.3432	0.6503	1.4242	0.6458	0.8263	0.8560	1.0625	0.7556	0.7390	0.7621	0.7623	0.7423	1.0106	0.8289	0.8267	0.9416	0.7252	0.9021	0.8700	0.9531	0.9403	0.6593	0.8327	0.5890	0.6808	1.7118	0.6415	0.5645	2.0757	0.9345	0.5221	0.5807	1.0333	0.6900	1.1260	0.9870	0.9079	0.7825	0.8895	0.7137	0.3485	1.8217	0.6522	1.2922	0.9726	0.8936	0.9166	1.1611	0.9617	0.9773	0.9956	1.2543	0.7207	2.3344	0.7429	1.5552	1.3009	0.9257	0.6155	1.0936	1.2237	1.7867	0.8122	0.9214	1.0219	1.0816	1.0256	1.3155	0.9290	1.4540	1.2684	0.8877	1.2633	1.0870	1.1253	1.0368	1.2038	1.0647	1.3791	0.8764	0.7963	0.9839	0.6404	1.3795	1.1678	0.9270	1.0327	1.2793	1.0113	0.4631	1.1396	0.8046	1.3088	0.9834	1.3263	1.5791	0.8264	1.4596	1.2088	1.2723
2-hydroxy-4-(methylthio)butanoic acid	1.3158	2.1428	1.4199	1.0680	1.5278	1.0345	0.8015	1.3448	1.5541	0.6095	0.9399	0.5465	1.5340	0.7256	1.0056	0.7474	1.0587	1.2736	0.5871	0.7167	0.3914	0.8513	1.0075	0.7242	0.8045	0.7847	0.6834	0.7658	0.7274	0.8043	0.7278	0.8464	0.9475	0.3361	3.4975	0.5233	0.4157	1.0568	0.9299	0.4227	1.3073	0.5895	1.5160	0.5596	1.3006	0.6583	0.6934	0.7694	1.4058	1.2993	0.7087	0.5378	0.5853	0.9376	0.3431	0.4271	1.6440	1.7808	1.4634	1.1935	1.4501	3.8153	0.7614	1.1019	1.3416	2.2005	1.1584	0.6337	1.3741	0.7310	1.9403	1.8669	0.7644	1.7849	1.3723	1.0815	1.1574	0.9480	0.7824	1.0751	1.1238	0.7872	0.9623	0.9744	0.7885	0.9275	1.0171	0.8064	1.0482	1.1669	0.8210	0.9323	0.8823	0.7747	0.7704	0.6919	0.9297	1.2189	1.3104	0.6724	0.8143	2.1251	1.2490	1.6688	0.7361	0.7282	0.6785	2.5692	1.7808	1.3586	0.5819	1.0185
2-hydroxybutyrate/2-hydroxyisobutyrate	0.7906	0.7398	1.0600	0.8905	0.7274	0.7494	0.8200	0.8542	1.1932	0.4013	1.0398	1.2018	0.8240	0.7495	1.0774	0.7998	0.8958	0.5965	0.8291	1.1149	0.9963	0.7569	1.0373	0.6639	1.2660	0.7124	0.8768	0.8748	1.0937	0.8866	1.2462	1.2650	1.0253	1.1331	0.3526	0.7562	1.1633	1.2772	0.9702	1.1326	1.5635	1.1301	0.5792	0.7127	1.0852	1.1587	1.2848	1.0492	0.7830	1.1590	1.5546	1.3780	0.5393	1.7675	1.0433	1.8637	0.9664	0.9795	0.9701	0.8812	0.7267	1.1677	0.9388	0.7670	0.6555	1.0668	0.9141	0.9728	0.9706	0.5740	0.4612	1.1685	0.6800	1.0216	0.9031	0.9129	0.9335	1.0297	0.7878	1.1569	0.9773	0.9377	0.9202	0.9136	0.9513	1.1388	1.1193	1.2053	1.0492	0.9555	0.7372	0.8406	1.3279	0.8100	0.7220	0.8673	0.7671	0.7910	1.2013	1.2647	0.6379	0.8376	1.4174	1.1336	1.2210	1.3696	1.2099	1.8343	0.8136	1.1658	1.4249	2.3788
2-hydroxyphenylacetate	0.7108	0.7891	0.6309	0.9331	0.4922	0.5302	0.7991	0.8944	0.6303	1.0411	0.4939	0.6297	0.8816	0.5481	0.5795	0.6918	0.7609	0.8989	0.6711	0.9162	0.7835	1.0115	0.9610	0.7602	1.3338	0.8810	0.8351	1.1373	0.8118	1.0074	0.8763	0.7560	0.3357	0.3249	2.3354	0.9659	1.3288	0.9328	1.1010	0.9147	0.7676	0.7970	1.0532	0.4589	1.0130	1.0381	1.6908	0.7532	0.7244	0.7062	0.8776	0.3988	0.8174	0.4318	0.3519	0.6976	0.7643	1.1063	0.8336	0.9004	0.8369	0.9090	0.8159	1.4347	0.9781	1.2416	0.9941	0.8241	1.0943	0.5903	1.0181	0.9025	0.6804	1.8072	1.0545	0.9496	1.2535	1.1912	1.0364	1.0483	1.1822	1.0392	1.1860	1.0228	1.3699	1.2609	1.1436	0.9831	1.1133	1.0794	1.1938	1.2660	0.6147	1.7185	0.7668	1.0258	1.1716	1.3852	1.1378	1.4534	0.5760	0.4625	0.9356	0.9170	0.7351	1.5169	1.0136	1.3462	0.9428	0.8474	0.9151	0.8139
2-keto-3-deoxy-gluconate	0.8387	0.7917	1.1234	0.7618	0.7848	0.9966	0.8791	0.9260	0.8600	1.5937	1.1424	0.8469	0.8805	0.7744	0.3978	0.7666	0.6877	0.8404	0.9548	0.8395	0.7705	0.7978	0.7721	0.8367	0.9589	0.8830	0.8739	0.8010	0.7944	0.9897	0.9754	1.0473	0.8393	0.6198	0.6644	0.7751	0.8612	0.5747	0.9103	1.2629	0.7868	0.6218	0.5731	0.5600	0.7910	0.9379	0.8255	0.7652	0.6643	0.9432	0.8888	0.7585	0.8010	0.8028	0.5265	0.4288	0.8776	0.9807	1.1428	1.6191	0.7801	1.0260	0.7640	1.0241	1.6358	1.6280	0.8078	0.8597	1.2688	0.4884	1.1843	0.9786	1.4524	1.0396	0.8460	0.8553	0.8650	0.9664	0.9839	1.0508	1.2537	1.0495	1.3573	1.2585	1.0762	1.1142	1.2003	1.1418	1.1637	1.1859	1.6194	0.9537	0.9545	0.8077	1.0747	1.2099	1.0261	1.0974	1.0458	1.2844	1.2348	0.9608	1.0768	1.2067	1.0032	0.7872	0.8207	1.4218	1.1623	0.6304	0.8707	1.5700
2-ketocaprylate	0.7596	0.9201	1.1393	0.9169	0.5907	0.7820	0.9305	0.7676	0.7554	2.4785	0.8055	0.5512	0.2881	0.7183	0.2532	0.7782	0.8457	0.9380	0.6519	1.0274	0.9345	0.9762	0.7556	0.8333	1.2462	0.9385	1.1261	1.2570	1.0911	0.8761	0.9736	0.9315	0.9623	0.4495	1.4520	1.2244	0.6171	1.2848	1.0183	0.6999	1.4200	1.0763	0.7731	0.5084	0.8554	0.7534	1.1686	0.4414	0.7198	0.7311	0.7549	0.3491	1.0003	0.6553	0.7879	1.0292	0.9588	1.2883	1.4867	1.1309	0.5337	2.2666	0.6628	1.1497	0.6095	1.1071	1.7412	0.6835	1.4449	0.7692	2.3685	0.6771	0.6701	1.3783	0.9875	0.8672	1.4875	1.2011	1.0771	1.0404	1.1917	0.9346	1.2902	1.1539	0.8569	0.9289	1.0301	0.7768	1.1865	1.1861	0.6839	0.6731	1.2360	0.8608	0.5484	0.5924	1.0622	1.3435	1.1121	0.7737	0.6985	3.1836	0.8502	1.0119	0.9355	0.9185	0.8006	0.9298	1.5527	0.8925	0.4633	0.7233
2R,3R-dihydroxybutyrate	0.7400	0.9178	1.0518	1.1502	0.4437	0.7632	1.3412	1.1466	0.7359	0.8623	0.7600	0.5823	0.7250	0.6690	1.2651	1.0356	1.0564	0.9985	1.0271	0.8013	0.9025	1.0132	1.0578	0.7056	1.4350	0.9894	0.7567	0.9370	0.8746	1.1107	1.0123	0.8584	0.7176	0.5194	0.9246	0.9310	1.3552	0.8979	1.1485	1.1167	0.6237	2.0807	0.9449	0.4580	1.5708	0.7581	1.5792	0.7879	1.1687	0.9122	0.5530	0.6385	0.7271	0.8023	0.4195	0.6039	0.8109	1.0605	1.0152	0.8842	0.8140	1.2947	0.8975	1.0558	0.9629	1.1836	0.6093	0.9151	1.1793	0.7115	0.7356	0.8777	0.4880	1.4535	1.2069	0.9045	1.1965	0.8544	0.9287	1.0940	0.9349	0.9276	1.1703	1.0706	1.0640	1.1323	1.0501	0.9023	1.0260	1.2277	1.2645	0.8819	0.8052	0.9014	0.5674	1.0739	1.2368	1.1958	0.8278	0.8112	0.6516	1.1063	1.1258	1.2203	0.8638	0.7897	0.8241	1.4905	0.7238	0.9590	0.5922	1.0238
2S,3R-dihydroxybutyrate	0.4856	0.6624	0.8419	0.7137	0.4418	0.5852	0.6807	0.6992	0.9592	0.9111	0.7625	1.5133	0.5116	0.7605	0.5574	0.6421	0.8635	0.4936	0.7895	0.8153	0.6487	0.7017	0.8718	0.4587	1.0468	0.5998	0.5531	0.9113	0.9305	0.8541	0.9194	0.8834	0.8513	0.6073	0.2597	0.5641	0.9954	1.1255	0.8449	0.9614	1.2197	1.5144	0.5881	0.2897	0.7600	0.8142	1.1225	0.9096	0.5576	0.8779	0.9946	0.5069	0.3977	1.2478	0.6440	0.9384	1.1041	1.1601	0.9036	1.0803	0.7139	0.9771	0.7961	0.9487	1.6241	1.4179	0.9551	0.9100	0.9390	0.4552	0.5069	1.3026	0.4200	1.2347	1.2024	1.1023	0.7692	1.2678	0.9281	1.2588	1.1381	1.2439	1.1882	1.4136	1.2200	1.3988	1.1575	1.0860	1.2683	1.1321	1.1485	1.2560	1.1377	1.0138	1.2404	1.1915	0.8748	1.4614	0.9361	0.9193	0.6969	1.0395	1.5517	1.1160	1.2918	1.4137	1.3914	1.9544	1.0834	0.9603	1.0541	1.3665
3-(2-methoxyethoxy)propanoic acid	0.8966	0.8906	0.9244	1.1689	1.1779	1.0384	1.1699	1.1164	0.6452	1.4450	0.6283	0.6705	0.5937	0.9117	0.7665	1.1388	0.9082	1.0908	1.3638	0.9260	0.9749	1.1354	1.2396	1.0714	1.0161	0.8808	1.1606	0.6952	0.9131	1.1082	0.9374	0.8795	0.7210	0.6417	1.4823	0.7519	0.6718	0.4962	1.2497	1.0638	0.7841	0.8056	0.9877	0.6698	1.0457	1.4054	1.5196	1.6550	1.1219	0.7106	0.8424	0.9844	0.8103	1.0987	0.4222	1.0177	1.2681	1.1592	1.3784	0.7621	1.0064	1.1158	1.9863	0.9931	0.9406	0.9517	0.9053	1.0939	0.6077	0.8955	0.9424	1.0121	0.6508	0.6898	0.7405	1.1153	0.8648	1.0763	1.2540	1.0418	1.2909	0.7556	0.9772	0.9795	0.8889	0.9778	0.9869	0.9606	0.9968	0.8566	1.2983	0.9438	0.8384	0.9544	0.6309	0.7641	1.1390	0.7777	1.8567	1.0633	1.6266	0.9946	1.0365	1.3590	1.0981	1.0020	0.7361	1.0336	0.8075	1.3266	0.5175	1.6247
3,4-dihydroxybutyrate	0.8306	0.8595	1.1510	1.1659	1.0034	0.8640	0.8935	0.8723	0.9622	0.5320	1.2740	0.8427	0.8806	0.7665	0.6101	0.7595	1.0944	0.9197	0.9104	0.9698	0.5955	1.0307	1.1411	0.9284	1.1231	0.8398	0.8835	1.0471	0.9603	0.9768	0.9558	1.0480	0.8710	0.8340	2.8135	0.6433	0.7190	0.8687	0.9785	0.9261	1.1794	0.5281	0.9540	0.5887	1.0942	0.9110	1.1648	0.7848	0.9813	0.9602	0.8069	0.7457	0.8133	0.6073	0.5643	0.7572	1.1485	0.9484	1.0012	1.0743	0.7524	1.3303	0.7782	1.1118	1.3835	1.4285	0.7833	1.1060	1.2227	1.3831	0.7717	1.4157	0.5180	1.3737	1.1526	0.9689	1.0938	1.2629	1.0464	0.9913	1.0920	0.9570	1.2045	1.1816	1.0489	1.0188	1.0737	0.9143	1.0028	1.0215	0.8677	0.6522	0.8905	0.8861	0.6935	0.6455	0.9896	0.8424	0.9957	0.7329	0.5488	0.9437	0.9441	1.1960	1.0548	0.9051	1.3081	0.9703	0.7785	0.8087	0.8629	0.8629
3,5-dichloro-2,6-dihydroxybenzoic acid	0.9436	1.0541	0.8864	0.8293	0.5171	1.3397	1.2155	0.9549	0.7544	0.9660	0.4431	1.1958	0.8211	1.1789	0.7367	1.1769	0.8554	1.1721	0.9201	0.7068	0.5962	1.0060	0.8464	0.8895	1.1784	1.2950	0.8942	0.8130	0.8889	1.1280	1.2192	1.3190	0.9933	0.5334	1.2551	0.9097	1.1614	0.8774	1.1472	1.0128	1.1882	1.3552	0.6594	0.3932	1.4577	0.7275	1.1096	0.0601	0.8653	0.8482	1.8797	0.7687	1.4215	1.3833	1.1889	0.1300	0.7822	0.8870	0.7096	0.6468	0.6877	0.6642	0.8475	1.0249	1.0346	0.8796	0.6795	0.4622	1.3041	0.9174	1.2483	0.5433	1.0550	0.9252	1.1933	0.8591	1.0893	0.7469	0.8326	0.9568	1.1163	0.9450	1.1525	1.0144	0.9597	0.8819	1.0539	0.9455	1.1639	1.4911	1.5337	0.7726	0.8892	0.7513	1.2067	1.1538	1.1478	0.7763	1.0062	0.6923	0.9279	1.2128	1.1506	1.3324	0.8410	0.8536	1.0454	1.0084	0.7742	1.2872	0.7653	0.4881
3-hydroxy-3-methylglutarate	0.7791	0.7731	1.2761	0.7759	0.8844	1.0027	0.8431	0.9988	0.8537	1.0066	1.3292	0.9311	0.7497	0.6820	0.7238	0.7682	0.8039	0.9221	0.8259	0.9181	0.6286	0.8470	1.4276	0.9607	1.1467	1.0127	0.9485	1.3865	1.0519	1.0631	1.0415	1.0255	0.9941	0.5965	1.3946	0.6738	0.9706	1.0587	0.9950	1.2186	1.3406	0.7455	0.8573	0.4316	0.8186	1.0696	0.8428	0.7108	1.0696	0.6228	0.9423	0.6309	0.9809	0.7324	0.3586	0.5954	0.8272	0.9086	0.7385	1.0131	0.7477	0.8989	0.7591	0.9142	1.1574	1.9856	0.6824	1.2778	1.3182	0.4194	0.7313	1.5432	0.6278	1.3015	0.8958	0.7561	1.0133	1.3361	0.8980	1.0768	0.9545	1.0189	1.2582	1.1384	1.1678	1.0057	1.0775	0.9718	1.0485	1.0390	1.3252	0.7067	0.7811	0.8390	0.7394	0.8446	0.8641	0.7751	0.9950	0.7629	0.5342	0.5259	1.0038	0.8292	0.9154	0.7692	1.2979	0.8986	0.6022	0.6118	1.0220	0.8482
3-hydroxyadipate	0.8322	0.6968	1.2186	0.7259	0.3189	0.8451	1.2236	0.9995	1.3450	0.7398	2.1446	1.0565	1.7951	1.1752	0.3980	0.8639	0.6812	1.0385	0.9197	0.5323	0.8393	1.0599	1.5502	0.9461	1.0943	0.8335	0.9337	1.0774	1.1953	0.8777	1.0231	0.9349	0.9913	0.9450	1.3429	0.5493	0.6204	2.4187	0.8573	1.6655	0.9587	0.5915	1.1358	0.6576	1.0089	1.1180	1.0839	0.7412	0.8221	0.1358	1.0360	0.4465	0.5491	0.6198	0.5576	0.6234	0.9132	0.8834	0.5648	0.9048	0.4787	0.9488	1.4519	0.9597	2.3877	0.9988	0.7436	0.6239	0.7650	0.5903	0.7499	5.7060	0.6346	1.3739	0.7996	0.7337	1.0252	1.3433	0.8673	1.0540	0.9005	0.8751	1.6236	1.1810	1.0924	0.9999	0.9024	1.1004	0.9718	1.1817	0.9540	0.6911	0.5013	0.5324	0.9365	0.5941	0.6696	1.0223	0.8026	0.2724	0.4743	0.7071	1.0798	1.0066	0.6494	0.7064	4.2654	1.0473	0.4297	1.4519	0.7328	0.4449
3-hydroxyhexanoate	0.8076	0.6813	1.0118	0.6934	0.3920	1.3195	0.8982	0.9963	1.1420	0.7215	1.2868	1.3744	0.9338	1.0443	0.8235	0.8227	0.6803	0.8202	0.8442	0.7503	0.8540	0.9678	1.4381	1.2384	1.0130	0.7811	1.1552	1.2255	1.2250	0.9466	1.2781	1.3229	1.5143	1.2212	1.1986	1.2180	1.0581	1.0004	1.1569	1.5517	1.4720	1.0222	0.9579	0.5996	1.3622	1.2457	0.7571	0.8383	0.8227	1.2207	1.0644	0.7778	0.6155	1.0394	0.8092	0.6856	1.1202	1.0201	0.8398	0.9090	0.4789	0.6880	0.7620	0.7010	1.4453	1.3166	1.0308	0.6570	0.7178	0.4419	0.8321	1.3791	0.4972	0.8166	0.8478	0.8032	1.0838	1.1047	0.8672	0.9931	1.0724	0.9074	0.9256	0.9991	1.0508	0.9599	0.8427	1.0672	1.0186	1.3465	0.9347	0.9878	1.1930	0.7764	0.8071	0.8258	0.8018	1.4742	1.1367	0.4264	0.5613	1.0120	1.1169	1.0077	1.0987	0.9688	1.1911	1.2447	0.6872	0.8044	0.9069	1.0940
3-hydroxyhippurate sulfate	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	NA	NA	NA	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	1.0000	NA	1.0000	1.0000	NA	NA	1.0000	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	NA	NA	1.0000	1.0000	NA	1.0000	NA	NA	NA	1.0000	NA	NA	1.0000	1.0000	1.0000	NA	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	1.0000	NA	1.0000	1.0000	1.0000	NA	1.0000	1.0000	NA	NA	NA	NA
3-hydroxyisobutyrate	0.9539	0.8463	0.9380	0.7902	0.5870	0.7041	0.8680	0.8622	1.0870	0.7001	0.6807	0.9350	0.7516	0.5914	1.2113	0.8361	0.7666	0.7931	0.7040	0.9662	1.0347	0.7708	0.6275	0.6984	1.1252	0.7404	0.8591	1.1694	1.0017	0.8389	0.8622	0.9980	0.5652	0.6340	1.0148	0.8900	1.4786	1.0723	0.8938	1.1529	2.1251	1.5007	0.8050	0.5037	0.6316	0.6693	1.4618	0.6604	1.1215	1.0714	0.7143	1.6542	0.6851	1.3658	0.7634	1.5969	1.0245	1.0606	1.2689	0.8082	0.7470	0.7838	0.9424	0.9556	0.6608	1.8849	1.1202	1.4763	1.1502	0.6002	0.6808	0.9185	1.2997	1.2533	0.7890	0.9358	0.6077	0.8889	0.7510	1.1566	1.0680	1.2394	1.0023	1.0730	1.1945	1.0903	1.0917	1.1797	1.1383	1.2776	0.6987	0.8775	1.4559	0.7114	0.4991	0.9191	0.8931	1.2466	1.5366	1.1717	0.6389	0.8403	1.1187	1.3406	1.0400	1.8736	1.0348	1.4682	0.8908	1.8379	1.2910	2.4569
3-methyladipate	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	NA	1.0000	1.0000	NA	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	NA	1.0000	1.0000	1.0000	NA	NA	NA	1.0000	1.0000
3-methylglutaconate	0.5143	0.5457	0.7842	0.6164	0.4885	0.6276	0.6607	0.8395	0.5108	0.7648	0.8330	0.5298	0.8992	0.4395	0.7598	0.5470	0.8822	0.6652	0.7979	0.6178	0.5001	0.6802	1.2802	1.0656	2.0098	0.8329	0.7457	1.4254	1.1867	2.1822	1.0997	0.9671	1.2439	0.3337	0.5921	0.7854	0.8118	1.3802	1.2084	1.9068	1.0739	0.5516	0.6235	0.4185	0.6002	0.6187	0.4646	0.5999	2.4090	0.6352	3.2737	0.4546	0.5274	0.4686	0.4109	1.2243	0.7555	0.7820	0.5668	0.4908	0.6173	0.4449	0.6103	0.9679	0.4603	0.7709	0.5025	0.5827	0.7975	0.2940	0.4795	0.6458	0.4689	0.9083	0.8424	0.8719	0.7826	1.2745	0.7013	1.3589	0.6164	1.0178	1.0078	0.9088	1.0096	0.8923	0.9507	1.2339	0.9734	1.1926	1.3930	0.7101	0.8037	0.5322	0.6694	0.7027	0.7473	0.5442	0.5475	0.4107	0.4581	0.3634	0.9408	0.5976	0.6797	0.9119	0.9819	0.5465	0.3993	0.4585	1.3834	0.5830
4-hydroxy-2-oxoglutaric acid	0.8042	0.6366	0.8318	0.9044	1.1260	0.7783	0.9990	0.7224	1.0004	1.1302	0.4366	1.0153	0.3171	1.2220	0.4552	0.7075	1.2084	0.6319	1.1839	1.7667	0.6712	0.9180	1.1182	1.1776	0.9804	0.9059	1.2110	1.0954	0.9286	0.9763	1.2392	1.1456	1.2261	1.1642	1.7718	1.3176	1.7644	1.2864	0.8063	1.0799	0.8790	0.8615	0.7102	0.7442	1.1209	0.9626	3.1587	0.7439	0.5355	0.9754	1.5781	1.5989	0.9138	1.0028	1.7095	2.7550	0.8745	0.5350	0.8477	0.9437	1.1392	0.7473	1.4693	1.0199	1.0813	0.8852	0.8126	0.9441	0.8090	0.7922	1.3886	1.2119	1.5922	0.9531	0.6964	0.8349	0.9114	0.8450	1.0210	1.1924	0.7931	1.1321	1.0753	0.9998	1.0810	0.8744	1.0725	1.0775	1.0331	0.9912	1.0494	1.0856	1.0304	0.8189	1.0246	0.9005	1.0218	0.7029	0.8897	1.0450	1.1183	0.5654	0.9347	1.3902	0.9895	0.8820	1.4923	0.5128	0.4818	1.3780	1.3767	1.7217
4-ureidobutyrate	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA
5-acetylamino-6-amino-3-methyluracil	0.6311	0.7283	0.5811	0.2687	0.0953	1.8559	0.6461	0.3796	0.4339	1.1755	1.3331	0.3909	1.4008	0.1137	0.1628	0.3384	0.9683	0.7137	2.5947	0.8903	1.2970	2.0311	1.1441	1.4861	0.8380	1.1061	0.7886	1.2440	1.2207	0.9865	1.0245	0.9607	0.8524	1.5228	1.2653	0.7369	0.1070	1.1553	1.0202	0.5237	0.8143	0.1786	0.3178	0.2261	2.0343	1.0634	0.9249	1.4950	0.8920	0.8967	1.8391	0.1360	0.4966	0.4843	0.2207	0.3953	0.5850	0.4618	0.6272	0.5559	0.3207	0.3710	0.4821	0.4353	0.1398	0.3588	0.3789	0.7320	0.2083	0.7825	0.3439	0.4020	0.1196	0.9878	0.9282	0.8394	1.5998	2.3272	1.6690	1.5543	1.2519	1.0531	1.1626	1.1960	1.0354	1.0249	0.8806	1.0375	1.3404	1.1561	1.5502	0.6095	0.3386	0.5085	1.1085	1.0693	1.8605	1.0440	1.0054	0.0289	1.0192	1.4240	0.6733	0.6071	0.6668	1.0524	0.4530	0.7847	0.0568	1.7885	0.2738	0.5259
5-acetylamino-6-formylamino-3-methyluracil	0.6219	0.7495	0.6235	0.3216	0.3016	0.7238	0.4531	0.6175	0.5671	1.1380	0.9328	0.2654	1.2553	0.3927	0.1070	0.4339	1.7876	0.7240	3.3590	1.0746	0.6671	1.6516	1.0741	1.3636	0.6957	0.9931	0.9099	1.3471	1.2603	0.8420	0.9763	0.8238	0.8759	2.7462	0.6607	0.8384	0.0993	1.9921	0.5349	0.4204	1.5589	0.4264	0.5827	0.0851	3.8213	0.5347	0.4105	3.5210	1.1819	0.4500	1.9059	0.2866	0.5986	0.1961	0.3098	0.0812	0.5849	0.7011	0.6436	0.6051	0.3343	0.6539	0.4484	0.3640	0.5342	0.3099	0.5485	0.4522	0.5579	0.5867	0.3117	0.3588	0.2713	0.7081	0.7619	1.2734	2.8736	2.2001	1.3478	2.3309	1.1919	1.0337	1.1283	1.4860	1.0068	0.6884	0.8666	0.7231	1.5083	0.6539	0.6381	0.1218	0.5249	0.4148	0.7963	1.1906	2.0735	0.8111	1.7380	0.3621	0.4435	1.7711	0.6298	0.3418	1.2508	0.6258	0.4823	1.4256	0.1308	1.8581	0.1884	0.5739
allantoin	0.8328	0.7639	0.9011	1.0166	1.0562	0.8568	0.9392	0.8664	0.9979	1.3408	1.1444	1.0058	0.6771	0.9609	0.6988	0.9441	0.8285	0.8337	0.8199	1.1636	0.9035	0.8497	0.9711	0.9250	1.0330	0.9688	1.0352	1.0367	0.9311	0.9980	1.0354	0.9830	1.0930	0.8024	0.8692	0.8858	1.3065	1.3338	0.8377	0.9669	0.9166	1.0473	0.8496	0.7509	1.0076	1.0275	1.0463	0.9790	0.8671	0.9622	1.2354	0.9592	0.6537	0.9641	0.8404	1.1299	0.9592	0.9640	0.9287	1.1002	0.9069	1.0220	1.1659	1.0391	1.2324	1.0347	0.8831	1.2659	1.2461	1.2768	1.0790	1.1069	0.7369	0.9997	0.9169	0.8387	0.8533	1.1032	0.9520	0.9774	0.8986	1.1150	1.2560	0.9118	1.1161	1.0218	1.1386	1.0281	1.0515	1.2371	1.2659	1.2755	0.8697	1.0364	1.1295	0.9142	1.0466	0.9575	1.2015	0.9283	1.0885	0.7907	1.0686	1.1995	1.2637	1.0322	1.1144	1.0319	1.0904	1.2626	0.8342	0.9286
allo-threonine	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	NA	NA	1.0000	1.0000
alpha-ketobutyrate	0.9843	0.7337	0.8483	0.8257	0.3991	0.8003	0.7378	0.8247	1.2321	0.7285	1.4133	1.4037	0.6181	0.9781	0.9530	0.8927	1.1335	0.4784	0.9046	1.0722	0.8927	0.7757	0.8248	0.5994	1.1998	0.7058	0.8479	0.9386	1.2331	0.9361	0.9795	1.0465	1.5527	0.6284	0.4175	1.1245	0.8902	1.5918	0.9489	0.7680	1.2113	1.1713	0.6000	0.9638	1.1808	0.9669	1.8162	1.6341	0.8248	0.9624	1.3497	2.1896	0.7478	1.7911	0.9047	2.2030	1.1349	0.8765	0.9206	0.7977	0.8076	1.1036	1.0431	1.0002	0.7116	0.8647	0.7571	1.0084	0.9433	0.6645	0.5545	1.4843	0.9314	1.2600	0.7649	1.1160	1.0930	1.1055	0.7848	0.9634	0.9050	1.1751	0.9915	0.9769	1.0230	1.2382	1.1135	0.9453	0.9774	0.8113	0.6605	1.0183	1.5062	0.8254	0.4684	0.6965	1.1368	0.8785	1.0924	1.7213	0.5057	1.0074	1.7497	1.4832	1.0143	1.6196	1.1278	1.3634	0.6985	1.9160	1.3655	2.1714
alpha-ketoglutaramate*	0.8659	0.8016	1.1631	0.8418	0.6172	0.7390	0.8685	0.8493	0.8452	1.2266	1.0495	0.7415	0.7014	1.0236	0.6787	0.9368	0.8527	0.8671	0.8827	0.9255	0.8919	0.9371	0.9109	0.8201	1.0827	0.8850	0.8716	0.9342	0.9149	0.9722	1.0529	0.9477	1.1463	0.6529	1.2356	0.9749	1.1549	0.9737	0.8924	1.0728	0.8389	1.0285	0.8012	0.4448	0.7601	0.9216	0.9595	0.6788	0.7802	0.8495	0.8827	0.6365	0.9468	0.9522	0.4497	0.5554	0.8322	1.0858	1.0845	1.0133	0.9360	1.0751	0.8172	1.0584	1.0105	1.2288	0.8080	1.2509	1.2361	0.5945	0.8893	1.1352	0.7838	1.3063	1.0493	0.7550	1.1222	1.0970	0.9428	1.1323	1.0145	1.1016	1.1929	1.0767	1.2129	1.1713	1.0205	1.0135	1.1506	1.2954	1.2339	0.9835	0.9354	1.0587	0.9464	1.1123	1.0444	0.9525	0.9574	0.7995	0.9410	1.0966	0.9782	1.1348	0.9951	1.0067	0.9833	0.9601	0.9183	0.8748	0.8301	0.9991
alpha-ketoglutarate	1.1665	0.9990	1.3691	0.9841	0.8405	1.0973	0.8685	0.9975	1.3978	0.8755	0.9794	1.1313	1.0882	0.8959	0.8359	0.7614	0.9716	0.9468	1.0035	0.9229	0.6399	0.8769	1.0426	0.9490	1.0065	0.9583	0.9070	1.0252	0.9947	0.9487	1.0609	1.1184	1.1199	1.0518	1.4200	0.9209	0.8377	1.0275	0.9486	1.1111	1.3221	0.8696	1.1139	0.5921	0.9441	1.1350	0.9253	1.0824	1.0015	0.8666	1.6193	1.0854	0.9415	1.1213	0.6647	1.1759	0.9987	0.8952	0.8477	1.0367	0.8051	1.0283	1.3857	0.9590	1.1164	1.7403	0.8755	0.9635	1.3324	0.5906	0.9050	0.9847	0.6420	0.7467	1.0613	0.8793	0.8390	1.0825	0.7846	0.9848	0.9772	0.8270	1.2150	1.0111	1.0086	0.9669	0.9765	1.0156	1.0486	0.9445	0.7961	0.8136	0.9848	0.7405	0.7653	1.0331	0.9861	0.8322	1.2599	1.1364	0.7703	0.8123	1.0437	1.7287	1.6835	0.7325	1.0696	2.0979	2.1811	0.8324	0.7942	1.0375
arabinose	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	NA	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	1.0000	NA	NA
arabitol/xylitol	0.7738	0.7903	0.9934	0.8546	1.0432	0.8833	0.8816	0.8277	0.7528	1.3033	1.1824	0.6305	0.8503	0.7160	0.4958	0.6855	0.9204	0.8853	0.8862	0.9025	0.7494	1.0020	1.1165	0.7920	1.1016	0.9373	0.8776	1.1862	1.0461	1.0293	0.9233	1.0309	1.1325	0.7002	1.3966	0.7870	0.9793	0.8443	0.9315	0.8982	0.9653	0.8871	1.0102	0.4805	1.1764	0.9226	1.0061	0.6381	0.7981	0.7389	0.8501	0.7521	0.6927	0.7663	0.7428	0.5648	0.8004	1.1267	0.8616	1.0873	0.7680	1.2190	0.7447	1.1695	1.3498	1.1115	0.7036	1.3994	1.1902	0.5314	0.8021	1.1549	0.6662	1.3505	0.9205	0.8198	0.9787	1.1277	0.9837	0.9920	1.0585	1.1051	1.4253	1.0546	1.2055	1.0458	1.0341	0.9654	1.0486	1.1718	1.2618	1.2759	0.8174	0.9122	0.9228	0.8335	1.0094	0.7709	2.9261	0.7334	0.8531	0.9758	1.0201	1.7620	0.8834	0.8717	1.1042	0.8934	0.7396	0.7815	1.0021	0.8659
arabonate/xylonate	0.6700	0.6244	0.9309	0.7876	0.8479	0.8013	1.0809	0.6036	0.7398	1.1094	1.1306	0.6226	0.6108	0.9737	0.5639	0.6857	0.8918	0.6815	0.7278	1.0217	1.1484	0.9817	1.1577	0.8209	1.2835	0.9803	0.8997	1.1909	1.2457	1.0693	0.9598	1.3238	1.5194	0.6512	0.8666	0.9180	1.1496	0.8226	1.0876	1.0813	1.2060	0.8056	0.7144	0.2932	1.1850	0.9034	1.2466	0.5949	0.7669	0.8964	0.8255	0.8543	0.9787	0.7128	0.6799	0.7399	0.6217	0.9697	0.7823	1.0501	0.6972	0.9368	0.7194	1.1419	1.0874	0.5846	0.4924	1.7753	1.3750	0.5367	0.8932	1.6696	0.6077	1.0851	0.7292	0.7667	1.4582	0.9529	0.8262	0.8321	1.0806	1.1782	1.8447	1.0402	1.2555	1.0030	0.9995	0.8986	1.0398	1.3569	1.2486	0.7615	0.7475	0.9405	0.8608	0.7348	1.1327	0.6244	1.0425	0.6743	0.8575	0.4086	0.9488	2.3772	0.7643	0.7625	1.0253	0.7421	0.5794	0.4531	0.6578	1.4272
ascorbic acid 2-sulfate	0.7777	0.6021	0.9511	0.6656	0.7578	0.9070	0.8972	0.8613	0.9323	1.8392	1.3453	0.9240	0.4613	1.1015	0.3509	0.9381	1.0361	0.6522	1.3655	1.3677	1.0430	1.0223	1.1445	1.0602	1.2488	0.8366	1.0328	1.0293	1.2459	1.1009	1.1343	1.0938	1.1223	1.0639	1.0220	1.1017	2.6730	0.9416	0.9707	1.3957	0.8871	1.1379	0.8277	0.4234	1.0062	1.0476	1.2718	0.5447	0.6827	1.0727	0.9050	0.7314	1.1835	0.8777	0.8542	1.0496	0.7455	0.9478	0.7199	0.8618	0.8481	0.5481	0.9162	0.9289	1.7221	0.7035	0.6921	1.1596	0.8371	0.3378	1.0979	1.1030	0.8412	0.8506	0.7135	0.5965	0.9521	1.1677	0.8816	1.1432	0.8738	1.0825	1.1612	1.0615	1.1385	1.1230	0.9315	1.1134	0.8756	1.4385	1.0476	0.6420	1.1017	0.9638	1.1409	0.8159	1.2480	0.7761	0.7977	0.9800	0.7620	0.1939	0.9988	0.8342	0.9164	0.7240	0.6148	0.4901	0.7105	0.7937	0.6568	0.9470
beta-hydroxyisovalerylglycine	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA
carboxysuccinate	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA
chiro-inositol	NA	1.0000	1.0000	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	NA	1.0000	NA	NA	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	NA	1.0000	1.0000	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	NA	NA	1.0000	1.0000	NA	NA	NA	NA	NA	NA
citraconate/glutaconate	0.1868	0.1808	0.1968	0.4305	0.3072	2.4776	0.6303	0.1560	0.1886	0.2190	0.6496	0.0983	0.1414	0.1415	0.1086	0.1493	1.6786	0.1756	0.5924	2.9333	0.2139	2.0734	1.8764	2.6749	0.4010	1.9771	0.2464	2.8102	0.3934	0.4715	0.5146	2.5863	0.3649	1.1357	0.2146	0.7498	0.1219	0.2724	1.4059	0.1245	2.1425	0.0944	0.1706	0.0675	2.7700	1.4327	0.2755	0.3573	0.1190	0.4328	0.1807	0.2137	0.3023	0.1325	0.0642	0.1870	0.4311	0.2536	0.2196	0.6210	0.1879	0.2032	0.1743	0.6829	0.1354	1.6198	2.2211	1.7224	2.8605	0.1175	0.1475	0.3173	0.0966	0.5328	1.8279	1.4487	3.8155	3.2499	0.9551	1.0354	2.6795	0.4315	1.3502	0.6601	1.9228	0.7003	0.4373	0.6046	2.1070	0.2623	0.2599	0.1567	0.1889	0.2606	0.2061	0.0983	1.6090	0.1960	2.3074	0.1594	0.2270	0.1702	0.2398	0.3266	1.2016	1.0245	0.5437	0.1975	0.2105	0.4591	0.2306	0.2138
cysteine s-sulfate	0.7699	0.9541	1.0040	0.9621	0.7632	1.0659	0.7918	0.9594	0.9492	1.0328	0.7282	0.9473	0.9785	0.7463	0.9432	0.9317	0.8449	1.0941	0.9885	0.9318	0.7127	1.1470	0.9779	0.8216	0.9287	0.9803	1.1352	0.9592	0.8444	1.0762	1.0500	0.9241	0.8769	0.9578	2.1249	0.5785	0.8571	0.8981	1.0508	1.1141	1.0978	0.9968	1.2410	0.7491	1.2756	0.9351	0.6044	0.7981	0.9014	0.8309	1.1080	1.0694	0.6822	0.7135	0.5819	0.7434	0.7963	1.1598	0.8839	0.9034	0.9244	1.3357	1.2374	0.9773	0.9604	1.3093	1.0875	0.9395	1.1935	0.7794	0.9236	0.9129	0.9994	1.4559	1.2753	1.0089	1.0368	1.1615	1.0530	1.1338	0.9952	0.8436	1.2019	0.9960	1.0647	0.9046	1.0625	1.1358	1.1234	1.2220	0.7671	0.8465	0.7969	0.9519	0.9641	1.0708	0.9386	0.9890	1.1652	0.6710	0.9566	0.7580	0.9218	0.9954	0.7389	0.7848	0.8906	1.4408	0.7860	0.6370	1.0840	0.9320
decadienedioic acid (C10:2-DC)**	0.8943	0.5503	1.8055	0.6521	0.3681	0.6366	1.0953	1.2919	0.7207	0.3772	1.1405	0.8432	1.1058	0.5788	0.8377	0.7177	1.0332	1.1114	0.5108	0.5333	0.6985	1.0116	1.1696	1.3546	0.6713	1.2427	1.0226	1.8494	1.3170	1.0862	1.4638	1.3447	1.1197	1.3557	0.2668	0.6033	1.0008	0.2353	1.3036	1.7081	0.8286	0.2144	1.9281	0.0840	0.8470	1.9905	0.3335	0.2856	1.1736	0.8051	1.1554	0.2090	0.8250	0.5457	0.8452	0.6703	1.4106	1.3555	0.8331	0.5898	0.4663	0.7333	0.5284	0.5897	1.7630	0.7500	0.4813	0.3723	0.8709	0.3644	0.9015	0.8239	0.3495	1.6843	0.9800	0.8377	0.8672	1.5971	0.7321	0.9030	0.7452	0.6512	1.3679	0.8912	1.0484	0.9215	0.7867	1.1756	0.7798	0.9090	0.8516	0.6380	0.4340	1.0822	0.9689	0.9510	1.0976	0.9515	1.6622	0.3996	0.3209	0.7983	1.1266	1.4889	0.7220	0.5885	0.9707	0.9935	0.8718	0.5626	0.4722	0.4651
dihydrocaffeate sulfate (2)	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	NA	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000
dihydroorotate	0.6596	0.7394	0.8697	0.8753	0.6659	1.2719	0.5728	0.8732	1.0042	1.3030	0.6028	0.7533	1.1278	0.5598	0.8557	0.8493	0.8003	0.7193	0.6786	1.0332	0.7263	0.8822	0.9357	0.7927	0.8754	1.1129	1.1412	0.9912	0.8015	1.0765	0.9361	1.0978	0.5877	0.5004	2.1163	0.7513	1.1691	1.0282	0.8731	1.1664	1.1767	1.2033	1.1358	0.7922	1.0157	0.8218	0.8741	0.8772	0.6691	1.0735	1.6951	0.6078	1.0377	0.7163	0.6405	0.7326	0.6857	0.6409	1.1610	0.8290	0.7781	0.8530	0.8837	0.8198	0.8774	1.2590	1.1078	0.5231	1.1054	0.4049	0.8695	0.4969	0.8716	1.0970	0.9514	0.8962	0.9248	0.9184	0.9659	1.1849	1.2380	0.7740	1.2908	1.2192	1.1715	0.9624	1.1707	1.2428	1.2850	0.8089	0.9797	1.1215	0.8240	1.2398	1.2479	2.1368	0.8681	0.8308	0.9421	1.4269	1.0332	0.8941	1.2196	1.3219	1.0861	0.9381	0.9738	2.5089	1.9674	0.4223	1.2074	0.8899
erythritol	0.4489	0.4394	0.6319	0.4626	0.2538	0.4363	0.5542	0.6615	0.4526	0.6688	0.7713	0.4057	0.4234	0.4983	0.3788	0.4212	0.5317	0.4935	0.5028	0.4755	0.3767	0.5461	0.6403	0.5074	4.0966	0.4907	0.4867	1.1813	0.5858	0.6377	1.3769	3.7389	0.7883	0.3669	1.0783	0.8117	0.6283	0.4625	14.4637	0.5825	0.4418	0.4166	0.5293	0.3436	0.5625	0.6856	0.5583	10.0244	0.5009	0.4866	0.6467	0.5012	0.4077	0.4582	0.4214	0.3576	0.3740	0.5338	0.4972	0.5726	0.4051	0.5347	0.3686	0.6132	0.6156	0.5341	0.4163	16.6469	0.5706	0.3327	0.6046	1.0248	0.4666	1.0690	0.4594	0.5293	0.5432	0.5542	0.4940	0.6054	1.5161	0.5544	0.6582	0.5675	0.6057	0.5609	0.8636	0.6569	0.5568	0.5352	0.6633	0.6663	0.3944	0.5103	0.6272	0.3948	0.4959	0.4874	0.5979	0.4299	0.4613	0.6012	0.6550	0.5237	0.4383	0.4445	1.5986	0.5193	0.4537	0.4224	0.4381	0.6142
erythronate*	0.8662	0.8487	1.0937	0.8099	0.6026	0.8625	0.9944	0.8097	0.8844	1.1765	1.2358	0.8161	0.8239	0.8276	0.7677	0.7784	0.9481	0.8972	0.9263	0.8764	0.7637	0.9648	1.1710	1.0105	1.1671	0.9118	0.9286	1.0357	0.9590	1.0331	1.1107	1.1245	0.9677	0.7625	1.8181	0.7645	1.1103	0.8631	1.1858	1.0772	0.8310	0.7390	0.9359	0.5350	1.0215	1.2273	1.0318	0.8528	0.7962	0.8777	1.2659	0.8647	0.8281	0.9032	0.7183	0.7595	0.8161	0.9791	0.9308	0.9865	0.7478	0.9352	0.8414	1.0231	1.2971	1.0988	0.7750	1.5455	1.1414	0.6749	1.1907	1.6837	0.8482	1.2370	0.9303	0.8844	0.9856	1.0660	0.9097	1.0662	1.0551	0.9791	1.1920	1.0531	1.0835	1.0231	0.9693	1.0177	1.0464	1.0964	1.2533	0.7878	0.8015	0.9300	0.7957	0.7792	1.0326	0.9420	1.0875	0.9657	0.8776	1.0471	1.0908	0.9105	0.8911	0.8789	1.2165	0.9569	0.9624	0.8026	0.7883	1.1447
ethylmalonate	0.8826	0.6157	0.7769	0.9157	0.8590	0.6790	0.8526	0.5848	0.5959	0.5305	0.7015	0.9737	0.5683	0.6780	2.2932	0.6540	0.8372	1.2681	1.0502	0.7359	0.8697	1.0757	1.4803	1.0969	2.0418	1.6568	0.9456	1.3064	1.0888	1.0991	0.9576	1.1859	1.4989	0.9378	2.5141	0.6791	0.9057	0.6110	1.0271	0.8080	1.2104	0.3633	0.6671	0.3836	0.9859	0.7104	1.0305	0.5392	1.1849	0.7943	0.4969	0.4917	0.4792	0.5755	0.8141	0.5578	0.6597	0.6311	0.6083	0.6627	0.5258	0.7317	0.7288	0.7045	0.7344	0.6671	0.6796	0.7126	0.7388	0.4391	0.6543	0.5142	0.4775	1.3684	0.8941	0.6507	0.8287	0.8867	0.8172	1.0960	1.2377	1.0349	1.0834	1.5088	1.0921	1.2092	0.9551	1.0497	0.8521	0.7381	1.8348	0.9967	1.6600	0.8150	1.1696	0.6586	1.2373	0.5633	0.8150	0.4902	0.4121	0.9243	0.8972	1.0664	0.8450	0.9017	0.8906	0.8343	0.7337	0.7085	0.6470	1.9709
fructose	1.4245	0.7607	0.8479	1.4973	0.5821	0.6044	1.5781	0.7198	0.8489	0.5745	0.8430	0.6040	0.7906	1.0486	1.0454	0.8015	1.0273	0.8559	0.6999	0.8181	1.4371	0.7692	0.7046	1.6667	1.5646	1.2340	0.6721	1.5561	1.0612	0.8472	0.9763	0.8638	0.9128	0.5679	21.0040	1.1418	0.6336	0.4988	1.2087	0.6839	0.6576	0.6716	0.7780	0.9601	0.7608	0.7898	2.5393	0.6285	0.7373	0.7629	0.5106	0.6161	0.7268	0.7306	0.4725	1.0350	1.0113	1.0165	1.0812	1.1385	0.6014	0.9026	1.5300	0.9943	0.9831	1.8880	0.9709	1.5458	0.8986	1.1937	1.0896	1.4103	0.8860	0.8463	0.6465	1.2209	0.6372	0.7539	0.7300	0.5222	0.9126	1.7769	1.7264	0.7755	1.0510	0.8235	0.8567	0.6916	0.7479	0.5505	2.8442	1.1525	0.7897	1.6626	0.6012	1.0600	0.9565	0.6919	0.8120	1.0129	0.6686	0.3738	0.8296	1.0452	0.7884	0.9015	1.2344	0.6401	2.6352	1.6114	0.4408	1.2622
fumarate	0.8898	0.8057	1.2624	1.0426	0.8719	0.9597	0.8800	0.8704	1.1245	1.0543	0.7909	1.1827	1.0383	0.7794	0.9140	0.8546	0.7349	0.7783	0.7304	1.1013	0.9224	0.8520	1.4682	0.9160	0.9377	0.9142	1.1366	1.0344	0.9659	0.9528	1.2028	1.1222	0.8694	1.1278	1.9362	0.9063	1.6666	0.7892	1.0451	1.3498	1.5004	0.8514	1.0817	0.7354	0.7881	1.1610	0.7476	0.7790	0.7405	1.0421	1.5600	0.8565	1.0910	1.0267	0.7982	1.0031	0.8898	0.8371	0.8587	1.2784	0.7784	1.0852	0.8526	0.9562	1.4447	1.5230	0.9094	1.4116	1.4612	0.5694	0.8955	1.1395	0.9130	0.7364	0.9678	0.8775	0.8804	0.8629	0.8834	1.1146	0.9516	0.8085	1.0673	1.0673	1.1401	1.0302	1.0235	1.1329	1.0059	1.1808	1.0589	1.1650	0.8481	0.9117	1.1551	1.0203	0.7125	0.7364	1.1018	0.6476	0.9643	0.8163	1.0137	1.1442	0.9711	0.8611	1.1762	1.0290	0.7452	0.7343	0.8818	1.1600
galactonate	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000
gluconate	0.9066	0.9282	0.9784	0.9376	0.3215	1.0712	1.2248	0.8581	1.3408	0.9450	1.3098	0.8899	1.5972	1.0452	1.0141	1.1321	1.0267	0.8754	0.9360	0.9685	1.1183	1.0438	1.0272	1.0099	1.3286	1.0874	0.8930	1.0385	1.1738	1.1665	1.1755	1.1016	1.0311	0.8318	1.0706	0.8030	1.7252	1.0667	0.9778	0.9380	0.7864	0.6709	0.8154	0.7184	1.2433	1.2875	1.5669	0.9405	1.0503	0.7685	0.8108	0.7796	0.9368	0.9280	0.7571	1.3303	0.7392	0.8873	0.7709	1.7542	1.0624	0.7813	0.8712	1.1415	1.3319	1.3959	0.6696	1.4053	1.3837	0.6034	0.9811	2.0422	1.1528	0.8253	0.6840	0.8758	0.9757	0.9793	0.8520	0.8259	0.9348	1.0455	1.2327	0.7482	0.9608	0.9710	0.8914	0.9918	0.9361	0.9976	1.0097	0.7017	0.7152	0.8408	0.7317	0.6474	0.8546	0.8062	0.7348	0.7133	0.7636	0.5654	0.9633	0.8856	0.8392	0.8396	0.7602	0.4430	0.7182	0.8646	0.9088	1.0968
glucose	1.0056	0.9711	1.0009	0.9530	0.8997	1.0268	0.9661	1.0109	1.0968	0.7518	0.9450	0.9503	1.0023	0.9980	0.9976	0.9479	1.0700	0.9829	1.0073	0.8909	0.9285	0.9352	0.8778	0.8650	1.0027	0.9938	0.8520	0.9910	0.9858	0.9711	0.9816	0.9856	1.0308	0.8836	1.2328	0.8973	0.8952	1.0978	1.0138	0.8416	0.9126	0.9653	0.9217	1.0126	1.0779	1.0885	1.4585	1.1643	0.9858	0.8987	0.8871	1.0505	0.8467	0.9723	0.8775	1.0043	1.0694	0.9933	1.0344	1.2662	0.9959	1.0497	1.0166	1.1056	0.9219	1.5728	0.8407	0.9175	1.0953	0.9381	0.9638	0.8943	1.3046	1.0910	0.9510	1.1500	1.0243	1.0028	0.9507	0.9574	1.1390	1.0337	1.0588	0.9652	1.0018	1.0099	1.0262	0.9828	1.0398	0.9250	0.8793	0.8777	1.0317	0.8913	0.7971	0.9080	1.0027	1.0789	1.1653	1.0840	1.0053	0.8357	1.0397	1.1045	1.0147	1.0464	1.0231	0.8896	1.1001	1.1027	0.8712	1.3419
glucuronate	0.8053	0.8232	0.9270	2.9452	1.2547	1.6596	1.0367	0.7289	0.7096	0.7998	0.9057	0.7002	1.6986	1.0694	0.5006	0.6504	1.1575	0.9161	0.7065	1.0732	0.5440	0.9917	1.1192	0.9960	1.0271	1.4409	0.7575	1.0742	1.0580	0.7947	1.1735	1.1630	0.8568	1.8876	1.1553	0.8604	0.4670	0.6733	0.8790	0.7281	0.7046	0.6725	0.9889	0.4354	1.9961	0.8464	0.9770	1.3177	0.9676	0.5446	0.7418	0.4445	0.8695	0.4767	0.3124	0.6282	0.9101	1.8614	0.8556	1.0243	0.5273	1.7877	0.7122	0.8951	0.7777	1.0356	0.6989	1.0764	1.1202	0.5149	0.7771	0.8891	0.7055	2.4999	1.2961	0.7501	1.2943	1.1088	0.8142	0.8913	0.8850	0.8515	1.8556	0.8949	1.0169	0.9330	1.0671	1.0979	0.8428	0.8819	0.4552	0.5917	0.7909	1.6617	0.5080	0.4745	0.9285	0.9219	0.9039	0.6143	0.5494	0.7928	0.9060	0.7137	0.7282	0.7989	1.0026	0.8081	0.4809	0.7408	1.1444	0.6010
glutarate (C5-DC)	2.1658	1.1466	2.1952	1.0904	0.3436	0.5413	0.8994	2.8614	2.1937	2.9018	0.7865	0.8203	0.8196	0.6752	2.5823	1.3770	0.5161	0.5077	0.4537	0.4126	0.3007	0.4924	1.4050	0.5183	0.9420	1.0473	0.7857	0.9705	0.6266	0.6099	0.8118	1.0361	0.4565	0.3801	1.8518	0.4990	0.5590	0.3614	1.2839	0.7570	0.6801	0.2555	2.2018	2.1926	0.5596	1.9616	1.1456	1.3683	1.5043	0.5613	1.7898	0.5715	0.5088	0.5110	0.2687	0.6957	1.6277	1.2514	1.0032	3.3682	1.4837	3.4564	1.0153	1.3942	1.3010	1.1579	4.7221	6.9954	1.5462	2.5225	0.5654	1.0899	0.5992	1.1744	1.5865	0.5241	1.1473	0.5581	0.7889	0.6000	0.7695	0.5716	1.1430	0.8663	0.9488	0.6884	1.1060	0.8007	0.5874	0.6147	3.2963	0.6183	0.6165	0.7200	1.8553	0.7653	0.6338	1.0356	0.8692	0.5017	0.3459	0.6652	0.7994	2.9420	1.2580	0.3958	0.8249	1.5079	0.7175	0.4779	0.6424	0.9807
glycerate	0.7701	0.6924	0.7281	0.6887	0.5710	0.7966	0.9564	0.7370	1.0260	1.5615	1.1187	1.3303	0.4361	1.0834	0.5887	0.9612	0.8730	0.6384	0.8831	1.4488	1.1926	0.8796	1.0729	1.1541	1.1166	0.8160	1.1616	1.1141	1.1081	1.0176	1.1496	1.1890	1.0849	1.1775	1.3083	1.2271	2.2534	1.4951	1.0980	1.2528	1.0142	1.1759	0.6851	0.4583	0.7163	1.0388	1.1526	0.6863	0.5705	1.0579	1.1609	0.9512	0.9855	1.1665	1.3021	1.5808	0.9317	0.7739	0.8060	0.9396	0.7090	0.6196	1.3232	0.8840	0.9932	0.8272	0.6686	0.9139	0.8888	1.4004	0.9295	0.8573	1.0958	0.7706	0.6919	0.6281	0.7834	0.9436	0.8687	1.0005	0.8232	1.0950	1.2092	0.9663	1.2190	1.0064	1.0176	1.0973	1.0481	1.1579	1.2619	1.2967	1.2896	1.1698	1.1315	0.9838	1.0265	0.7233	0.8850	0.8772	1.0508	0.3816	0.9694	0.5663	1.2675	1.0442	0.9985	0.7395	0.8118	1.0698	1.3839	1.3897
glycolate (hydroxyacetate)	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA
guanidinoacetate	1.0098	0.9105	0.9314	0.7757	1.1573	1.4576	0.8457	1.0046	0.8239	1.4676	0.6631	0.7150	0.8345	1.0611	0.8306	0.7416	0.8398	1.0661	0.9494	1.1151	0.8327	0.9463	0.8563	0.9861	0.7934	0.8018	1.0958	0.8971	0.8653	0.8212	0.8330	0.8235	1.2318	1.1077	1.3400	1.0537	0.9553	0.7295	0.8292	0.7859	1.0194	0.7409	1.0596	0.8512	0.7033	0.9324	0.7649	0.8435	0.6943	0.9110	0.8255	0.5450	1.0187	0.6222	0.8736	0.4925	1.2197	1.3287	1.2080	1.2284	1.2282	1.0956	1.4433	1.2015	0.9014	0.8524	1.2306	0.9502	1.2057	0.9870	0.9439	0.7943	1.5855	0.8352	1.0682	1.0415	1.0955	1.2613	1.1548	1.0656	1.1666	1.0025	0.9717	0.9256	1.2229	1.0408	1.0719	1.0945	1.0816	1.3008	0.9944	1.1454	1.0617	0.7747	1.1239	1.0854	1.1517	1.1168	1.3368	1.2021	1.3800	1.4020	0.9788	0.9671	1.3897	1.0452	1.0171	1.0892	0.9138	1.5798	0.9708	0.7630
gulonate*	0.8040	0.9050	1.3468	0.9025	0.8455	1.0437	0.9762	0.9466	0.8426	0.9502	1.3924	0.6936	1.3345	0.8459	0.7720	0.7988	1.0288	1.2581	0.8764	0.8568	0.6595	1.0958	1.1128	1.1056	1.0831	0.9417	0.8131	0.9346	0.9429	1.0423	1.0823	1.1512	0.8700	0.5922	1.3737	0.6139	0.8727	0.7090	0.9397	1.0154	0.7564	0.8563	1.1403	0.6694	1.0081	0.9959	1.0245	0.5383	0.7221	0.6607	0.7761	0.5276	0.8116	0.5376	0.4837	0.5183	0.8769	1.3052	0.9560	1.0598	0.8370	1.3536	0.8902	1.2163	1.5273	1.0802	0.7521	1.4737	1.1062	0.5545	1.1374	1.4267	0.9434	1.4053	0.9453	0.7102	1.1642	1.0182	0.9765	1.1047	0.9211	0.9280	1.4686	0.9911	1.0432	1.0373	1.0309	0.8959	1.0402	0.9865	1.4491	0.6482	0.6413	1.3063	0.6663	0.6756	0.9552	0.9101	1.1700	0.7710	0.7046	1.0736	0.8429	1.0437	0.6374	0.8047	1.0549	0.9987	0.7712	0.5210	0.5720	0.9036
heptenedioate (C7:1-DC)*	0.9740	0.8732	0.7169	0.5889	0.3226	0.9839	1.1934	0.8776	0.8954	0.9015	2.0234	0.8414	0.7290	1.2383	0.6764	0.9857	0.9374	0.7970	0.7655	0.7796	0.7699	1.1040	1.0854	0.7018	1.0204	0.8212	0.8873	1.1001	1.0327	1.0875	1.0139	1.0679	0.9256	1.8757	0.5658	0.8045	1.1693	1.0287	0.9504	1.1644	0.9200	0.9550	0.6302	0.5413	1.1530	0.7362	0.4536	0.8604	0.9725	0.7705	0.9214	0.6278	0.5494	0.7253	0.4674	0.5352	0.8594	1.1889	0.6606	0.8334	0.6594	0.6291	0.5024	0.7428	1.1463	0.8622	1.2481	0.5839	0.7267	0.3867	1.7434	0.4814	1.3164	1.0794	1.1041	1.0454	0.9252	1.5768	0.8781	1.1888	1.1672	1.0656	1.1638	1.0835	1.1349	1.1539	0.9936	1.0687	0.9677	1.2911	1.1468	1.5334	0.9023	1.2009	0.7063	0.8924	1.1594	0.7936	0.6152	0.6290	0.5700	0.6158	1.3601	0.7433	0.8965	1.1871	1.0882	0.7150	0.7365	0.7126	0.6686	0.3100
homocitrulline	0.8761	0.8426	1.7265	0.4791	0.7050	0.9438	0.9808	1.2797	1.0460	0.9892	2.0044	0.4868	4.1765	1.0771	0.8583	1.0717	0.8985	1.2341	0.9138	0.7621	0.8104	1.4985	1.2372	0.4739	1.1391	0.7913	0.6762	0.8889	1.1805	1.0692	1.0316	1.2201	1.1079	1.3781	2.2054	0.7485	1.0674	0.8886	1.1144	1.1711	0.8871	0.9773	0.7190	0.5821	1.3123	0.9227	1.1013	0.5692	0.6976	1.0466	0.8364	1.1793	0.6526	0.7153	0.5482	0.8878	0.7106	1.5776	1.0202	0.8355	0.7608	1.6793	1.2821	1.6387	1.6661	1.0901	1.0600	1.8825	1.5506	0.6998	0.4629	1.8474	0.9181	1.0049	0.8265	0.6560	0.7226	1.3147	0.8138	0.9262	0.6997	0.9313	1.0975	1.0656	0.8466	1.0654	0.9679	0.8648	0.7638	1.0647	0.6721	0.9747	1.2737	0.7063	0.6665	1.0649	0.9896	1.1336	0.8381	1.0958	0.8007	0.9495	0.9702	0.5010	0.6656	0.9231	0.8334	0.4703	0.3167	0.6838	0.8021	0.8736
hydantoin-5-propionate	0.6891	0.4726	0.8398	0.7232	0.3898	0.8813	0.7747	1.0661	0.8733	0.4437	0.7346	0.5733	1.1471	1.1520	1.8095	0.9353	0.8069	0.6135	0.8514	1.3188	0.6765	0.7491	0.9781	0.5176	1.1908	0.8450	0.7004	0.7813	0.8798	1.1564	1.1018	0.9575	0.6067	0.6015	0.5630	0.5510	0.8704	0.7948	0.9289	0.8474	2.0679	0.5416	0.7113	0.5401	0.5092	0.7241	0.5935	1.0520	0.7284	0.4498	0.6678	0.6207	0.8332	1.4594	0.1756	0.2529	1.0539	1.1342	0.9004	0.5498	0.5063	1.0381	0.3378	1.3420	0.7177	1.9420	0.4875	1.9223	1.1833	0.2442	0.4722	0.9654	1.0928	1.9526	0.9090	0.8569	0.6481	1.2305	0.9075	1.6713	1.0260	1.0368	1.4355	0.9809	1.0539	1.2231	1.0390	1.1164	1.3663	0.9764	0.8007	1.1349	1.0003	0.8729	0.6073	0.8029	0.7920	0.6963	0.9086	0.6421	0.5809	0.4526	1.8668	0.6434	0.7830	0.7619	0.4601	2.3970	0.3030	0.8802	0.5742	1.7225
hypotaurine	0.6819	0.9059	0.8427	0.9184	0.7639	0.9180	0.6029	0.9120	0.5588	0.8958	0.3336	0.7403	1.1539	0.7157	1.1675	0.7401	0.7415	1.1663	0.9500	0.9614	0.8103	0.8970	0.9624	1.0199	0.8991	1.1252	0.8662	0.6902	0.9091	0.9480	1.0737	0.9737	0.5611	0.7405	1.5247	0.9560	1.7741	0.7503	0.8535	1.2717	0.8389	0.8837	1.3425	0.7645	0.4794	0.8129	0.9850	0.4271	1.0002	0.8164	0.5053	0.6827	1.0288	0.9460	0.3976	0.7349	0.8310	1.1297	0.7037	0.9962	0.9137	0.6778	0.5623	0.7975	0.7763	1.1653	0.6860	0.6095	0.8654	0.9420	0.6659	0.6717	0.5522	1.2113	1.0768	0.8824	1.6366	1.1981	1.0103	1.2592	1.2357	1.0046	1.0734	1.4283	1.1117	1.2620	1.0999	1.1677	1.1751	1.0760	0.9014	1.2332	1.1282	0.8418	1.0122	1.0550	0.7219	0.8212	1.7868	0.8113	0.9345	0.8804	1.0953	0.8196	1.1677	0.8823	0.7643	1.3284	0.8314	0.6057	1.1379	1.3104
lyxonate	0.7519	0.7989	0.8652	0.6245	0.6146	0.7908	0.7498	0.7994	0.7301	1.2994	1.1693	0.6977	0.5098	1.4206	1.3498	0.7056	0.9356	0.5914	0.8629	1.0216	0.6056	0.7557	0.8419	0.7164	1.0852	1.1768	0.7234	1.5120	1.2147	1.0220	1.0260	0.9973	2.1037	0.9540	1.9594	0.7493	0.8475	1.3953	1.0570	1.1017	1.1042	0.8063	0.6964	0.4886	0.6917	0.9389	1.3204	1.1128	1.0077	0.6172	1.0662	1.1360	0.9193	0.8381	0.6147	1.0956	0.7632	0.8879	0.8111	1.2401	0.6756	0.8119	0.7966	2.2426	1.2589	1.5910	0.5495	1.1449	1.0055	0.6464	0.6482	3.0503	1.0316	0.9950	0.6974	0.7238	0.7590	1.7764	0.7464	1.0492	1.0170	1.2023	1.5014	0.9667	1.0486	1.0673	0.9425	0.7988	1.1334	1.1880	0.5247	0.8440	0.9912	0.6989	0.9454	0.4628	1.9206	0.8598	0.9491	0.5410	0.5707	0.6359	1.0672	1.0007	1.0998	0.7458	0.9774	0.7928	1.1052	0.7586	0.7612	1.3050
maleate	0.6929	0.5824	1.3814	0.6703	0.7040	1.1402	0.9607	0.6273	0.6912	0.4914	0.7679	0.6271	0.5830	0.5271	0.3685	0.5771	1.5056	0.7141	0.7822	1.7127	0.6492	1.1840	1.4033	1.3702	0.8995	1.0371	0.8183	1.9816	0.8012	0.7790	0.9220	1.4074	0.6631	0.9271	1.1382	0.8902	0.6616	0.6694	1.2746	0.8078	1.3026	0.3405	0.7251	0.4629	1.4382	1.6952	0.9356	0.8213	0.8414	0.7827	0.6783	0.6069	0.4616	0.8339	0.5910	0.7589	0.7088	0.6217	0.6818	0.7185	0.5037	0.6183	0.4061	0.8595	0.9486	1.6895	1.0603	2.6245	1.1588	0.3959	0.4615	1.0298	0.5038	0.9624	1.1142	1.2769	2.8987	1.7455	0.9454	0.9502	1.3688	0.7463	1.3053	0.8567	1.4942	0.9542	0.7881	0.8488	1.3977	0.8973	0.7500	0.4006	0.6792	0.5791	0.5205	0.5246	1.1425	0.5677	1.7281	0.6959	0.4876	0.5082	0.6607	0.9567	1.0191	1.2751	1.3469	0.7463	0.6914	0.6587	0.4699	1.0212
malonate	0.8682	0.9036	1.0144	1.1097	1.2800	1.0239	1.0718	1.7176	1.1014	0.7270	1.1810	0.8284	2.0073	1.5103	0.9842	1.1229	0.8955	0.7621	0.8805	0.8477	0.6438	0.7880	1.2996	0.7717	1.0657	0.8459	0.9262	1.0150	1.0399	1.1457	1.1557	0.9409	2.1401	1.3729	1.2882	1.0326	1.1060	2.0891	0.8437	1.1832	1.0693	0.7831	1.4224	0.6177	0.9257	1.0612	0.5620	0.9149	2.4318	0.1165	4.7505	2.8050	1.2862	1.2972	0.8194	0.8963	1.2389	0.8466	0.5934	0.7916	1.2457	0.7363	0.7905	1.2960	1.0299	0.8662	0.6136	0.9115	1.1185	0.4642	0.9341	1.1980	0.3246	0.7025	1.0432	0.8970	0.5567	1.2507	0.7233	1.0078	0.6722	0.8058	1.1384	0.9982	0.8747	1.0050	1.0078	0.9188	1.0389	1.1112	0.8372	0.6854	0.8293	0.4875	0.6631	0.8532	0.8280	1.9753	1.0983	0.8512	0.5705	0.9515	1.2115	1.4488	1.6746	0.7954	0.7735	0.9249	0.7869	0.7762	1.1357	0.0309
maltose	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	1.0000	NA	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000
mannitol/sorbitol	0.2455	1.1232	0.6087	0.3916	0.2333	0.3071	0.2277	0.5021	0.2734	0.3146	0.2935	0.1317	0.2725	0.2193	0.1513	0.4350	0.4655	1.1732	0.5767	0.7363	0.1392	1.1719	2.2471	0.6073	0.9014	0.3963	1.3132	9.4404	0.7867	1.2537	1.4560	0.9913	0.1882	0.4249	17.3260	0.2052	1.1416	1.4008	0.5760	0.3473	1.1295	0.1886	0.3026	0.1263	0.4671	0.6297	4.6365	0.5883	2.1273	0.2197	0.5263	0.2188	0.2825	0.1503	0.1980	0.1299	0.5203	0.5230	0.4106	0.7746	0.2125	2.8336	0.1304	0.5032	0.2304	1.1133	0.3105	0.7154	1.0519	0.1500	0.2179	2.3757	0.1878	4.8172	0.3329	0.3599	0.2379	1.0096	0.7708	0.5732	1.9110	0.7078	0.4677	0.8925	0.8797	0.7443	0.9601	0.6262	1.1879	0.5274	0.6566	0.7818	0.3873	0.4519	1.2675	0.3151	0.8655	0.5026	1.4696	1.0817	0.1698	0.8395	0.4548	0.4367	1.4301	0.2344	0.4397	0.3547	2.3981	0.1915	0.2321	0.3219
mannonate*	0.9679	0.8719	1.2481	0.9673	0.9724	1.1750	1.1674	0.9163	1.2157	1.1093	1.1850	1.1852	1.0484	1.2174	0.7212	0.8769	1.0593	0.7621	0.8997	0.8862	0.9331	0.9569	0.9015	0.7555	1.0291	0.9163	1.0160	0.8984	0.8784	0.9587	0.9435	1.0735	0.8083	0.6121	0.6505	0.6141	0.9924	0.7224	0.7309	0.8714	0.6695	1.0425	0.7788	0.8264	1.0882	0.9636	1.3137	0.7783	0.8035	1.0503	0.8582	0.6751	0.6002	0.7828	0.6317	0.4589	1.1343	0.9864	0.9756	1.6989	1.2999	1.2546	1.0119	1.1393	1.5541	2.1954	0.6882	0.8578	1.0368	0.6939	0.8565	0.9932	1.3405	0.8987	0.8274	1.0009	1.0151	0.9149	1.0158	1.1386	1.3434	1.0135	1.1688	0.9708	0.9667	1.0007	1.0537	1.0720	1.0978	0.8242	1.2200	0.7324	0.7998	0.7254	0.8054	0.9981	0.9594	1.2298	0.9012	1.9121	0.9267	0.7406	0.8431	1.0359	0.8451	0.8113	0.8325	0.9867	0.7592	0.7591	0.6719	1.0159
mannose	0.9649	1.0305	0.9778	0.7456	1.1694	0.9595	1.0229	1.0076	1.4590	0.6735	1.0996	1.0723	1.0555	1.4100	1.1150	1.0308	1.2352	0.9636	1.0723	0.7701	0.9047	0.9087	0.7925	0.7217	1.0575	0.9335	0.7533	0.9397	0.9887	0.9794	0.8899	0.9496	1.0902	0.7722	0.4358	0.7008	0.5552	1.0144	0.8314	0.6736	0.6949	1.1898	0.9860	0.9298	1.0975	0.9466	1.4725	1.0529	1.0892	1.0913	0.7930	0.8367	0.7581	0.9292	0.6698	0.5017	1.3763	1.0424	1.1470	1.3213	1.0297	1.3646	1.1888	1.1616	0.8249	1.6958	0.8590	0.7085	1.0573	0.7852	0.8117	0.6785	1.5162	1.0109	1.0946	1.2987	1.2685	1.1543	0.9417	0.9809	1.2182	1.1278	1.0466	0.9615	1.0016	1.0864	0.9791	0.8985	1.0569	0.8607	0.9646	0.6084	1.0612	0.8193	0.5948	0.8423	1.0497	1.2153	1.0429	1.3429	0.8963	0.6555	1.0149	0.9198	0.9498	0.9720	0.9800	0.7329	0.7730	0.9645	0.9156	0.8999
methylmalonate (MMA)	0.8873	0.9158	0.7124	0.7084	0.7365	0.6827	0.9691	0.7559	0.6946	0.9403	0.7224	0.8079	2.2134	0.8896	0.4839	0.7051	1.0572	1.0192	0.8392	0.9881	0.6670	0.9943	1.0096	0.6429	1.1244	1.2331	0.5924	1.0968	1.0832	0.9589	1.0205	0.9999	1.3973	0.7276	2.1143	0.7350	0.9387	0.6736	0.8727	0.7827	0.9047	0.7070	1.0954	0.4798	0.8292	0.7018	1.6124	0.8338	2.1221	0.9077	0.4641	0.5457	0.8106	0.5915	0.5191	0.7127	1.3234	1.2867	0.9192	0.8935	0.7263	0.9206	0.6595	0.9171	1.3726	1.1803	0.7815	2.2965	0.9785	0.4696	1.3183	0.8546	0.6804	1.0601	0.8662	2.5655	1.9805	2.2390	0.9006	0.7815	1.3020	1.1570	1.4495	0.9117	0.8813	1.1142	0.8388	0.7759	1.0372	0.7459	0.3001	0.9444	1.1195	1.0329	1.2050	0.5587	1.1955	0.8787	0.8350	0.6129	1.1426	0.7677	0.8258	0.9092	0.7133	0.7417	1.1715	0.6139	0.7856	3.1368	0.8380	0.7961
methylsuccinate	0.6211	0.7604	1.0831	1.0877	0.8478	1.3452	0.8133	0.7976	0.6502	1.1719	1.2867	0.6983	1.3597	0.8335	1.0430	0.8100	0.8325	1.1970	0.6974	0.9343	0.9653	1.2534	1.2281	1.2103	1.1499	0.9552	1.1583	1.2450	1.0221	1.0238	0.9267	1.0729	0.8514	0.9439	1.2671	0.8104	1.2092	0.6990	1.2112	1.1861	1.1203	0.7635	0.8195	0.5445	1.1813	0.9638	0.7228	0.5025	0.8533	0.6015	0.9816	0.7357	0.6750	0.6136	0.7660	0.7863	0.7273	0.8031	0.7300	0.7770	0.6180	0.6540	0.7944	1.0444	1.0103	1.2447	0.7648	1.1164	0.9474	0.3681	0.8213	0.7544	0.5689	1.0451	0.8495	0.9059	0.9637	1.0787	1.0462	0.9996	1.2449	0.9089	1.2758	1.2289	1.2573	1.0829	0.9248	0.9476	1.2434	1.1599	0.9524	0.7611	0.7490	0.9320	1.0922	0.8307	0.8497	1.1126	1.1299	0.8736	0.7853	0.7944	0.8769	1.1238	0.9096	1.1081	0.7108	0.8502	0.7100	0.9178	0.9171	1.1460
myo-inositol	0.8290	0.8127	0.9632	0.8754	0.7698	0.9030	0.9214	0.8695	0.7749	1.0721	2.2577	0.9470	0.7089	1.1077	0.7746	0.8656	0.9540	0.6890	0.9145	0.9439	1.0817	1.0378	1.0939	0.6478	1.1977	0.7875	0.8715	1.2981	1.2386	1.1605	0.9712	1.0585	1.4920	0.6460	0.7125	0.9821	0.9735	1.1293	1.1226	1.2395	0.9499	0.7597	0.8759	0.5365	0.9489	0.9099	1.0900	0.7497	0.9164	0.8414	1.2395	1.2975	1.2102	1.0505	0.8602	0.6334	0.9484	0.9438	0.7718	1.1528	0.8058	0.8924	0.8102	1.0723	1.3933	1.0707	0.7049	1.1397	1.2748	0.4447	0.5941	1.4343	0.7172	0.8692	0.8488	0.7736	1.1404	1.1451	0.8523	0.9781	0.9238	1.0363	1.1511	1.0400	1.1809	1.0990	0.9828	0.8981	0.9702	1.0961	1.1356	0.7953	0.9206	0.9622	1.2097	0.7668	0.9106	1.3244	0.9646	0.8483	0.5689	0.7212	0.9228	0.9390	1.0639	1.0076	0.7673	0.9337	0.6370	0.8171	0.7744	0.7169
N2-acetyllysine	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	1.0000	NA	1.0000	1.0000	1.0000	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	NA	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	NA	1.0000	NA	1.0000	NA	NA	NA	NA	1.0000
N-acetylcarnosine	0.5141	0.6484	0.8805	0.6459	0.6427	0.7226	0.6265	0.8677	0.9237	1.0522	0.3335	0.5207	0.5289	0.4595	0.4929	0.6700	0.6314	0.5123	0.6354	0.4268	0.7011	0.6314	0.6974	0.4525	0.7925	0.6084	0.7394	0.6379	0.6309	0.7713	0.6772	0.7213	0.4606	0.3143	0.3932	0.6234	1.1151	0.8319	0.6256	0.8948	0.8946	0.8260	0.5630	0.7399	0.6610	1.0393	1.1243	1.0847	0.6227	0.7900	1.1693	0.4991	0.4551	0.9300	0.5538	0.5448	0.8909	0.9577	1.1319	1.2363	0.8134	1.7005	1.0371	1.5963	0.8733	2.0525	1.4189	1.2402	1.2233	0.7658	1.2194	1.5902	0.8213	1.1149	0.7792	1.0986	1.3231	1.1286	0.9592	1.2926	1.4617	1.1470	1.3164	1.2673	1.3137	1.2249	1.2887	1.2994	1.4941	1.5655	1.5526	0.8382	0.8522	1.5219	1.4050	1.8443	1.5827	1.6757	1.1085	1.3168	1.5071	1.8859	1.2920	1.1046	1.2688	1.1898	1.1737	1.6147	2.1800	1.2468	0.6724	1.6925
N-acetylglutamine	1.3850	0.8976	0.9480	0.8003	4.2863	1.3629	0.7549	1.2511	1.5131	0.8976	1.4359	0.9060	0.7642	0.4952	1.0837	1.0157	0.7992	0.9159	0.9987	1.0766	0.7226	0.8952	1.0280	0.7691	0.7985	0.8445	1.0788	1.1088	1.1288	0.9575	0.9709	0.9462	0.7032	0.7088	0.4142	0.7391	1.1890	1.5039	0.5906	0.8655	0.9646	1.5371	1.4661	0.2667	1.0262	0.8513	1.4114	1.0212	0.5691	0.5464	0.9142	0.7516	1.0201	0.5752	0.3049	0.3416	1.4468	1.7501	1.2481	1.3446	0.9713	1.7635	0.8143	1.3694	2.6774	1.2201	1.0114	1.8025	1.1220	0.6024	1.0505	1.5589	1.4148	1.2392	0.8510	0.7744	1.0974	1.2916	0.9540	0.9189	0.8658	1.0299	1.0393	1.0290	0.8938	1.0529	1.0344	0.8271	0.8465	0.9914	0.9046	1.1278	0.7527	0.6468	0.5274	0.8312	1.1860	1.1479	1.7205	0.3677	1.2628	0.6165	1.2341	0.7439	0.7900	0.6033	1.0307	1.4632	0.4556	0.5466	0.6655	0.8566
N-acetylglycine	1.0671	1.0033	1.1747	1.1811	1.2459	0.9051	0.7283	0.8812	1.5327	0.9555	2.7355	1.3055	2.3643	0.6349	0.7979	0.9403	0.9206	1.2078	1.3448	1.0045	1.1531	0.9480	1.3912	0.8747	0.8374	0.9944	0.9039	1.2137	1.2626	0.9797	1.5783	1.1397	0.8279	1.7029	0.7228	1.1032	1.7623	0.6166	0.9811	1.6786	2.5897	0.4469	1.3964	1.0916	0.5052	1.3983	0.6390	1.1154	0.9797	1.0769	1.4675	0.4441	1.2016	0.3893	0.8645	0.8296	1.0665	1.3420	1.1752	0.7455	0.6853	1.2944	0.4082	0.9408	0.9262	0.3331	0.5461	0.5157	0.4897	0.7132	0.6873	0.7704	0.4738	0.7000	0.6762	0.5883	0.6099	1.3745	0.8298	0.8776	1.0048	1.0201	0.7898	0.8503	1.0131	1.0713	0.8511	0.9928	0.6637	1.1499	0.7861	0.5606	1.1681	0.6273	1.1722	0.6958	0.6110	0.4888	1.2657	0.4215	0.6849	0.6257	1.1139	0.5785	1.1945	1.1540	0.5063	0.4387	0.5282	0.5399	4.3323	0.7235
N-acetylhistidine	0.8969	0.8240	0.8915	0.7074	1.4993	1.1572	0.9771	1.1208	0.9138	1.5624	0.7896	0.6856	0.7530	0.8228	0.6504	0.8449	0.8918	1.0292	0.9172	1.0061	0.9597	1.1513	1.0265	0.9509	0.8103	0.9552	0.9766	1.1599	0.9633	1.0057	0.9593	1.0947	0.9545	0.7694	0.9866	0.7262	1.3899	1.0346	0.8221	0.9758	1.1119	1.5533	1.0884	0.3321	0.9980	1.2499	1.1919	0.7208	0.7818	0.8008	0.8196	0.6073	1.1248	0.8189	0.5977	0.1514	1.2523	1.3268	1.4892	1.2334	0.7457	1.3364	0.5161	1.1388	1.1882	0.9434	0.6552	1.5707	0.9177	0.6599	1.1056	1.0275	1.0991	1.4229	0.9215	0.7683	0.9241	1.1644	0.8408	0.9938	0.9779	0.9780	1.0335	1.1168	1.0461	1.0531	1.0255	0.9474	0.9154	2.0387	1.1885	0.8459	0.8247	0.7399	0.5607	1.0080	0.9763	1.0794	1.5817	0.3860	1.3140	1.1400	1.8577	0.8486	0.7579	0.6937	1.1118	1.5061	0.5456	1.1442	0.7481	1.0039
N-acetylserine	0.9002	1.0029	1.1119	0.8005	1.3766	0.8831	0.8373	0.9974	0.8623	0.8250	1.2110	0.9734	1.1218	0.8761	1.0643	0.9954	0.9737	1.0927	0.9760	0.8542	0.7739	0.9745	1.0963	0.8313	1.0652	0.9513	0.8762	1.0184	0.9873	1.0599	0.9946	1.0297	0.9151	0.6864	0.9725	0.7988	0.9934	0.7307	0.9903	1.0725	0.9121	0.8728	0.9621	0.6135	0.9259	0.9665	0.9998	0.7803	0.8697	0.9039	0.8865	0.7732	0.9438	0.7580	0.7054	0.6292	0.9870	1.3781	1.1617	0.8718	0.8271	1.1516	0.8470	1.1305	1.5960	1.2767	1.1011	1.1873	1.3465	0.4835	0.9330	1.6092	0.9064	1.1682	1.0123	0.9237	1.0904	1.1874	0.9716	1.0435	1.0616	1.0300	1.1612	1.0273	1.0006	1.0743	0.9461	0.8923	0.9967	1.1350	1.2717	0.8603	0.8836	0.8558	0.8028	0.8297	1.0354	0.9856	0.9742	0.7280	0.7525	0.7567	1.1423	0.9664	0.8572	0.8310	1.0021	0.9613	0.7240	0.7072	0.8850	0.9675
N-methyltaurine	NA	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	NA	NA	NA	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	NA	NA	1.0000	1.0000	NA	NA	NA	1.0000	1.0000	NA	1.0000	1.0000	1.0000	NA	1.0000	1.0000	NA	1.0000	1.0000	1.0000	NA	NA	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	NA	NA	NA	1.0000	NA	1.0000	1.0000	NA	NA	NA	1.0000	NA	1.0000
orotate	0.7164	0.9058	2.0267	0.9026	0.5680	0.7847	0.6767	0.7230	0.7152	0.7070	0.7365	1.0388	1.3565	0.6757	0.8537	0.6406	0.7049	1.0747	0.7218	1.2458	0.5529	0.8885	0.8151	0.9942	0.8569	0.7311	0.9176	0.9859	1.3462	0.9889	0.8405	1.4991	0.9442	0.6671	1.0615	1.0203	0.8971	0.6309	0.8159	1.1474	1.2086	0.7451	0.8044	0.5299	0.6805	0.8132	0.4630	0.8341	1.0200	1.2116	5.7922	0.7285	0.6372	0.5512	0.2983	0.7463	0.8555	0.8025	0.8100	0.9407	0.6272	0.8130	0.7498	0.6962	0.9995	1.0269	0.7611	0.8811	0.9611	0.4409	0.6343	0.7927	0.8554	2.8428	0.9789	0.7373	0.8363	1.0270	0.8011	0.9392	1.8298	0.7781	0.8698	0.9444	1.2116	0.8902	0.9406	1.1421	1.1654	1.0694	0.9025	0.6467	0.8041	0.7944	0.8033	1.0265	0.8487	0.9143	0.8894	3.2239	0.4787	0.7148	1.0217	1.1001	0.9404	0.7569	0.9064	1.6049	0.8011	0.3938	0.9160	0.5059
orotidine	0.4488	0.4807	7.2743	0.5118	0.4522	0.4842	0.5783	0.4946	0.5084	0.5651	0.6240	0.3545	0.5795	0.3658	0.4199	0.4224	0.5967	0.4805	0.4604	0.4469	0.3718	0.5657	0.6624	0.5613	0.6607	0.5168	0.5235	0.5515	1.1614	1.0971	0.5885	2.8795	0.3802	0.3193	0.5976	0.3649	0.5888	0.4492	0.4446	0.5900	0.4994	0.3602	0.4268	0.2326	0.6446	0.7218	0.3288	0.3603	0.6503	0.5235	12.3921	0.3937	0.2975	0.3301	0.1896	0.3844	0.5221	0.6752	0.4724	0.6234	0.4637	0.7524	0.6985	0.6077	1.2195	0.8649	0.4875	0.6982	0.6274	0.2880	0.6595	0.8064	0.3365	9.2140	0.6481	0.4889	0.6423	0.7681	0.5476	0.7320	1.5905	0.5452	0.6844	0.7379	1.1675	0.6282	0.8291	1.4485	1.3572	0.6692	1.0768	0.4348	0.4680	0.5833	0.4762	0.5373	0.6493	0.8154	0.6843	7.7364	0.4732	0.6407	0.6865	0.9327	0.5512	0.4683	0.6776	0.7400	0.4164	0.4032	0.4297	0.6655
oxypurinol	NA	NA	1.2979	NA	NA	NA	0.0038	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	0.0002	0.0001	0.0213	NA	NA	NA	NA	NA	1.8263	2.2481	NA	1.9686	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	1.2453	NA	NA	0.0016	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	2.2197	NA	NA	NA	NA	NA	NA	2.9498	NA	NA	NA	1.5817	NA	1.3336	0.9622	0.6813	NA	0.0002	NA	0.0060	NA	NA	NA	NA	NA	NA	0.7458	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA
pentose acid*	0.4075	0.3886	0.7282	0.7799	0.6339	0.9354	0.5849	0.6656	0.4187	1.5846	1.1273	0.3969	0.1599	1.5703	0.4122	0.4309	0.7204	0.4456	1.0109	1.0957	0.4194	0.6839	0.8255	0.3848	1.1769	0.7069	0.9315	3.1777	1.8843	1.3746	0.7287	1.1721	3.2293	0.2398	1.5342	0.8543	0.8834	1.6857	0.7726	1.0782	1.3956	0.8939	0.4719	0.4284	0.6919	0.5500	0.8813	0.1190	0.5847	0.2059	0.3890	1.3662	0.5433	0.2626	0.3565	0.3982	0.4185	0.6014	0.8729	1.4519	0.6512	0.5953	0.1646	1.0692	0.5291	0.7526	0.3907	1.4321	0.5208	0.3019	0.2169	1.7561	0.6345	0.8821	0.2632	0.7694	0.6612	0.9136	0.7928	0.8783	1.0530	1.3236	2.3275	1.6014	1.4900	1.2140	0.8618	0.7213	1.1624	0.7208	0.8516	0.5687	1.1686	0.6146	1.1649	0.6572	0.8158	1.3516	1.2057	0.3915	0.4249	0.1822	0.9899	0.9142	0.8012	0.6270	1.1390	0.2430	0.3686	0.1910	0.4772	0.8074
perfluorooctanesulfonate (PFOS)	0.5580	1.1425	0.7576	0.4451	0.5176	1.3450	1.4210	1.6844	0.4722	0.8892	0.2134	1.6963	0.5684	1.0884	0.7846	0.8714	0.4375	0.9613	0.3011	0.7491	0.2694	0.8412	0.5123	0.6698	0.9313	1.2593	1.8121	0.6304	0.8702	1.1288	0.8555	0.9315	1.4031	0.3473	0.5435	0.4839	0.9472	0.5304	0.6824	0.8009	0.9723	1.6729	0.5719	0.7676	0.4808	0.8235	0.8353	0.7038	0.7443	0.8817	0.7709	0.4366	0.6337	0.3128	0.3935	0.0174	0.8353	1.4230	0.9595	0.7163	0.3969	1.0446	0.2817	1.5824	1.2265	0.9103	0.4192	0.3063	1.3679	2.9394	1.0579	1.1387	1.7849	0.9440	1.1185	0.8337	1.1319	0.7804	1.0041	0.8448	1.1636	1.2083	0.9889	0.8725	1.3142	0.7620	1.3755	0.9760	1.6005	1.0376	1.7341	0.2098	0.8212	1.0095	1.2231	1.5308	0.6483	1.4272	0.8735	1.4384	0.4289	0.5332	0.7475	0.5623	0.7612	0.8337	1.1992	0.5004	1.9638	1.0047	3.7035	0.4030
pimelate (C7-DC)	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	NA	1.0000	NA	1.0000	NA	1.0000	NA	1.0000	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	NA	NA	NA	1.0000	1.0000	NA	NA	1.0000	NA	NA	NA	NA	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	1.0000	1.0000	1.0000	NA	NA	1.0000	NA	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	1.0000	NA	1.0000	1.0000	1.0000	1.0000	NA	NA	1.0000	NA	1.0000	NA	1.0000	1.0000	1.0000	NA	NA	NA	NA	1.0000
pyridoxate	0.0996	0.1090	0.1961	0.1204	0.1120	0.1591	0.6143	0.2587	0.1095	0.2733	0.2878	0.2786	0.0905	0.2065	0.1773	0.1841	0.2075	0.1680	0.6953	0.7466	0.9854	0.9588	0.4695	0.5084	6.8269	0.4333	0.5055	0.7177	0.8883	1.3255	1.0078	0.3040	0.2644	0.1295	0.7600	1.8977	1.8424	0.1878	0.7588	1.1671	0.2677	0.3238	0.1753	0.0826	0.1357	0.2416	0.4039	0.2625	0.1306	0.1583	0.4336	0.3961	0.2334	0.1574	0.1115	0.3137	0.1916	0.4844	0.2143	0.4446	0.1947	0.1299	0.7766	0.5856	0.1133	0.2847	0.1188	0.7289	0.3593	0.1733	0.1102	0.1571	0.1467	0.7284	0.3071	0.1964	0.4517	6.3657	0.3762	0.9100	0.6588	0.7885	1.9048	0.5019	3.0213	2.0402	1.4563	0.7540	0.8378	0.5472	0.4851	0.3169	0.4502	0.9628	0.3719	0.3747	1.0232	0.2931	0.2396	0.7658	0.1378	0.0544	1.3909	0.2019	1.2162	0.4408	1.0700	0.2230	0.1142	0.1199	0.2489	0.2273
quinate	0.2484	0.2777	0.1330	0.2355	0.0865	1.9690	0.5066	0.2315	0.1505	0.7714	1.8617	0.1516	0.3590	0.1379	0.0424	0.1865	1.0815	0.1134	0.9098	1.5147	1.2226	2.3766	1.4345	1.3021	1.1926	1.2061	1.3302	3.3575	1.3344	0.8585	0.6175	1.7136	0.2175	1.4177	0.0848	1.1747	0.0133	1.3786	1.3514	0.1110	1.7770	0.0277	0.0465	0.3603	0.9227	0.7945	1.9846	0.7247	0.2294	1.1246	1.4011	0.1184	0.6187	0.3432	0.3125	0.0065	0.4492	0.3300	0.2902	0.3090	0.2299	0.1792	0.2151	0.8423	0.0145	0.7055	0.7587	0.7580	0.5861	0.0103	0.0160	0.4193	0.0882	0.7648	1.3808	0.9460	2.0015	2.9896	1.5303	0.9382	1.6233	0.7130	1.0404	0.6568	1.3996	1.3493	0.6551	0.6937	1.3608	0.7452	1.1579	0.4839	0.4324	0.4372	0.7464	0.5482	1.9377	0.0547	1.8672	0.0443	0.5430	0.0383	0.7473	0.3619	1.0052	2.0515	0.5460	0.2312	0.5270	1.8986	1.3129	0.9520
ribitol	1.1405	1.0104	1.0483	0.9559	1.3727	0.8224	1.0226	0.8926	0.9912	0.9029	0.8655	0.7418	0.9264	0.9399	0.7527	0.8408	1.0000	1.0096	1.0027	0.9175	0.6549	0.8904	1.0309	0.8736	1.0832	0.9475	1.0823	1.0384	0.8570	0.9985	0.9727	1.0916	1.0416	0.8740	2.4485	0.8425	0.8228	0.9711	0.8649	0.8404	0.8989	0.8925	1.2698	0.6647	1.0537	0.9994	1.2637	0.8893	1.0671	0.7584	1.1620	0.8995	0.8753	1.1063	0.4201	0.7806	0.9403	0.8971	0.9098	1.1353	0.8196	1.5173	0.8105	0.9747	0.8344	1.1834	0.9577	0.9685	1.2918	0.6230	0.9289	0.9905	0.8769	1.0586	1.0058	0.9367	0.9470	1.0291	0.8607	0.9395	1.0426	0.8629	1.0915	1.0462	1.0406	1.0234	1.1653	0.9843	1.0115	0.8960	1.0124	0.8973	0.8178	0.8812	0.8450	0.9434	1.0094	0.8200	3.7078	0.9088	0.9174	1.0883	1.1817	1.6040	0.8928	0.7920	1.0485	1.1615	1.0811	0.8563	0.7706	1.0667
ribonate	0.9817	0.9374	1.1614	1.0861	0.8695	0.8105	1.2019	0.8717	0.8351	1.4560	0.8757	0.5924	0.8307	1.0031	0.9379	0.8771	0.9995	0.9460	0.9606	0.8015	0.8149	1.0774	1.0976	1.0150	1.0693	1.1390	0.8043	1.0476	0.9897	1.1240	1.0578	1.0738	0.7438	1.1007	0.7892	0.8514	1.6675	0.7418	1.0314	1.2471	0.8373	0.5736	1.2304	1.0799	1.0594	0.9128	1.0671	0.8889	0.7612	0.6763	0.8380	0.5888	0.7613	1.0622	1.2230	1.1547	0.6878	0.8786	0.9004	1.0392	0.6874	1.2698	0.8339	0.8905	1.8112	0.5409	0.4976	1.9297	1.1745	0.7535	1.0969	1.0269	1.2882	0.8908	0.7745	0.8486	0.7902	0.8208	0.9869	0.9324	1.0631	1.0037	1.2311	1.0929	1.1238	1.0787	0.9680	0.8822	1.0726	0.8156	1.6598	0.9439	0.7948	1.1404	0.8094	0.8688	1.0015	0.9768	1.5594	0.6515	0.5659	0.6020	0.6265	1.0123	0.5866	1.1836	0.9162	0.6612	1.0388	1.0737	0.5246	1.6199
salicylate	0.2587	0.3423	0.1454	7.1839	0.0293	14.7866	0.0407	0.1949	0.0723	0.0536	0.7669	0.0780	9.8225	6.1563	0.0740	0.0298	0.0278	0.3038	0.0287	0.0893	0.0596	0.2081	0.4570	7.0441	0.6605	0.0311	2.8824	1.1933	1.4951	1.5535	0.9537	1.0743	0.1618	0.0076	0.2826	0.0793	0.0169	1.3830	0.1299	0.9358	0.1157	0.0133	0.0686	0.0709	0.9507	0.0133	0.0355	0.0080	0.0105	0.0104	0.0053	0.1182	0.1136	0.0122	0.0394	0.0448	1.0259	0.5623	0.3897	1.8247	0.0253	0.2445	0.0123	0.6747	1.1815	0.6541	0.5224	0.1938	6.3884	0.0148	0.0631	0.3956	0.1191	0.9445	0.4429	0.0724	4.5919	0.2103	0.9243	0.7931	0.1505	2.1347	0.3132	0.5548	1.3127	0.4549	0.5833	1.4006	1.1010	0.1075	0.3171	1.1511	0.0201	0.0613	0.0230	0.0206	0.1075	5.9558	0.0252	0.0164	0.0121	0.0063	0.0347	0.0119	3.2628	0.0566	0.1360	2.0659	0.9618	0.1281	0.0163	0.0132
succinate	1.1835	0.9900	1.1676	0.9698	1.9059	1.0155	1.1376	1.0515	1.0691	1.1570	0.9963	0.9997	2.1153	0.9074	1.0685	1.0091	0.7176	1.1937	0.9167	1.2678	0.8605	0.9682	1.2334	0.9430	0.9986	1.2750	1.1325	1.1173	1.0366	0.9801	1.1682	1.0006	1.5686	1.1164	0.9724	0.8272	1.5493	0.9481	1.0815	1.3476	1.1927	1.1030	1.1862	0.7898	0.8749	0.8809	0.7882	1.0118	0.9435	0.1008	0.9699	0.8513	1.1161	1.1632	0.9078	1.0183	0.9122	0.8330	0.6933	1.1876	1.0097	1.0187	1.2743	1.0920	1.0734	0.9869	0.4725	0.9926	1.4451	0.7082	0.8479	0.8234	0.7439	0.9133	0.9957	0.8552	0.6716	1.0321	0.9409	1.0549	0.8726	0.9392	1.2048	0.9061	1.0250	0.9495	0.9782	1.0111	0.9654	0.9193	0.0964	0.9800	0.8831	0.5505	1.1901	0.9629	0.8297	0.8713	1.1856	0.6807	0.9128	0.8606	0.9701	0.9673	0.9786	0.8614	0.9522	1.0193	0.8007	0.8136	0.9359	0.0798
succinoyltaurine	1.0198	0.5499	0.8970	0.3454	0.3089	0.8633	0.8307	0.5775	0.5376	1.1883	0.7898	0.5251	0.6509	0.9096	0.6966	0.8469	1.2395	0.6232	0.9881	0.8220	1.1442	1.2264	1.4439	1.4414	0.9446	0.8739	0.7588	1.2874	1.0248	0.9988	1.0310	1.1916	0.8061	0.7273	0.5377	0.9618	1.1393	0.5024	1.0651	1.4388	0.6505	0.8215	0.6135	0.5413	0.9673	0.8679	1.8930	0.2922	0.5089	1.6556	0.4795	0.3233	0.7762	0.4364	0.5508	0.5298	1.0848	0.9846	1.1366	0.7967	0.9097	0.6990	0.3271	0.8537	0.7188	0.6845	0.7952	2.4618	0.5048	0.3743	1.0428	2.3290	1.2294	1.2195	1.1646	0.7125	0.9506	1.6667	0.7708	1.0111	0.9478	1.0873	1.1516	0.9031	1.3815	1.0182	0.9673	1.1120	0.9542	0.7929	3.3801	0.4365	0.9981	1.3412	0.9472	0.9632	1.2428	0.5035	0.7759	0.9564	0.3519	1.2394	1.3035	0.5145	0.3726	0.7251	1.0517	0.5860	0.4326	1.4322	0.6817	1.6449
threonate	0.7270	0.5849	0.6741	0.6242	0.6712	0.7201	1.1077	0.7506	0.9869	2.0253	1.1793	1.4568	0.1023	1.4763	0.5619	1.0146	0.9378	0.5468	0.8753	1.4758	1.5136	0.8156	0.9247	0.9681	1.4736	0.7648	1.0431	1.1166	1.2436	1.0765	1.1018	1.1444	1.3473	1.2227	1.3461	1.2505	3.4346	1.8612	1.1440	1.0728	0.8860	1.0191	0.5366	0.3070	0.7334	0.9824	1.6736	0.8212	0.5813	1.0075	1.2521	1.0861	0.9121	1.2710	1.2921	1.6868	1.0116	0.6816	0.7688	1.0705	0.7316	0.4951	1.0082	0.9480	1.0525	0.8145	0.4368	0.7951	0.7510	1.0113	0.8639	0.9474	1.5541	0.9987	0.5565	0.6111	0.6409	0.9942	0.7832	0.8687	0.7543	1.2691	1.3666	0.8703	1.2357	1.0943	0.9774	1.0019	0.9996	1.1536	1.0982	1.1124	1.1885	0.9391	1.0204	0.9836	1.0756	0.7934	0.7884	0.8988	0.9470	0.1265	1.0336	0.2911	1.2858	1.0682	0.9710	0.4001	0.5671	0.9451	1.3623	1.0820
trans-urocanate	1.1372	1.0032	0.9134	0.7538	0.6013	1.4335	0.8488	1.1678	1.1592	0.9185	0.4267	1.2411	0.5097	1.0279	1.0481	1.0392	0.7812	1.1453	0.9188	0.9960	1.0903	0.8395	1.1357	0.8801	0.8513	0.9547	1.6161	0.8177	1.0937	1.1144	1.1572	0.8200	0.9454	1.1103	0.8013	1.0297	0.7256	1.0845	1.2048	0.8373	0.6636	0.8450	0.7883	0.8603	1.3442	1.1489	1.0040	0.9116	0.8065	1.5052	1.1224	1.1604	0.6454	0.8694	0.5090	1.3825	0.9380	0.8637	0.9794	1.0411	1.0985	0.7395	0.8824	0.9586	0.7275	0.9082	0.7731	0.7466	1.2512	0.8016	0.8530	1.2055	0.7795	1.2473	0.9616	0.9855	1.1464	1.0818	0.8958	0.9431	0.9074	1.1163	0.9541	1.0245	1.0212	1.0907	0.9571	0.8890	1.1029	1.3498	0.9529	0.8155	0.8362	1.1348	0.7191	0.6803	1.2550	0.9818	0.5285	0.9544	0.9364	1.7134	0.9147	0.8014	1.2379	1.1110	1.1145	0.7628	0.8826	1.0383	1.8835	0.7973
uracil	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000
valsartan	NA	NA	NA	NA	NA	NA	0.0324	0.0253	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	1.4095	NA	NA	NA	NA	0.3859	NA	4.3483	NA	NA	0.0548	NA	0.7636	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	0.7675	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	0.7636	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	2.0380	NA	NA	NA	0.2361	0.2646	1.9876	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	NA	1.2627	NA	NA	NA	NA	NA	NA
xanthine	0.9092	1.0790	1.8054	0.7534	0.9364	1.0219	0.8010	0.8168	1.1131	1.0122	0.6234	0.8823	0.9322	1.1408	0.8952	0.9404	0.7443	0.8330	0.6674	0.8382	0.7074	0.7460	0.8548	0.9145	0.8458	0.8907	1.0392	0.8080	1.1281	0.9691	0.9264	1.2677	0.9448	0.9343	0.5891	0.7175	1.2838	0.6840	0.9508	0.9094	0.8078	1.0126	0.7869	0.6857	0.9085	0.8939	0.7581	0.8119	0.7695	0.7829	2.7070	0.7314	0.6869	1.0661	0.7433	0.9353	0.9002	0.8351	0.8828	0.9085	0.7304	0.9392	1.2903	0.7797	0.9616	1.1060	1.0503	0.7216	1.2611	0.5690	1.0796	0.6028	0.8571	1.4388	1.0822	0.8405	0.9217	0.7511	0.7478	0.9979	1.8545	0.8273	0.9297	1.1229	1.1166	0.7967	0.9402	1.1358	1.1611	0.9003	1.4846	0.8145	0.9458	0.6698	0.8407	1.1945	0.9137	0.8175	4.6670	3.4490	0.9855	1.3561	0.8753	1.7394	1.1568	0.7517	0.8875	2.0843	1.4738	0.8624	0.9982	1.0734
xylose	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	NA	NA	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	1.0000	NA	1.0000	NA	NA

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

Factors:

F1	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:Columbia
F2	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:Johns Hopkins
F3	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:Other
F4	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:UCLA
F5	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:UCSF
F6	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:Wake Forest University
F7	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:Columbia
F8	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:Johns Hopkins
F9	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:Other
F10	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:UCLA
F11	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:UCSF
F12	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:U of Michigan
F13	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:Wake Forest University
F14	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Never Smoked | SITE_cat:Columbia
F15	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Never Smoked | SITE_cat:Johns Hopkins
F16	GENDER:Female | RACE.ETH:Black/Africian American | smokStatus:Never Smoked | SITE_cat:U of Michigan
F17	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:Columbia
F18	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:Johns Hopkins
F19	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:Other
F20	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:UCLA
F21	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:UCSF
F22	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:U of Michigan
F23	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:U of Utah
F24	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:Wake Forest University
F25	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:Columbia
F26	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:Johns Hopkins
F27	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:Other
F28	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:UCLA
F29	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:UCSF
F30	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:U of Michigan
F31	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:U of Utah
F32	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:Wake Forest University
F33	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:NA | SITE_cat:Columbia
F34	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:NA | SITE_cat:U of Utah
F35	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:Johns Hopkins
F36	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:Other
F37	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:UCLA
F38	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:UCSF
F39	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:U of Michigan
F40	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:U of Utah
F41	GENDER:Female | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:Wake Forest University
F42	GENDER:Female | RACE.ETH:Other | smokStatus:Current Smoker | SITE_cat:Johns Hopkins
F43	GENDER:Female | RACE.ETH:Other | smokStatus:Current Smoker | SITE_cat:Other
F44	GENDER:Female | RACE.ETH:Other | smokStatus:Current Smoker | SITE_cat:UCLA
F45	GENDER:Female | RACE.ETH:Other | smokStatus:Current Smoker | SITE_cat:U of Michigan
F46	GENDER:Female | RACE.ETH:Other | smokStatus:Current Smoker | SITE_cat:U of Utah
F47	GENDER:Female | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:Columbia
F48	GENDER:Female | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:Other
F49	GENDER:Female | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:UCSF
F50	GENDER:Female | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:U of Michigan
F51	GENDER:Female | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:U of Utah
F52	GENDER:Female | RACE.ETH:Other | smokStatus:NA | SITE_cat:Columbia
F53	GENDER:Female | RACE.ETH:Other | smokStatus:Never Smoked | SITE_cat:Columbia
F54	GENDER:Female | RACE.ETH:Other | smokStatus:Never Smoked | SITE_cat:Other
F55	GENDER:Female | RACE.ETH:Other | smokStatus:Never Smoked | SITE_cat:UCSF
F56	GENDER:Female | RACE.ETH:Other | smokStatus:Never Smoked | SITE_cat:U of Michigan
F57	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:Columbia
F58	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:Johns Hopkins
F59	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:Other
F60	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:UCLA
F61	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:UCSF
F62	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:U of Michigan
F63	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Current Smoker | SITE_cat:Wake Forest University
F64	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:Columbia
F65	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:Johns Hopkins
F66	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:Other
F67	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:UCLA
F68	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:UCSF
F69	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Former Smoker | SITE_cat:Wake Forest University
F70	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:NA | SITE_cat:Johns Hopkins
F71	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Never Smoked | SITE_cat:Johns Hopkins
F72	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Never Smoked | SITE_cat:UCSF
F73	GENDER:Male | RACE.ETH:Black/Africian American | smokStatus:Never Smoked | SITE_cat:U of Michigan
F74	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:Columbia
F75	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:Johns Hopkins
F76	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:Other
F77	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:UCLA
F78	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:UCSF
F79	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:U of Michigan
F80	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:U of Utah
F81	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Current Smoker | SITE_cat:Wake Forest University
F82	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:Columbia
F83	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:Johns Hopkins
F84	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:Other
F85	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:UCLA
F86	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:UCSF
F87	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:U of Michigan
F88	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:U of Utah
F89	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Former Smoker | SITE_cat:Wake Forest University
F90	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:NA | SITE_cat:U of Utah
F91	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:NA | SITE_cat:Wake Forest University
F92	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:Other
F93	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:UCSF
F94	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:U of Michigan
F95	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:U of Utah
F96	GENDER:Male | RACE.ETH:Non-Hispanic, White | smokStatus:Never Smoked | SITE_cat:Wake Forest University
F97	GENDER:Male | RACE.ETH:Other | smokStatus:Current Smoker | SITE_cat:Columbia
F98	GENDER:Male | RACE.ETH:Other | smokStatus:Current Smoker | SITE_cat:Other
F99	GENDER:Male | RACE.ETH:Other | smokStatus:Current Smoker | SITE_cat:UCLA
F100	GENDER:Male | RACE.ETH:Other | smokStatus:Current Smoker | SITE_cat:UCSF
F101	GENDER:Male | RACE.ETH:Other | smokStatus:Current Smoker | SITE_cat:U of Michigan
F102	GENDER:Male | RACE.ETH:Other | smokStatus:Current Smoker | SITE_cat:U of Utah
F103	GENDER:Male | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:Columbia
F104	GENDER:Male | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:Other
F105	GENDER:Male | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:UCLA
F106	GENDER:Male | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:UCSF
F107	GENDER:Male | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:U of Michigan
F108	GENDER:Male | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:U of Utah
F109	GENDER:Male | RACE.ETH:Other | smokStatus:Former Smoker | SITE_cat:Wake Forest University
F110	GENDER:Male | RACE.ETH:Other | smokStatus:Never Smoked | SITE_cat:Columbia
F111	GENDER:Male | RACE.ETH:Other | smokStatus:Never Smoked | SITE_cat:Johns Hopkins
F112	GENDER:Male | RACE.ETH:Other | smokStatus:Never Smoked | SITE_cat:U of Utah