metabolite_name	7122	7147	7150	7153	7184	7238	7406	7408	7421	7445	7486	7496	7506	7547	7658	7662	7744	7759	7762	7776	7791	7843	7847	7852	7855	7858	7860	7861	7862	7870	7874	7875	7879	7897	7899	7904	7906	7908	7909	7910	7911	7912	7938	7941	7947	7948	7955	7971	7989	8095	8096	8101	8106	8129	8226	8244	8264	8275	8283	8332	8336	8361	8374	8377	8406	8441	8444	8447	8452	8458	8462	8464	8466	8467	8475	8480	8483	8485	8496	8502	8503	8511	8513	8515	8523	8534	8537	8550	8564	8565	8573	8577	8589	8591	8592	8605	8624	8628	8629	8667	8675	8683	8692	8696	8728	8734	8735	8746	8749	8753	8754	8758	8764	8765	8774	8776	8778	8783	8784	8785	8788	8789	8794	8795	8800	8802	8803	8805	8806	8807	8809	8815	8841	8843	8844	8846	8847	8849	8878	8882	8892	8894	8898	8924	8932	8982	8998	9010	9018	9030	9033	9074	9079	9126	9148	LLDeep_0001	LLDeep_0003	LLDeep_0010	LLDeep_0011	LLDeep_0012	LLDeep_0015	LLDeep_0018	LLDeep_0021	LLDeep_0022	LLDeep_0024	LLDeep_0026	LLDeep_0027	LLDeep_0028	LLDeep_0029	LLDeep_0030	LLDeep_0033	LLDeep_0034	LLDeep_0037	LLDeep_0039	LLDeep_0043	LLDeep_0047	LLDeep_0052	UMCGIBD00072	UMCGIBD00122	UMCGIBD00030	UMCGIBD00167	UMCGIBD00208	UMCGIBD00032	UMCGIBD00529	UMCGIBD00371	UMCGIBD00145	UMCGIBD00613	UMCGIBD00004	UMCGIBD00053	UMCGIBD00269	UMCGIBD00250	UMCGIBD00327	UMCGIBD00249	UMCGIBD00461	UMCGIBD00266	UMCGIBD00347	UMCGIBD00645	UMCGIBD00361	UMCGIBD00485	UMCGIBD00041	UMCGIBD00126	UMCGIBD00082	UMCGIBD00442	UMCGIBD00412	UMCGIBD00539	UMCGIBD00077	UMCGIBD00141	UMCGIBD00389	UMCGIBD00112	UMCGIBD00508	UMCGIBD00588	UMCGIBD00106	UMCGIBD00393	UMCGIBD00458	UMCGIBD00254	UMCGIBD00593	UMCGIBD00233	UMCGIBD00238	UMCGIBD00027	UMCGIBD00064
1,2,3,4-Tetrahydro-1-methyl-beta-carboline-3-carboxylic acid	210.752	23.7645	359.982	190.391	45.9292	9.97964	37.7002	32.5376	75.2186	82.7138	101.724	192.064	174.756	33.0444	100.998	592.864	99.6607	49.2859	18.231	121.54	245.24	65.6484	76.6127	178.403	30.5471	763.987	225.442	249.915	43.27	277.127	411.318	11.6805	130.804	100.659	175.906	745.407	396.93	310.744	600.25	49.4962	91.017	74.9699	8.92318	55.806	83.0106	77.468	118.231	47.8845	0	15.1896	24.0793	59.0846	41.5517	64.8042	21.3066	241.303	0	232.008	86.1763	74.4084	25.8303	310.351	144.208	10.3398	91.3197	50.2509	298.486	94.2471	27.694	96.1905	132.379	218.336	82.5763	37.043	305.677	0	30.802	69.207	136.377	0	113.645	129.78	106.687	26.264	0	24.5652	28.6131	130.071	139.637	0	31.0141	334.732	98.18	158.547	51.2666	0	158.061	85.8568	174.778	46.3216	67.3489	14.5036	180.805	441.572	149.387	58.4181	6.96508	0	50.9968	66.8732	251.878	22.0876	55.2679	643.751	318.789	8.71072	56.3939	50.8732	129.843	51.7829	53.7234	328.882	74.0934	36.1308	31.3612	19.563	128.904	17.373	33.738	8.82836	0	27.6956	0	0	28.1051	96.756	61.4675	62.2382	22.4909	0	105.397	94.6328	18.237	89.194	0	23.0764	26.4372	252.712	140.535	116.316	10.4345	23.5167	129.167	41.1595	48.3834	38.4206	141.349	119.628	150.16	53.4259	55.0506	159.585	161.529	330.675	223.51	32.2171	74.6972	431.325	69.6111	186.474	209.144	100.345	54.4176	47.9909	25.4764	349.186	298.49	69.1491	68.5173	103.833	180.006	102.033	91.8844	466.678	58.4888	69.3686	95.0217	34.7471	127.718	61.9212	88.5054	142.451	240.106	0	77.551	79.4585	30.2013	55.6471	130.078	52.5842	14.6644	38.2607	503.662	63.9289	30.2118	30.0963	84.7099	172.123	147.691	25.2867	19.1128	74.2413	200.164	42.9478	3.97689	55.5309	27.9643	234.823	120.184	43.251
1-3-7-trimethylurate	873.165	690.634	686.706	348.698	798.689	1182.57	220.943	1232.39	466.765	987.381	471.087	392.733	7288.46	2358.8	55.2227	215.957	372.47	254.563	103.409	342.913	244.263	18.4484	952.639	859.9	327.996	443.386	380.197	453.848	743.955	364.847	992.547	7.69112	11804.7	923.792	765.699	225.271	301.288	45.6177	35.3132	460.403	822.364	14030	348.694	136.764	273.165	161.027	93.1425	857.336	32.2331	686.402	19.3179	2287.46	168.074	0	0	3906.38	227.125	63.3173	18603.7	97.3081	322.311	1107.56	241.88	523.946	128.994	1405.93	1024.42	7192.84	135.579	606.394	2827.73	985.293	238.309	450.396	1031.43	0	817.092	565.389	654.208	105.135	43343.5	576.552	597.287	0	37.6157	648.865	341.608	303.816	311.406	2279.48	260.357	865.414	10835.7	69.5477	1002.28	48.788	910.89	172.946	67.0117	381.457	0	118.034	1585.74	257.758	1352.75	997.95	15.581	706.27	715.357	200.898	31275.8	29.3057	12583.6	2654.56	259.212	284.714	12393.8	543.733	370.527	64.128	1173.08	16709	187.039	188.874	224.001	8088.28	113.465	61.3205	955.475	340.054	244.015	1262.72	348.81	67.2142	329.771	0	0	0	567.767	499.737	252.534	1480.36	45.3423	200.06	999.238	1965.54	115.28	501.2	635.243	784.432	1744.44	26.1289	256.154	123.428	86.8816	11394.3	9.59411	1013.8	16125.4	349.405	646.949	16537.4	14234.3	893.309	2869.24	4053.24	9612.94	2905.01	1114.2	2180.26	10403.7	6035.7	14600.2	158.635	1465.36	9711.67	7341.52	151.353	769.422	46.9596	3244.87	14021.7	413.765	4169.42	221.022	908.112	371.88	26.6232	920.582	9.37302	490.852	4941.19	6875.48	422.368	388.781	142.93	1019.58	92.3264	809.324	181.276	998.137	1442.68	1079.55	769.366	799.558	45.4202	870.76	393.397	1698.6	1009.53	1644.45	869.866	383.265	243.77	395.738	164.168	2186.9	132.754	659.85	685.766
2-Aminobutyric Acid	356.396	12.3401	791.694	19.8677	265.094	7841.86	15.3182	250.658	341.89	4056.1	843.62	65.8817	10.1573	35.3852	86.0906	950.261	2246.22	100.885	989.926	1844.36	4813.04	9038.28	323.352	245.529	1086.07	262.825	297.3	893.65	876.781	612.285	437.812	949.275	622.109	527.577	567.115	696.962	78.974	538.057	895.743	206.618	453.31	360.271	3638.04	177.608	130.138	386.958	1305.16	184.112	1077.34	285.89	781.206	68.9052	1164.73	823.195	1935.62	43.8185	35.2663	1064.06	24.9017	28.4954	191.646	3167.18	441.255	1494.46	243.75	1906.8	1067.79	70.593	52.2122	404.977	326.785	448.974	368.891	365.638	173.658	298.189	247.143	3288.49	780.887	684.013	732.337	654.821	4349.15	138.908	2264.91	456.449	4087.98	116.754	879.409	449.33	259.563	967.826	126.197	1154.79	55.4083	2437.57	1095.98	153.066	130.936	144.498	107.964	492.493	15.357	116.576	21.3496	8.50441	45.1887	105.336	142.593	53.6537	9.69961	5583.68	11.2719	13.2673	53.8397	50.8123	33.9241	46.0675	28.2648	120.448	13.9701	18.061	29.4803	12.0516	62.1021	22.7682	52.3295	2132.41	759.271	802.99	212.459	284.876	93.7563	87.1465	153.611	70.1929	15.4093	387.404	24.7285	255.878	2867.9	46.6631	125.658	13.2783	330.389	20.4962	236.74	18.9814	215.811	33.7866	16.0381	518.01	51.0879	88.0569	103.06	179.557	241.973	122.812	135.153	416.701	626.586	1627.8	111.457	221.081	525.755	387.977	225.176	249.582	83.4654	136.453	64.8038	836.012	162.619	260.304	98.3661	101.962	295.343	717.265	117.967	2096.18	85.7941	80.3255	3084.89	70.8319	20.0608	79.0992	29.8114	12.2099	53.7086	232.796	515.085	892.041	22.0669	194.952	114.619	54.966	1173.06	454.597	94.4172	89.0803	4411.75	195.958	264.003	354.73	1952.86	380.889	517.024	168.758	137.159	309.185	121.682	2127.34	36.5204	368.781	7011.93	102.918	105.317	941.291	84.6731	490.023
2-hydroxy-3-methylpentanoic acid / leucinic acid	295.788	26.1544	5721.94	57.3873	111.748	1461.04	135.227	734.9	1179.57	512.329	809.784	211.586	33.4676	241.494	239.427	884.625	1414.41	1372.27	1046.21	3187.04	763.505	9157.78	1090.19	9659.67	423.51	882.385	202.158	184.773	304.965	489.869	1477.94	7280.36	291.917	1458.05	192.251	420.543	257.838	1153.91	920.691	3750.49	244.853	110.249	504.056	932.247	1014.6	1041.8	1185.3	7208.15	3083.23	1313.57	7584.12	183.988	2511.28	2578.12	10596	79.0152	843.715	433.876	69.4248	19.1761	7176.79	6002.59	911.404	690.472	443.457	957.179	1367.67	628.949	3310.64	1232.79	336.551	943.409	213.43	360.07	802.108	7335.61	188.015	87.9089	511.517	2671.51	418.812	1744.23	386.802	1928.41	6933.18	267.841	649.173	2586.47	244.744	2334.69	266.607	374.546	424.822	1564.4	928.09	6615.11	1058.4	106.415	17992.2	14.1988	830.657	8690.69	39.722	56.5466	160.231	145.371	69.609	1320.29	1354.52	52.8861	31.7746	3494.39	37.0467	45.9907	91.9249	17.7537	117.418	140.351	103.361	299.865	0	100.459	65.3607	119.04	533.07	90.037	34.6668	5841.73	323.02	554.911	3949.55	1543.52	1226.17	350.648	441.744	119.48	163.152	2560.86	146.311	1506.48	5937.4	157.954	503.073	84.4797	8250.28	46.7099	1955.27	20.966	145.648	178.949	11.7223	53.6161	169.091	233.008	56.8216	128.848	216.834	217.183	357.346	2239.61	389.348	1709.8	143.919	121.058	439.029	490.268	428.264	74.4604	492.293	290.199	32.2794	121.513	388.328	227.634	352.274	663.262	576.448	612.824	177.094	2851.5	88.429	23.1404	1656.24	40.2982	39.6975	331.232	61.3876	2719.89	20.4875	67.1397	1087.03	227.716	131.64	1709.1	140.995	875.209	1830.32	478.261	218.77	898.449	9421.53	580.846	192.499	68.5933	338.768	310.282	22.6924	161.138	27.8091	231.038	236.761	167.754	54.2034	1282.48	7057.63	70.1665	56.5223	3050.55	25.0697	1152.23
2-hydroxyglutarate	202.812	134.078	3340.93	409.949	1224.01	1117.62	146.085	882.498	1382.11	645.519	518.777	757.059	259.065	369.582	1093.64	1435.54	1907.53	1773.84	1425.06	194.331	1134.08	8292.87	2538.9	46.5008	1449.58	1102.62	507.629	522.314	1336.05	167.396	779.181	1898.8	581.716	1059.05	386.49	385.78	384.202	3412.52	433.562	731.863	523.85	687.822	981.701	56.8718	214.758	510.577	565.745	6115.06	1654.54	1080.63	23.6465	876.415	219.393	27.6695	348.068	665.351	415.252	334.779	138.725	496.326	2910.35	1192.9	111.517	253.744	292.744	275.855	342.418	232.901	1136.53	393.584	43.2844	1714.19	101.168	1577.41	139.463	4613.85	812.234	146.927	0	783.85	513.315	987.441	625.114	864.573	1690.73	0	2796.49	0.295502	218.58	140.688	963.308	197.928	816.524	90.219	1492.53	2375.19	326.388	536.74	15278.9	146.432	20.1802	202.335	498.636	54.0447	975.468	591.722	38.014	1068.89	198.875	869.413	627.267	541.236	794.053	760.962	471.347	114.855	208.004	455.166	698.23	2728.28	180.097	1376.22	1111.66	654.12	294.66	2667.91	138.166	168.122	179.26	11.9373	3318.66	590.527	250.966	298.517	709.921	122.571	382.461	951.284	783.239	1238.26	1899.85	3252.15	664.011	231.082	553.591	642.658	99.2222	578.321	102.37	1305.38	93.6678	117.828	1016.9	127.07	727.845	363.652	282.211	109.094	52.2563	2653.24	93.1667	175.83	63.7216	260.95	142.367	576.271	523.308	10.6681	1676.65	222.794	1.45337	121.281	143.706	1181.07	174.279	419.605	554.654	521.366	136.845	72.3782	101.135	192.915	62.0885	283.188	839.97	367.029	48.4799	1645	204.755	172.366	115.734	571.659	354.844	1667.88	394.844	670.486	113.547	3258.56	60.9459	11.8099	1341.99	193.076	754.831	141.989	1222.01	704.49	406.797	435.479	225.521	42.7708	383.626	519.211	158.699	103.159	6530.4	1603.43	725.578	961.179	101.083	511.425
2-Methylglutaric acid	119.766	115.556	381.781	43.0961	400.394	48.4604	10.9577	28.8922	998.704	39.6429	106.149	560.365	36.0052	135.64	280.431	542.713	476.602	175.266	78.7093	88.6714	669.773	458.358	301.176	234.367	253.203	323.939	570.048	1091.88	419.493	738.635	580.723	15.7453	716.344	380.068	455.16	739.229	279.712	244.064	1087.56	357.663	153.846	930.029	1073.87	59.3678	66.0576	728.962	366.634	20.0866	13.9448	21.079	7.43636	326.36	22.655	16.1977	8.07486	152.02	8.06733	82.317	181.714	165.189	12.7574	573.975	139.74	425.197	448.517	645.497	1088.34	352.875	29.9746	779.498	334.739	49.5702	1207.83	297.013	80.6011	19.8807	103.628	601.343	215.479	189.284	1076.9	356.598	349.919	532.212	25.0836	15.468	94.8662	14.474	29978.6	47.5906	167.046	5009.87	298.184	111.134	896.73	485.225	535.602	419.696	15.3902	588.16	51.2175	4.98128	57.9663	21.3659	356.808	193.682	11.265	14.3849	8.9943	45.1465	154.554	9.19516	178.498	331.941	187.614	132.907	312.136	40.5803	72.0678	325.054	112.087	232.623	118.273	108.073	87.286	253.077	90.5135	9.16481	13.831	22.5588	21.9068	23.1302	13.3629	19.639	11.2021	5.32874	127.743	18.6966	72.7072	2005.56	60.2991	274.501	29.4165	167.113	34.1213	106.28	55.7367	221.674	10.1851	187.229	19.5919	38.2384	188.852	2537.95	247.346	380.493	862.859	908.599	882.967	438.381	677.11	798.314	1087.43	736.02	541.451	281.209	304.568	1036.71	443.674	492.955	1085.5	848.333	546.057	331.131	289.99	369.122	464.841	149.065	229.705	22.0788	569.458	1018.95	37.0716	215.539	296.832	67.2234	404.574	162.91	419.812	746.012	137.746	387.715	185.097	17.2692	519.633	339.077	10.4149	327.163	914.548	14.5098	1015.25	398.545	714.483	505.036	132.887	203.928	199.517	1365.44	450.9	412.43	173.94	290.636	112.313	508.695	31.4279	281.426	269.126	169.199	255.93	358.69
3-methyladipate-pimelate	0	751.737	0	55.0089	6.99238	1.37894	0	26.2881	0	71.61	396.224	1154.61	0	1425.24	362.339	1023.59	439.309	2.50236	312.103	178.366	168.697	57.829	1940.53	41.7234	1276.97	467.789	3198.85	3968.36	1491.57	1227.93	451.218	0	1274.93	310.401	470.677	1604.49	360.064	428.35	6186.88	690.1	598.727	1852.9	8.35356	8.9687	75.3943	0	592.883	0	0	0	23.9905	1156.18	2.38956	0	7.25361	757.514	0	15.8665	1206.92	1224.03	0	1807.66	98.7768	87.3124	838.783	160.836	2825	59.9464	2.56989	957.91	48.8654	3.03812	378.801	1314.6	10.0451	3.59798	73.3977	13.074	0	0	1765.92	1093.62	221.555	693.116	43.6423	0	94.5445	0	0	0	6.16832	213.371	77.512	1.02162	582.426	5.18051	373.72	830.441	0	1458.22	0	0	670.017	7.78929	1047.58	39.3776	28.735	0	3.08928	210.893	1470.38	0	14.4142	2623.38	728.265	565.217	1790.54	205.215	593.16	1283.34	962.751	739.269	1263.13	352.832	863.008	260.994	5.47026	0	0	0	0	0	10.7909	7.17774	0	0	22.5316	0	100.217	52.5922	368.232	723.107	57.4861	988.118	0	293.857	25.8128	2579.25	58.0097	2.60792	54.6019	35.0416	230.79	336.753	1035.61	673.463	478.46	1187.57	2032.25	398.071	358.977	254.087	1521.95	915.644	118.466	1481.45	12.2739	252.358	495.041	1813	1572.11	152.121	183.592	0	507	748.66	291.113	65.6338	562.293	413.547	107.009	2238.08	346.779	1259.26	1790.66	37.4912	1313.06	171.304	26.5683	3126.55	0	429.922	2774.32	0	780.911	992.487	17.39	2054.86	0	0	367.549	121.06	800.634	194.484	0	19.7871	406.579	164.547	659.648	198.517	830.497	162.531	220.393	438.565	0	1745.58	1189.37	88.5264	444.502	550.495
4-hydroxybenzaldehyde	1492.37	544.207	5126.41	376.044	302.201	647.134	590.192	343.584	602.873	158.012	217.841	2899.41	304.886	528.233	477.562	564.294	4984.54	1230.53	243.654	762.128	5963.39	539.246	505.247	1247.46	1076.89	383.448	888.067	970.925	552.905	1650.35	728.203	307.436	1103.94	1638.02	1006.73	939.095	195.935	102.484	1965.9	861.061	1022.59	357.065	108.654	796.623	210.621	673.755	1530.27	1708.32	201.564	199.577	83.5334	510.437	741.201	392.953	105.155	406.39	49.9297	502.805	346.463	357.67	100.762	8923.29	2150.66	1898.35	345.993	4394.15	2416.46	1067.9	430.213	3839.62	442.053	611.897	610.857	1366.71	439.066	86.0486	387.979	717.803	631.675	918.338	1004.44	5688.75	5182.15	1314.12	1233.69	100.482	2301.62	1364.21	1976.03	193.082	319.19	3519.2	625.473	1590.99	280.5	2067.14	2778.27	859.945	64.5131	1206.88	1466.59	152.692	312.478	409.432	513.429	565.89	230.276	365.3	887.1	548.438	369.334	354.695	466.344	289.099	413.464	598.246	393.263	391.985	308.035	310.648	222.828	419.66	267.328	344.776	487.866	1214.39	666.749	107.907	228.197	261.591	462.407	483.98	463.085	125.318	268.449	964.084	138.299	285.773	272.519	236.795	278.277	1435.08	171.002	445.449	837.937	192.516	195.982	1167.59	361.729	251.12	440.933	390.716	867.792	290.402	1214.62	702.762	213.017	662.259	739.019	731.327	1191.63	2405.16	2234.66	721.028	808.585	1491.96	841.949	326.974	657.936	619.282	837.936	1460.74	905.037	771.703	464.22	912.833	521.684	179.545	553.238	74.8274	366.484	1160.94	903.477	835.423	312.869	440.542	776.361	854.629	403.623	594.048	373.027	1956.27	525.507	189.054	759.78	800.485	164.104	456.05	1263.07	541.409	227.783	858.428	1503.74	550.662	442.38	364.091	1142.65	512.987	258.839	859.498	720.574	155.416	1091.02	219.561	196.951	535.532	924.22	555.129	311.996	201.103
4-methylcatechol	1507.62	145.222	30.3396	1240.3	139.924	5.85767	0	23.6063	137.516	4.36859	45.5056	5.60086	99.705	58.3007	11.6314	609.448	26.9635	10.8206	5.579	10.1014	6.97684	5.46784	15.062	19.5951	6.18548	46.4555	28.591	53.2679	7.77243	321.883	413.006	4.82665	7.51544	40.8653	53.8827	430.61	289.912	7.6604	43.3802	248.579	22.9243	1079.43	17.0116	12.9877	7.51237	19.2353	33.6426	10.6553	6.49709	5.12887	5.16451	601.475	5.56235	6.40795	0	11.68	0	9.29725	96.9982	19.523	5.37433	4.78926	66.8917	21.0403	60.1485	255.355	71.0989	12.0391	6.24376	16.4917	190.67	147.537	22.878	6.66397	1192.33	0	236.136	3.90386	42.7753	2.11103	103.27	4.19806	6.60302	4.20814	0	6.71185	7.14388	3.82926	7.17896	4.54895	30.4519	63.3348	11.4093	101.488	13.4079	2.59994	5.74152	7.40453	3.608	6.08041	9.9754	8.40345	35.873	9.24956	82.2568	414.802	5.05354	0	19.8712	30.9571	247.78	0	50.9797	1406.3	134.036	88.8205	1367.7	69.6235	41.6457	197.093	1029.07	135.093	380.738	31.9998	188.693	4.79239	3.66377	6.60167	2.7186	6.87884	8.25383	8.49445	69.7354	5.0554	0	5.44165	4.92089	5.60167	13.9457	4.383	3.63088	11.9357	16.5968	3.03739	11.193	23.6753	5.79456	7.79893	4.20693	91.425	10.0938	4.20468	7.57616	5.70474	8.60376	210.504	84.8098	266.541	147.105	57.6716	29.9096	58.0117	46.63	100.388	259.307	15.4332	9.21737	75.8467	14.5799	27.7906	1672.26	17.8026	145.135	5.8287	41.5327	27.2163	8.76045	8.41676	50.9091	2.81055	58.9344	109.689	7.74835	20.1881	31.2987	4.79109	7.69681	3.77456	29.4891	10.9047	7.08904	6.56585	106.384	0	8.91471	5.00523	7.36992	4.14884	28.4799	3.34988	7.24784	160.312	10.0395	10.5228	7.73772	6.49266	8.13961	10.5867	58.1342	195.832	5.96446	24.6285	6.09869	88.3107	0	20.9611	9.92831	7.96195	56.2139	116.38
4-nitrophenol	735.922	41.1237	41.2858	36.294	75.1944	147.636	7.77959	628.841	417.287	165.644	270.975	184.754	108.698	993.739	18.2437	13.0217	139.569	467.689	1263.08	108.068	35.6474	35.3322	95.0783	70.7227	23.3119	41.9301	13.8464	5.88837	17.423	489.479	26.2162	133.721	23.5653	226.505	28.5553	410.674	99.298	45.3677	31.153	455.197	116.776	18.6205	266.266	950.11	69.4985	114.108	63.669	193.674	8.8402	223.65	43.7998	1147.33	4449.24	2878.36	33.5382	103.364	15.6341	144.209	4.67549	138.628	0	1566	97.952	69.069	2334.07	45.1487	1.20655	310.116	17.0883	621.753	9.19237	409.921	69.9461	36.4528	28.3886	0	454.598	302.682	347.541	40.6694	24.5069	588.437	19.7614	138.187	114.563	9.7505	92.267	184.94	192.886	12.0225	512.008	15.6372	67.2449	93.5208	109.626	107.972	32.8415	10.6985	99.0745	878.877	339.869	1.52827	59.9738	1758.9	46.2143	1104.51	62.9841	20.4958	51.9057	1547.72	212.089	71.0093	38.0351	185.524	18.7215	34.9125	33.8595	85.122	61.9669	1289.55	32.3172	191.184	124.512	109.114	543.87	47.8163	72.4932	30.8088	54.6609	625.287	72.1677	189.593	67.9014	11.5505	379.759	68.2253	319.009	18.6236	24.2617	61.6112	173.927	36.926	148.478	112.295	1417.83	44.5806	88.2959	131.582	42.0353	296.116	5.73781	307.423	1037.47	27.6002	102.399	3.45992	30.5758	828.926	7.91154	20.4296	21.919	5.57005	0	16.8398	21.3561	1.07548	111.227	22.6554	26.1041	0	56.5293	306.78	10.344	185.766	8.91551	6.22973	0	551.275	5.24441	69.1167	21.0514	16.9373	54.3955	340.993	4.95318	152.384	102.329	72.7511	156.98	831.613	90.9796	21.1406	15.623	0	341.654	229.137	32.1987	79.6929	186.094	114.866	260.43	122.213	24.8524	156.267	195.171	120.173	20.0405	130.887	42.5286	8.35279	18.1818	374.427	299.27	323.247	57.3786	104.388	17.8337	42.3215	23.3584	19.3584
4-pyridoxate	5751.9	1538.6	8604.46	531.664	2312.11	2975.38	173.878	1769.13	15757.4	2085.87	1305.55	4280.19	840.818	1368.55	13778.7	4212.77	5786.46	7939.11	1163.69	4605.84	4669.96	1120.7	6379.78	2108.37	4941.97	2321.16	6495.9	10493.1	8097.24	4867.92	3491.6	730.007	11.9015	6761.62	18408.7	7159.11	5070.06	3647.33	8165.68	4751.52	3882.05	4845.82	876.639	1962.73	1387.36	2411.37	6330.13	4880.99	272.143	2277.37	1442.13	1848.57	3360.62	1279.67	1364.67	1678.46	863.421	3990.91	1285.61	2215.68	1025.78	2716.3	2798.14	3718.89	6346.46	6754.94	27181.3	4405.1	2861.71	6508.47	2682.09	7346.4	5796.88	4718.04	4272.88	56.0495	3571.61	1467.71	5309.04	185.09	16.6859	3200.74	12242.1	3772.43	368.686	1892.73	2541.21	1739.2	4410.17	4096.18	4200.04	2365.04	4947.07	3298.77	2502.61	648.04	3793.39	26349.6	4770.1	2660.39	19671	745.176	1079.58	620.915	33.7435	2578.91	407.992	567.357	360.868	810.004	150.865	557.767	1590.71	3153.17	1601.61	1877.74	1520.03	3549.28	1663.59	1415.2	707.035	3460.55	7646.86	2039.43	1265.61	234.611	3106.05	2399.88	702.943	4172.65	3782.67	1953.86	1678.65	268.275	521.037	1791.36	1360.25	630.859	2870.09	1273.51	2889.16	14.9481	843.967	4602	5058.27	4224.91	814.746	3928.99	335.329	969.088	369.571	1919.61	982.752	1668.94	1068.25	2896.8	1906.85	2077.71	2450.9	2307.03	3186.02	3324.34	1803.2	3295.05	2179.34	3887.5	1622.76	8854.1	2085.08	1456.27	4840.72	6216.63	5358.84	2636.05	2639.79	3120.67	3980.13	1237.66	1731.25	984.256	2780.46	5194.5	1330.86	1633.11	3562.43	517.5	5004.62	1425.56	2340.73	3629.63	2067.51	2244.35	4335.29	384.253	5783.85	1845.03	1362.96	4911.55	2212.7	1524.21	1324.9	2012.33	3688.22	4364.57	1582.17	978.457	3425.74	5170.34	1175.99	3526.42	1846.88	2639.74	1888.81	2611.11	176.672	1672.23	1942.51	632.754	1500.6	2690.02
acesulfame	146.049	557.593	0	291.826	977.104	0	64.2741	73.8307	704.578	1298.26	0	104.779	0	44.9531	349.92	352.162	30.2558	4594.82	578.838	7613.3	147.328	3328.61	4382.29	0	0	67.8345	0	0	235.381	919.88	348.561	0	20.9354	779.999	131.25	0	263.833	48.8546	0	0	0	770.685	0	49.1999	140.648	2833.47	0	1443.26	598.377	182.774	0	2718.93	384.647	0	131.838	0	24823.7	5182.98	0	0	0	4.08194	225.489	0	0	147.408	0	23.2741	0	253.814	0	0	0	0	0	0	7572.64	147.63	0	0	0	0	102.44	0	4751.09	12781.9	7438.28	0	118.005	4.95387	0	0	0	0	1596.42	493.053	670.038	0	0	437.286	272.367	0	28.9185	0	0	115.83	0	15.7702	190.717	0	866.919	0	0	0	0	0	0	0	52.2855	0	0	551.241	436.01	44.6305	1051.76	229.947	0	1744.13	0	5339.2	0	326.314	8246.19	4062.46	0	0	0	0	185.125	2889.88	8982.07	0	734.166	0	39.722	0	2400.92	461.621	0	0	0	0	0	0	15743.5	0	0	91.9243	0	1038.38	22.4425	475.898	0	0	535.862	0	0	0	23.8546	190.303	0	43.2753	0	0	9888.09	87.618	1910.68	2918.31	534.705	5.64396	0	0	0	0	82.2087	35.7427	0	0	275.041	0	1812.38	377.406	40.7376	0	0	0	0	0	35.3773	540.222	4854.8	0	0	451.918	0	124.074	3252.93	169.701	20.8588	116.853	106.125	0	80.019	0	0	4.30012	0	0	0	157.247
acetylalanine	261.271	15.1277	208.689	33.4453	170.086	61.9607	15.0605	135.19	166.184	133.982	104.794	97.4624	24.0949	76.8656	124.774	221.778	181.92	145.424	46.862	495.312	151.44	608.099	314.328	211.528	186.572	158.007	211.493	412.226	197.111	459.559	183.445	655.431	81.2049	229.335	109.708	155.414	171.628	68.7257	238.181	283.796	197.513	126.054	676.797	185.7	48.8994	141.18	102.698	490.227	563.927	115.031	313.966	82.4935	853.68	132.805	353.841	93.3127	298.098	454.687	96.3761	90.4344	703.652	287.84	342.352	301.29	88.9455	282.44	124.088	50.0857	576.85	390.295	222.676	636.487	126.638	282.699	125.819	601.59	153.47	224.009	156.64	951.214	115.472	460.121	167.632	98.6248	671.556	114.299	150.646	155.804	85.71	362.242	47.3845	100.402	233.604	164.456	121.069	1210.49	234.67	41.8068	639.217	25.9397	192.419	300.229	118.901	9.73411	30.6138	37.1698	14.6892	35.6954	17.499	53.2822	9.91929	120.121	26.2111	18.0666	103.428	100.601	14.1083	33.6306	127.122	69.1927	25.095	13.035	35.7751	32.4427	50.1318	119.029	43.0206	755.364	44.3981	389.823	107.045	204.285	381.876	83.9685	56.6004	54.6368	35.9152	306.059	37.6743	498.14	599.496	119.591	66.8797	28.1333	338.649	97.2192	136.837	98.1629	139.283	40.066	1.67813	49.1373	78.2237	202.776	155.292	80.5656	266.521	201.314	91.2262	161.986	100.142	1249.76	141.849	173.653	332.37	378.252	142.794	162.038	76.9075	357.471	135.995	212.896	41.0036	233.495	268.365	98.6985	275.922	126.191	191.788	102.553	19.3958	77.9265	402.967	179.324	100.616	190.868	109.42	134.427	183.16	111.209	164.703	137.941	160.535	632.423	78.2497	20.7729	242.061	194.151	112.891	80.7824	201.088	323.791	316.404	117.669	97.6649	200.321	430.769	98.6794	430.745	85.7343	40.8275	249.412	154.56	216.84	189.79	55.5142	298.31	522.317	151.34	241.096
adenine	57.9458	438.951	296.616	74.7872	89.1398	17.3648	90.6193	58.3023	60.0778	31.9456	54.1447	213.701	258.634	93.5754	99.8843	139.006	588.34	73.1126	42.3664	71.8317	133.074	134.967	49.3702	19.7277	129.042	159.639	1298.63	91.0521	397.419	17.8998	355.124	32.5472	521.528	188.029	98.9113	214.008	50.9833	126.232	407.487	354.29	175.289	783.155	699.325	25.6459	66.3735	300.729	291.702	16.6345	23.3065	604.52	61.4374	623.876	37.471	19.6387	76.5711	435.735	6.03185	41.1401	552.167	151.018	21.228	1209.03	78.6603	103.547	68.9962	48.6702	129.069	60.1523	33.5455	45.2338	52.2157	65.0014	133.106	112.201	145.159	52.6637	40.8613	12.668	10.9106	19.4791	658.423	117.253	217.283	52.768	113.566	38.0348	2329.98	41.7245	61.6975	21.5279	453.196	249.653	77.6704	129.512	30.4002	40.8982	41.9056	62.4129	36.4426	2343.57	150.649	94.1475	342.947	221.937	273.312	261.571	120.693	685.199	501.276	530.038	4836.25	86.4051	149.644	2294.36	126.483	360.743	782.84	58.4143	282.398	311.402	829.375	7448.91	237.091	79.9525	1341.05	1136.05	29.0149	32.2274	323.367	138.655	765.39	59.04	61.6943	51.9339	208.401	24.4217	40.8577	113.469	324.475	19.9916	270.52	281.238	543.291	61.8191	77.8027	154.317	6034.63	248.797	857.265	208.538	917.912	4414.04	6609.82	9677.52	6909.96	995.069	224.73	249.216	266.992	541.448	403.352	763.11	524.581	952.694	173.692	34.3853	68.9004	207.625	367.164	28.3306	250.879	152.115	195.695	21.6569	123.902	545.802	149.648	90.6891	86.5952	40.6035	272.024	230.21	42.0874	127.679	107.394	178.142	3310.45	59.7473	306.048	120.9	82.5541	39.472	24.2794	22.4993	71.3729	121.111	104.725	30.0179	1062.11	38.9254	43.245	256.411	422.882	157.471	32.5802	146.117	95.8727	83.6277	214.054	282.217	182.675	48.4889	22.0329	100.134	82.9291	379.613	52.5122	155.489	112.529	54.5696
alanine	8191.74	254.605	12880.9	245.939	3437.88	2821.11	182.143	1680.75	4918.23	4792.77	4251.62	6625.84	180.18	499.563	3928.08	3063.38	10508.2	6370.58	3065.13	10530.6	8435.9	15661.3	5328.26	7914.76	5333.96	4760.97	5338.55	8233.6	2157.56	5727.82	9780.31	10977.2	4848.5	7648.92	4392.2	7703.35	1853.87	4146.58	10374.3	6932.74	5288.86	5659.89	10793.9	5360.97	2143.12	4159.95	9127.94	1916.78	8682.97	2164.43	11420.1	1533.82	15755.4	7495.26	5259.09	1162.46	3122.93	8384.71	459.654	1175.2	10349.3	13202.3	7871.51	8009.55	3721.91	10103.7	6794.7	3931.44	13409.6	8913.86	5289.73	4990.92	4055.02	8905.15	8754.5	15206.6	5258.74	8060.34	4658.79	12227	8189.17	10096.2	7960.15	4605.46	12714.4	3961.43	4708.85	3663.11	5347.99	6892.42	4739.6	7033.41	4510.96	6946.89	3445.4	16445.7	8240.32	3847.59	7885.81	2232.91	2890.35	1688.15	289.145	334.552	910.982	461.69	277.254	984.688	539.247	932.736	118.961	5690.38	182.21	410.36	1714.88	254.308	655.849	1751.52	1050.13	1356.11	87.4572	650.957	236.744	354.918	463.678	1995.51	1385.8	8068.25	2219.34	7630.52	1905.83	5429.15	13295.8	2121.25	953.273	2001.22	513.774	6731.32	584.055	9604.7	8230.23	3325.86	326.843	386.727	7201.03	1014.93	1857.22	1307.29	690.075	264.792	9.05315	4407.27	2929.22	5276.35	3770.96	6342.97	9210.02	2744.11	9687.25	6650.56	7784.52	8129.07	7938.2	12080.3	8463.26	9056.93	5500.77	12778.1	4066.84	7561.75	4060.48	9117.96	4993.05	7808.02	10134.1	5882.21	6576.74	3224.91	4009.94	4601.44	5298.62	3349.49	15389	4659.4	3866.89	2402.67	3924.37	6938.19	3686.05	10372.3	5280.88	6825.23	2871.5	2843.05	3934.99	1516.65	5449.23	8321.99	10145	6742.66	6388.89	7677.16	11392.9	2131.98	4552.03	4754.16	10241.7	7614.17	4598	5583.3	3232.88	6498.31	5144.17	2538.19	8118.61	3395.22	7340.09	7322.99	4213.41	2967.16
alpha-hydroxybutyrate	32.7535	31.7497	692.326	64.7021	81.3763	65.193	198.875	56.8318	39.3652	315.049	36.5397	510.767	49.7763	45.3802	159.661	78.0582	65.4554	181.723	168.184	2630.9	62.6553	2312.62	97.3626	1024.46	182.664	261.187	174.769	37.5091	220.379	82.4284	289.554	4146.32	82.5208	121.964	41.9079	72.8588	28.0657	135.675	48.1267	70.5641	77.7021	77.998	224.665	188.716	129.675	110.751	503.366	211.474	2212.82	736.248	225.76	83.9247	2632.24	190.573	7522.6	19.9791	1503.33	509.29	15.8274	56.4614	523.856	781.142	132.97	508.196	637.904	88.3294	19.7606	43.034	2303.44	28.9847	41.8674	259.566	26.5675	82.9941	113.736	8523.93	66.0432	210.314	21.3967	5098.94	73.6175	437.8	367.862	33.2005	8341.25	219.379	143.809	1505.27	113.383	904.006	98.4422	61.2948	186.225	317.555	188.22	5361.74	103.258	21.6741	797.936	351.823	106.83	125.962	90.193	38.1527	63.588	17.3597	35.3156	236.923	122.14	147.318	46.9175	102.056	35.3912	34.0321	301.265	144.302	31.7778	42.1454	8.36082	99.5907	227.725	183.511	75.5179	24.8234	106.441	14.5116	145.139	1915.25	29.4897	48.2602	1434.19	568.91	2466.87	17.9099	34.041	21.0465	88.6843	1743.8	29.0286	2444.12	289.008	67.136	54.0847	9.83568	1148.71	31.9395	573.769	74.0161	17.6797	33.9755	24.2117	35.1848	35.8957	273.722	258.059	20.4951	60.9061	17.5936	59.515	170.542	192.925	280.954	35.0142	71.8149	44.4973	94.9731	100.395	105.684	27.7212	80.7687	19.9217	120.005	30.7226	16.2232	5.92615	115.413	197.606	23.0877	32.5231	80.0562	23.4256	6.20046	412.996	207.307	51.1859	642.358	507.526	164.191	60.1182	45.4553	113.225	152.961	372.63	3249.17	87.0489	167.256	489.352	160.578	31.6356	84.7931	321.107	44.3443	386.77	34.9066	37.0171	23.254	132.663	73.5751	215.391	16.1682	444.412	23.5249	84.2377	25.7406	3311.39	171.747	62.7832	268.555	9.72144	117.028
alpha-ketoglutarate	564.834	0	349.315	0	46.4008	15.5187	0	0	72.0769	13.1273	13.9648	85.8755	0	0	23.9846	67.3023	239.849	62.6193	2.96618	155.667	616.216	28.2922	136.402	332.931	66.6532	69.2479	57.3791	34.448	157.366	24.9573	21.6608	23.563	0	234.644	57.3301	40.5012	110.567	24.8419	50.5679	203.52	116.802	82.1535	28.0739	156.321	61.7298	5.14226	514.096	63.465	113.111	95.7923	9.19732	0	746.893	17.481	63.4611	0	13.242	41.5427	0	0	40.6213	257.048	9.34621	134.124	0	49.5571	64.9555	26.9169	68.0844	107.832	90.6139	314.131	24.5392	118.489	117.373	28.044	126.486	70.7752	28.2164	181.583	114.648	193.383	357.557	27.9143	394.47	36.0605	5.23836	78.8873	20.672	31.1742	7.71274	155.196	72.1732	129.384	40.1532	605.732	309.816	32.5523	25.7604	17.2974	51.4886	8.03704	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.43587	0	0	0	0	0	0	0	6.73857	0	35.3808	0	98.1851	23.7545	0	0	0	0	105.99	0	131.619	116.55	0	0	0	271.845	0	36.8461	0	0	0	0	7.41427	49.1939	42.6936	109.41	147.936	44.8261	81.7975	17.3728	59.6451	101.221	70.8954	34.3163	64.9514	18.6544	26.0123	97.6587	25.9715	95.9149	19.5501	13.1424	38.1893	36.3622	70.8602	55.343	54.9913	49.1967	48.5432	2.7016	4.77669	31.9224	74.3079	42.5364	20.2223	7.13819	38.2298	3.92078	17.1561	22.3025	4.58297	5.38919	66.8862	1.90136	12.9182	7.95281	10.104	11.6854	26.4793	55.1444	7.73674	14.6931	84.7407	204.816	12.83	8.27523	22.3415	86.0711	85.779	33.0277	63.9525	8.08375	22.9865	25.5504	6.03905	4.72624	25.0971	28.0833	68.5191	27.5328	17.6202
alpha-ketoisovalerate	1288.08	11.1852	1757.35	7.63654	170.585	168.654	0	59.1738	194.281	72.2438	62.9857	822.653	2.26829	0	334.93	456.433	1258.06	386.922	74.5806	757.936	1845.52	432.174	584.274	902.041	880.309	193.374	477.112	834.057	570.405	404.056	388.609	141.67	703.298	1185.33	314.029	431.684	227.111	30.7706	613.56	1050.23	561.838	146.457	35.8661	529.766	320.235	351.041	1163.29	352.434	334.395	546.841	70.767	51.5274	2100.3	53.807	118.405	58.0239	7.15913	141.611	23.794	31.716	226.916	2042.02	135.902	1067.1	248.733	1315.14	883.553	335.791	68.0262	1107.54	239.038	300.662	279.421	1097.96	399.839	33.4606	203.456	851.816	644.699	199.606	847.902	1609.77	2656.4	686.931	383.336	19.0924	37.3605	356.452	210.069	46.171	48.6648	717.664	330.202	843.147	339.674	1125.11	743.33	388.799	117.406	18.1637	165.696	29.7461	6.12213	11.027	71.6054	17.1197	8.93089	19.9965	0	16.6736	0	16.7792	23.2258	8.86851	24.6539	11.2726	23.7805	88.6968	55.2389	12.8946	7.05843	23.1724	0	15.3801	17.6471	914.886	56.7643	34.775	4.78683	116.361	5.70997	91.3448	72.7555	16.0096	0	17.8422	44.674	141.322	14.2019	329.305	667.95	220.417	13.2144	98.2302	339.263	30.2421	15.8906	36.0066	9.92864	0	0	16.5583	28.1584	62.8241	37.5543	554.694	159.813	186.681	315.439	501.787	592.876	554.061	500.594	143.589	409.765	429.465	416.201	126.024	133.067	211.812	215.117	228.843	465.355	427.465	120.419	326.601	554.506	54.7894	0	23.9188	186.353	290.661	211.541	125.431	85.5571	86.0313	70.8068	49.0664	56.2711	139.904	12.8664	483.467	13.7363	27.4849	47.6578	49.2622	88.8166	260.375	780.502	92.9005	80.5518	208.528	430.438	134.905	127.282	92.5123	222.187	128.085	74.7058	296.018	72.8524	222.309	34.4673	87.5144	109.091	163.205	402.127	209.029	160.089	43.8495
arginine	37.1656	131.121	19.4448	33.2281	12.0549	11.6477	0	17.4549	112.474	71.2511	63.9787	44.1802	128.654	115.161	50.6986	18.3167	9.18967	350.012	88.8036	51.5787	8.26528	4.61517	172.578	45.3891	291.805	143.586	31.4714	30.0949	137.877	13.7722	32.8738	82.378	19.4651	10.9872	127.042	45.8344	63.0741	61.381	13.4297	26.2508	91.3075	31.9046	161.236	35.5739	12.9592	50.6353	37.0531	73.2598	161.965	32.3336	275.12	118.029	885.83	99.797	95.6792	69.2596	927.739	30.5027	27.7051	55.433	24.8533	243.02	61.1009	37.5815	28.3577	19.9381	8.24686	23.5535	306.724	11.1758	50.5799	150.44	17.6934	787.756	17.7036	8.35159	59.0896	10.6148	39.6211	542.489	8.67199	535.283	80.1988	12.7321	208.325	81.342	705.805	73.1213	84.6798	509.864	36.2337	11.6634	100.084	26.612	11.0361	129.383	31.9141	14.4416	36.6303	383.851	81.0419	21.2098	47.8081	76.8672	28.7901	27.2605	38.9505	32.9294	65.3833	78.1467	13.9535	27.9381	50.4855	25.5639	185.46	79.8692	21.0111	93.8322	39.7881	79.0517	16.3452	73.8057	47.2027	25.1377	119.046	143.077	144.275	338.948	60.3524	934.4	40.7188	408.469	14.7841	43.113	16.2419	292.729	28.0022	601.576	92.4383	740.541	85.1756	285.025	46.5243	17.5	127.627	17.9709	317.242	195.403	19.6021	44.6685	5.47192	24.1333	361.848	68.6128	548.201	18.3332	195.094	81.7727	110.541	12.8574	53.0823	24.9234	18.8267	138.394	22.7373	477.517	13.3674	22.4067	29.8257	336.441	45.5812	150.472	24.1187	82.3691	55.1794	113.17	27.964	36.1181	80.1668	68.1966	30.6244	10.9162	282.789	37.8549	179.006	494.704	32.2323	32.3003	167.06	52.3904	37.9196	26.0604	86.2101	187.792	30.6116	16.2698	64.354	383.176	0	293.413	92.9521	24.8623	64.0592	12.5526	19.732	44.0142	1029.21	23.2155	17.9913	6.8125	0	83.2178	26.723	9.00017	7.5467	47.807	115.057	104.669	111.822	91.5077
ascorbate	3794.71	174.147	13469.4	430.133	10343.6	54.6704	0	394.431	6720.12	7830.9	6135.3	5793.36	108.123	1566.93	14257.8	12544	13920.4	5631.19	5244.49	7414.06	7195.98	2178.52	6259.91	9524.02	2299.96	17527	10674.3	7707.32	11807.3	2147.7	15893.3	1151.03	13504.8	8203.75	9719.32	12066.4	5366.44	10195.8	13800.4	12749.3	3709.24	12323.6	1250	9169.71	10319.1	17.9919	9090.83	3470.81	60.6104	2724.28	3863.75	2367.56	122.206	666.163	3045.72	3513.84	4368.07	7683.9	11781.8	483.03	2776.76	8010.61	1394.99	3952.09	20455.6	3920.96	11208	9508.15	1419.91	5065.31	2052.73	15122.6	7243.77	9117.8	4613.4	867.678	2025.07	3111.69	8115.28	541.426	14459.7	2006.22	9479.42	339.876	1121.61	113.029	756.402	71.7049	8362.93	297.385	4691.09	11437.4	9519.82	100.674	6223.46	1840.92	4033.03	7753.8	799.129	11062.5	8044.42	1335.92	391.813	172.131	2164.16	3162.14	70.4198	0	23.6207	944.26	7054.05	0	509.16	3182.06	5575.89	828.047	4671.28	2434.06	367.388	27157.7	178.222	2167.5	867.859	2382.73	4399.22	1335.12	450.805	1300.47	45.5315	32.8452	0	43.9456	4208.35	185.483	12.8455	185.81	427.677	31.2598	166.161	6669.24	9083.73	925.837	82.793	4535.09	483.529	13.8622	14735.1	856.577	147.863	713.746	285.121	4901.03	9149.74	7404.87	4614.18	8069.46	9322.82	15476	12776.4	10794	12109.4	13936.1	16037.4	13688	7390.26	7040.45	9672.46	17525	7419.33	2282.58	12705.9	9665.05	14639.3	858.76	14879.7	10934.8	14181.2	9425.77	1027.31	2580.51	11361.2	46.9151	6230.35	11955.8	4402.68	6817.42	6003.37	1992.6	8105.02	2980.92	5231.3	8387.97	7989.24	49.4928	9535.86	8999.43	11360.4	8113.05	5803.83	136.563	10111.8	6906.9	10229.1	12945.8	4299.81	12360.6	2169.6	11132.4	10823.5	7289.68	11129.9	7863.6	4138.52	8749.02	2449.03	8979.08	2413.34	6051.68	6130.34	9410.18
asparagine	2012.71	7.84123	90.623	0	75.9631	376.678	0	0	630.684	58.6739	226.792	55.4628	0	0	212.458	40.7535	0	136.525	79.6392	612.592	1389.78	10.739	155.618	264.314	15.9001	71.2843	459.727	440.986	28.5975	34.9289	75.641	2081.68	46.9938	89.4982	9.64381	735.801	0	714.152	24.6545	25.773	0	97.4036	0	99.8089	16.4502	24.7333	8.31085	20.3379	0	6.12904	494.649	0	754.836	477.918	23.7199	158.228	1367.18	1028	0	13.7184	4485.94	452.676	29.2964	816.366	1586.08	43.5697	130.678	35.9201	4692.26	51.5418	300.499	136.59	245.75	2193.51	35.0255	322.341	124.145	47.7803	1460.58	21.2328	102.672	271.97	57.305	147.657	34.2168	526.044	28.7376	146.93	75.0102	1183.75	469.32	91.4122	2297.47	66.3747	39.531	2912.3	2318.25	82.2398	4018.26	7.04259	129.591	39.8446	0	0	40.6651	0	0	0	0	0	0	0	0	0	0	0	7.6456	0	0	0	0	0	0	0	0	319.607	64.8896	224.014	4.73792	873.332	35.6122	0	176.059	0	0	245.25	0	2012.96	0	1904.91	26.7589	24.255	0	0	0	7.00344	4.5073	177.26	11.1718	9.59138	0	335.492	133.404	75.7192	0	84.1027	130.372	226.716	99.3776	35.139	87.8058	82.9853	80.8087	183.369	12.1339	2352.97	507.29	31.9815	59.9562	1593.29	43.4415	56.4033	54.4731	33.9926	34.0661	81.3495	33.3046	178.367	224.098	25.6747	65.3599	51.2772	3992.99	45.0139	1225.7	9.21194	6.34114	742.043	172.214	354.292	526.846	1003.96	424.265	838.253	112.335	58.551	62.8522	572.341	160.544	572.553	129.004	183.615	519.25	0	163.449	1056.96	3662.26	297.533	20.7396	29.231	116.965	1249.86	596.901	39.0387	74.7718	48.4272	1112.35	100.35	337.759	461.637
aspartate	13644.5	2257.11	14939.6	1474.72	7435.23	4017.53	181.107	7205.84	11394.8	9707.27	10196.9	19815.1	1311.42	1811.83	13098.4	8465.32	6570.26	20135.9	5087.74	26230.7	18707.4	17311.6	17351.5	10443.9	17786.2	8895.38	15978.5	20749.1	8292.24	6193.03	14653.5	31905.5	10566.3	19013.1	11396.6	22996	7411.31	9886.07	10658.5	11592	15422.2	13239.2	11851	18174	6101.4	12228.9	8378.92	12832.6	12650.2	5609.05	7410.72	9739.51	24308.1	11383	8623.58	5961.56	7809.85	18124	2315.02	8971.63	18842.1	21664	19758.5	17963.9	15252.8	14845.5	10132.5	7850.18	27304.1	18951.4	11052.3	15709.4	16553.2	26288.4	18766.8	27672.9	17927.9	13879.2	11852.6	13791.4	15982.1	17408.3	8801.34	8987.05	25389.6	3575.39	13725.9	12268.3	16301.4	12571.6	14421.5	10662.2	8004.01	13597	11945	27484.1	15907.2	7483.82	20765.4	9937.35	15683.7	3357.43	2790.31	1903.02	5818.55	2635.44	927.048	258.099	474.592	7662.17	1668.06	747.407	3025.42	3798.97	13461.5	2787.31	5533.85	10447.8	6231.9	3914.08	1201.84	6758.17	2923.87	2252.6	4794.2	5571.32	6019.2	12130.1	789.654	16677.4	1399.89	11882.4	2137.52	15608.9	133.073	10539.4	2283.55	19100	3795.91	21117.2	14199.5	15230	1386.39	3861.86	25109.4	6659.77	10351	5831.04	666.914	2272.44	567.172	7474.37	13567.8	25269.4	11620.9	9498.77	19586.9	9383.79	16897.4	12300.6	11452.1	11872	17054.9	20682.5	13429.2	19466.1	12182.1	15588.9	6250.46	23511.7	8029.91	16368.7	8287.09	19395.3	19620.6	11975.3	9814.57	16602.8	6709.86	5489.51	13261.5	7521.83	21054.5	12947.3	7732.17	18923.1	6411.08	13309	9090.91	19763.3	9527.46	18758.2	6705.5	12092.7	11092.8	6160.08	5419.16	25130	12393.5	11143.2	11234.5	19229.3	26389.4	4018.65	9983.02	13938.4	25818.3	16483.5	11340.3	12529	9999.95	15222.8	8971.28	8697.71	11924.5	9063.76	19817.5	11183.4	10409.3	7391.34
azelaic acid	218.768	115.022	467.787	73.1913	143.749	25.7478	32.0783	73.6899	284.636	69.4907	95.6349	234.768	121.762	79.1885	261.43	1047.37	457.882	172.442	57.986	77.6945	342.191	52.3605	209.353	110.054	689.036	311.027	309.688	3395.25	306.017	396.292	418.229	46.6541	2575.79	193.852	328.483	607.396	112.483	298.106	2003.03	1261.6	169.73	373.054	244.731	264.669	99.6228	67.8763	352.406	214.883	34.6559	114.55	30.2202	737.461	113.419	51.4978	25.9765	298.177	29.6617	157.203	63.1327	201.529	32.6191	320.56	99.1667	270.015	173.831	535.904	1742.9	196.832	54.4048	347.869	136.021	142.405	310.542	263.363	190.351	36.8257	127.826	126.091	120.993	13.7305	2897.17	153.526	1504.1	444.981	36.3925	24.962	54.7311	150.993	120.845	105.072	212.409	291.228	345.523	143.158	107.971	14.1782	418.923	614.022	74.0557	125.509	135.569	38.1873	248.014	63.3939	1230.34	286.936	50.9929	33.3357	25.1885	98.001	307.014	15.539	321.148	682.537	141.59	88.7996	743.529	43.8584	414.705	321.92	315.669	608.289	187.463	139.792	225.454	423.356	80.2756	37.5351	29.2158	96.0174	54.2763	56.7489	20.2192	23.0054	32.9079	60.3946	214.638	142.95	62.0653	85.2842	192.729	1116.81	77.8493	1413.6	33.0011	469.315	29.0543	485.911	22.4667	40.2817	48.9397	31.7768	87.6277	101.434	191.388	668.132	526.436	294.673	330.391	644.726	328.579	750.811	2433.91	549.805	223.158	174.475	232.87	292.54	236.983	139.303	941.696	424.553	2493.34	230.446	156.066	998.129	192.147	191.787	44.6519	163.319	54.5823	2805.7	53.3067	115.524	139.056	20.6772	138.113	189.445	176.321	120.535	38.2955	85.7707	91.422	38.3788	154.885	79.6006	15.8886	143.019	117.338	36.7609	74.9509	146.973	834.475	130.455	74.2763	62.9277	81.1786	216.302	108.451	1242.73	60.6765	142.668	134.88	138.891	28.8566	257.397	139.956	76.0397	119.928	150.757
butyrate / isobutytare	7249.56	2739.18	5383.43	2341.12	13305.2	775.591	275.838	3557.14	11734	7835.87	9259.94	5579.89	957.5	4825.2	9451.18	14044.6	7878.57	10740.4	1734.96	11303.7	3002.26	9679.86	9290.13	11353.2	5563.33	15728.5	9356.05	4836.18	6485.48	17485.4	5301.13	12451.4	4050.33	13056	6809.92	9917.81	5343.13	11902.9	23097	13834.7	4842.93	9251.33	19084.4	9529.15	2039.07	3991.61	17096.3	1108.69	628.375	2569.43	12165.4	4779.37	7323.51	8686.86	1935.93	1870.13	163.321	11465.1	1560.1	1419.25	5.81333	2531.11	13181.5	11856.7	8431.54	6113.96	1922.04	2217.74	3.85806	5189.72	10605.2	20135.5	5686.58	9714.37	11984.7	1574.84	7871.52	10784.2	5984.12	454.327	5572.28	6044.78	5270.43	1497.52	6776.88	39.5003	1900.77	4097.85	4471.01	1718.88	2870.44	8067.75	10673.7	3792.17	4883.96	3915.59	3200.89	2017.01	14.983	1562.6	9900.33	14034.5	2520.09	1709.57	670.472	1051.11	1785.04	11.6404	660.682	2440.18	2634.17	434.433	2331.26	1775.39	5242.48	10154.3	1748.69	1298.55	625.094	10162.7	5393.94	2740.27	4225.53	1129.35	8663.98	844.927	583.636	5076.27	921.743	11574.4	2585.88	4835.19	5305.11	1160.18	47.8069	2167.05	451.356	1755.5	1145.29	7873.31	11063.4	741.836	3364.24	459.25	7917.11	819.256	2942.15	1305.52	1699.64	1210.62	448.086	1693.72	2409.27	3332.48	3205.52	3334.64	11950.7	1919.68	4761.26	6787.08	6656.66	2589.79	2825.67	20323.8	5739.41	4860.63	7035.19	8358.7	3553.86	11564.3	5152.95	4763.83	2239.21	6397.53	8286.79	6262.26	8477.04	4903.15	3846.31	9687.2	4780.62	2739.67	8375.39	4616.73	2345.78	1457.68	2496.81	7943.37	1860.27	3923.95	4754.59	5873.78	1730.74	349.08	5177.39	1650.77	2178.96	3001.8	1837.72	2119.43	17218.1	5713.41	6467.93	1742.15	5873.9	4701.4	7055.95	8217.57	4591.75	11706.2	1294.34	7573.73	3279.01	9901.77	2766.62	2978.26	7159.91	12591.7	3598.78	6299.16
caproic acid	372.631	4760.43	2675.13	145.896	338.366	0	14.6226	182.8	25.4089	928.402	611.184	280.116	66.8449	241.333	80.0619	5662.02	300.569	14.7215	12.8472	285.235	123.363	95.8311	157.697	1816.88	3279.52	260.663	287.814	188.343	183.592	16050.1	7189.46	97.1945	1145.85	139.46	8575.57	7212.29	94.5441	381.114	19860.7	10666.8	194.398	11983.9	87.1972	851.653	479.739	407.423	8020.52	53.2909	29.6145	3.92456	28.075	88.757	43.1893	895.512	768.187	150.219	27.4056	2009.18	1095.73	5277.97	12.6599	159.422	187.095	331.398	100.234	6600.91	650.867	1583.95	7.13839	1285.13	679.65	321.705	278.442	242.255	138.014	2978.76	1868.77	823.344	935.489	0	1129.26	637.439	2443.58	142.519	11588.5	8.27591	159.05	2438.05	143.456	8.48991	389.073	9396.56	6609.75	440.1	373.649	111.102	353.688	569.642	27.7516	22.0113	32.2814	5599.2	11271.3	103.533	900.769	83.7701	112.95	12.9674	4945.59	1273.07	7134.8	19.7924	512.435	3914.97	534.638	200.334	846.71	184.978	1576.95	7482.94	6616.48	6323.45	202.366	57.2774	162.528	667.305	65.8067	2965.59	28.1757	11.4212	13.121	0	11.3987	1998.76	61.3798	78.2286	27.5963	34.5229	189.086	71.734	0	271.144	741.593	484.151	2574.76	2277.59	7.57445	1603.78	363.871	115.302	58.3826	709.139	66.8901	68.7891	154.062	1350.25	7083.18	212.719	153.265	345.163	3716.09	87.1549	419.089	16771.7	4655.52	291.773	5690.5	36205	3724.81	437.643	2912.61	2535.18	689.854	145.729	3339.31	5632.9	167.988	58.0117	125.453	57.0926	4045.33	1599.21	0	445.049	147.744	33.7396	55.8534	39.3121	90.624	218.237	4756.54	311.808	413.619	9.11453	212.412	514.335	125.215	35.6372	244.907	11.7166	63.1121	80.3523	6902.72	125.369	269.819	952.251	409.107	7119.56	5559.6	409.528	37.8567	532.953	198.569	768.335	69.9242	88.2808	449.537	468.409	125.097	49.966
caprylic acid	31.5278	487.625	20.4815	47.7683	36.073	10.1261	17.8093	33.7013	92.1223	7.96561	26.4076	77.5946	39.3866	13.1454	200.332	420.66	339.083	24.7032	56.2231	66.3441	87.4174	22.7692	27.9793	162.632	547.407	151.119	82.5464	96.3772	79.7205	2136.79	3065.93	26.2493	153.589	31.2631	4116.05	892.663	794.496	66.305	2610.27	582.009	64.8222	7667.25	46.9101	160.383	336.583	44.0906	551.013	606.583	172.876	8.77237	18.956	47.1884	20.3838	9.96265	16.4903	1243.89	613.899	129.739	320.338	5806.98	66.2826	48.1061	54.4068	75.9869	52.0538	2724.53	79.4445	559.823	666.07	23.276	47.7705	35.832	1823.36	28.5603	46.3383	24.0636	17.173	4817.36	26.4771	27.2689	149.789	181.143	194.455	65.9084	28.516	29.3104	17.9068	9.81575	668.966	25.7157	81.9944	2500.65	561.966	3748.91	141.941	6.28157	50.6833	231.211	308.578	25.6092	35.7063	8823	9544.65	39.0769	153.764	21.1004	338.438	62.763	63004.9	83.1219	1117.09	19.4893	296.084	3026.69	654.762	186.843	158.919	227.639	699.206	315.444	112.006	724.673	27.2448	59.9629	38.9884	466.135	47.398	62.5174	14.4713	45.5495	21.2683	20.7479	79.2188	10328.6	1069.26	149.696	35.51	109.87	61.7202	49.7086	5.32558	117.078	19.5067	174.593	53.9544	908.74	31.1856	418.786	5487.83	54.0323	24.3151	61.8838	20.6666	107.614	534.972	12834.1	10176.6	176.029	145.404	68.3607	529.292	89.5764	91.4405	2609.3	1961.6	119.109	296.64	39262.7	2232.74	113.654	848.233	771.633	166.696	81.6233	115.24	1591.24	45.0582	191.679	980.886	262.082	3857.72	823.282	6.35193	53.2356	942.475	64.2601	674.632	26.3919	63.6734	79.9205	23.3404	7156.04	9081.76	22.2359	58.616	57.6478	302.966	100.258	726.011	49.5381	44.8339	21.2263	2533.91	21.5335	108.625	790.253	90.8836	2329.87	1916.85	51.2457	24.1588	33.1299	66.5769	4113.6	206.765	32.4804	45.2288	79.8256	117.058	820.711
chenodeoxycholate/deoxycholate	28440.3	7860.43	5037.54	34152.8	38985.9	3270.4	1112.26	47021.4	19624.7	19551.9	10192.5	8296.04	5073.81	19399.9	17849.4	23466.5	66516.8	14564	795.592	47018.1	12169.9	14251	1585.65	20973.1	3901.41	17547.4	15651.4	25978.4	8690.36	64986.4	7486.87	2351.52	10901.7	8262.78	11462.1	14312.8	15256.4	17504.3	46610.6	18110.3	29529.8	2223.88	42536.9	29947.1	5905.62	40767.4	27270	2712	17275.3	6257.59	1767.86	7054.65	10153.6	4551.81	1044.58	30821	1468.26	12168.3	40533.9	22680.8	13208.4	24790	56701.1	23174.4	26067.8	2417.76	9144.29	5718.37	464.119	21388.9	36219.2	8972.74	45312.7	4594.61	24539.2	0	43483.6	54230.1	23701.9	398.868	11586.5	36532.3	23716.5	36337.2	169.71	15285.7	5593.14	2985.71	6378.56	15087	6940.69	9173.81	18164.2	50413.5	29494.9	588.853	27545.7	3368.49	6090.97	4449.21	30049.8	12040.1	11997.7	427.139	5309.36	16436.6	1790.6	9.06163	7487.88	8498.13	34239.7	892.095	1055.6	14781	19805.2	12441	15092.3	19420.8	46223	46143.4	40933.8	20473.6	22397.7	10838.7	19493.3	16917.3	4291.84	1851.26	6010.3	9380.71	9544.33	9077.48	20090.8	34475.5	6278.61	8710.18	2787.77	7926.79	31684.8	634.223	9210.09	2978.93	19108.5	8806.6	271.293	9557.97	439.13	12685.5	27071.5	5595.44	4559.5	1358.89	9614.71	22479.4	14991.4	7167.96	10346.4	10251	10759.4	26974.4	27392.8	21126.2	26523.2	17575.6	9623.06	25540.9	24770.5	25675.3	4304.45	6353.01	32452.9	13615.6	8439.62	4780.42	24792.7	3550.85	27108.5	7704.86	6319.8	18060.1	5153.09	10943.4	11226.5	16161.7	5527.37	7457.36	6172.28	308.868	9876.49	3263.63	584.093	5722.01	4278.03	6002.3	12756.1	850.569	11596	15657.7	53343.8	23106.2	11477.3	53703.1	29490.8	19610.8	1307.23	8646.26	21134	15180.5	36245.6	33114.5	381.915	66167.2	27819.8	17316	7094.21	6808.49	12538.8	6195.38	13284.2	10419.8
cholate	268.064	122.987	486.275	3504.61	520.209	23329.6	8065.64	23836.9	4127.12	20836.8	293.272	162.43	693.726	616.866	372.833	122.435	957.255	2420.93	4930.19	46997.2	167.152	30895.4	31.3137	384.273	40.4317	2863.93	634.31	1123.45	87.2727	4074.15	73.3739	3371.26	169.565	309.833	334.857	574.086	245.41	12670.6	384.014	265.259	664.759	23.0929	14462.3	935.922	40698.6	396.589	222.439	5192.72	52562.9	33137.1	4054.08	176.336	193.189	417.533	4156.34	649.183	6068.57	25998	74.3678	439.316	39054.6	6734.58	1869.41	151.461	5883.59	137.446	28.7891	69.7373	6150	1346.74	5038.14	10412.1	3208.54	1379.74	40.6221	0	17639.2	208.42	482.941	1673.97	97.2176	464.943	133.027	98.5729	15.9193	6053.82	17886.1	16275.1	14197	25772.8	153.488	29.1222	643.685	3999.85	960.943	1597.97	502.665	33.0388	39217.1	492.432	9922.27	1301.08	178.443	170.997	114.064	434.403	1059.7	177.896	21348.3	31167.5	85.3084	12196.3	43.7291	50.0875	218.537	26.048	76.398	22609.3	1055.37	1005.21	35.1387	151.498	325.342	307.79	2722.66	156.928	55.1033	4410.01	14385.7	39050.9	17319.8	37632.3	61082.1	1085.96	28895.6	3860.13	135.941	20779.1	12891.6	2820.27	21581.4	127.243	9400.9	255.477	11081.7	78.1583	266.183	244.03	7988.57	13783.6	107.165	264.328	88.8129	2076.04	704.831	65.9372	284.596	1150.18	51.8324	287.944	278.959	360.877	530.689	285.699	57.4925	374.449	248.035	115.552	309.823	426.078	122.265	479.169	40.4867	16277.3	4340.96	299.477	16.1557	18253.6	129.378	32764.5	22.3702	47.6359	18066.1	115.152	265.686	23352.9	14.5313	2834.89	88.2518	60.546	39.5568	53.6256	99.3081	40970.9	122.125	98.2338	23064.5	909.814	426.031	6602.27	33475.7	7374.72	79.2399	59.6841	17.1757	25408.7	118.434	141.776	980.101	47.5621	10.8855	1791.99	125.939	1196.97	18279.3	75.8899	281.981	14965.6	886.436	3824.43
citrate	222.61	4181.75	741.898	3514.5	142.965	179.297	12531.1	5553.69	1909.14	499.202	812.419	383.209	6527.98	4682.46	243.582	193.709	37.9559	382.681	1421.71	603.123	272.078	236.492	1783.1	494.763	174.803	1101.93	918.054	541.337	1067.35	66.5758	48.8147	375.686	115.581	373.823	1659.71	1114.91	764.48	226.459	112.165	221.871	787.777	130.414	1182.89	161.759	169.09	308.818	494.354	1227.8	1224.77	597.298	347.296	7492.43	423.272	168.294	1999.29	5549.89	10948.4	187.056	7064.53	5345.04	6346.89	2119.98	145.938	150.072	8165.85	337.155	730.291	738.79	2407.55	117.977	250.263	1598.29	128.328	3705.14	194.458	924.832	4324.23	145.485	154.923	3073.99	44.8261	289.783	208.443	406.671	663.055	2781.94	181.204	521.803	280.199	2166.33	225.391	541.301	649.117	260.329	197.994	310.806	307.658	113.32	2600.43	1260.29	196.392	434.168	6333.24	11707.5	8135.33	5119.37	5007.42	15459	6225.12	4883.75	6056.45	5217.1	4640.49	5735.68	6100.46	3053.93	4965.51	3921.55	4106.04	7376.55	4794.84	4067.69	4900.95	6342.25	7535.51	6699.55	4562.11	272.034	5858	710.331	14593.8	2885.3	388.922	6989.15	10603.5	4592.05	10926.3	4976.95	5908.34	11810	3277.65	7179.18	9779.29	6041.67	1196.88	7388.68	281.14	9000.52	8791.21	8519.76	6710.43	105.152	423.766	2063.83	605.8	198.454	298.224	768.763	135.872	451.872	605.158	201.685	332.476	354.576	168.318	153.921	735.799	171.203	344.328	210.004	83.078	670.93	280.903	236.062	315.664	597.388	157.837	820.065	52.5185	669.959	613.426	94.0008	174.358	414.939	108.829	494.184	68.834	75.4902	172.416	42.0217	62.4764	262.492	144.248	972.881	239.209	295.781	582.391	334.09	154.186	124.951	130.978	210.183	209.333	306.035	249.235	310.496	187.541	360.493	510.352	234.749	872.985	112.07	49.3442	768.762	335.314	316.808	310.874	386.866	181.295	275.847
citrulline	3492.83	469.472	2572.63	401.235	1399.92	739.925	0	529.949	1609.75	1307.37	2261.46	2707.96	382.337	630.224	2365.48	3053.79	1316.69	1594.52	2648.32	1973.23	2705.63	921.63	3905.13	2081.42	3579.32	1141.85	3708.3	5395.3	1501.57	2036.78	4200.05	4534.63	2882.21	3849.81	2872.98	2853.13	2024.65	1787.08	2503.66	3483.02	3881.76	3155.36	1569.96	3243.76	923.881	2882.94	2189.23	1066.41	1542.81	493.996	4259.18	490.727	6900.6	2012.44	1140.36	310.73	126.275	3547.84	224.038	661.669	2455.48	5969.84	2739.34	7140.41	2167.85	4489.9	2451.35	2450.07	4220.85	5871.17	2605.52	1601.66	1510.24	2546.96	3986.07	3719.08	2280.55	1692.72	2910.01	3110.63	2112.08	3524.68	3984.42	2812.84	2606.28	747.002	630.505	2158.75	2948.27	752.044	3475.28	2094.94	2783.46	2822.92	2867.38	9854.91	4342.92	1247.5	741.004	255.124	2558.41	306.234	406.111	55.0379	256.254	261.49	182.847	86.7034	7.05036	1037.23	108.933	125.424	115.132	294.67	1051.74	293.531	304.45	686.522	439.482	355.142	149.582	413.314	195.123	288.757	444.807	435.158	617.282	1899.12	139.012	89.0576	116.146	765.926	116.967	1853.29	112.356	556.185	201.769	203.037	735.689	1520.12	907.832	395.831	269.644	197.871	2033.9	830.392	1291.67	387.943	61.7883	217.536	35.6304	2757.04	689.304	4050.37	2556.73	2800.65	5061.85	1695.25	3447.74	3067.09	4411.2	3750.6	4026.7	4327.81	5763.39	4344.3	3754.35	4228.6	1683.29	5056.46	2468.72	6001.83	2371.67	8298.71	5369.29	2951.71	3239.29	3754.45	2144.6	790.826	2123.08	2748.6	4872.77	4592.18	3469.97	101.036	2840.46	4822.54	2352.53	6703.96	3455.39	6556.12	2840.58	863.142	3310.33	1818.84	1377.51	5663.52	4656.24	3864.65	2134.06	5363.63	8605.81	1332.51	3728.12	3531.28	3088.75	4116.65	1616.53	2049.91	2409.65	4692.26	3676.15	1846.25	1541.16	2231.44	5625.41	5939.62	2357.34	2043.85
cystine	30.2932	0	52.1934	0	13.5342	9.68421	15.9491	0	12.7219	10.6561	21.2697	21.2525	0	0	14.2283	5.55428	2.42737	30.3839	5.12127	72.8519	57.3645	15.2152	12.8029	12.48	5.80041	10.3958	16.7867	11.5402	0	9.70516	6.15063	516.389	5.7647	19.1996	10.542	21.1193	4.643	11.7045	0	7.32524	20.7822	3.09652	35.4288	28.7079	9.59474	71.33	0	16.259	606.046	10.6197	113.454	0	319.155	29.6161	163.952	0	448.816	28.8705	0	0	2485.16	14.838	29.8952	50.3446	18.4334	20.3093	12.6158	12.4439	4725.09	15.5423	15.4061	19.3505	35.3014	79.1853	24.6472	448.224	23.281	13.8834	29.3597	980.044	9.58777	44.5427	4.9053	17.8967	92.3748	540.975	8.04698	36.2088	17.239	434.476	18.1422	4.71919	13.2548	102.093	12.9663	520.286	17.4657	6.06031	2044.06	0	8.91644	1.34128	0	0	0	8.64771	0	275.345	0	5.60476	0	805.001	0	0	2.16141	0	0	17.4635	0	0	0	0	0	0	0	0	2.29997	139.914	0	58.0904	0	54.1319	99.4199	27.794	0	11.5789	0	1047.94	2.79056	335.881	88.7031	0	0	0	100.809	0	18.2575	0	0	0	0	7.4885	3.59277	43.1811	8.94461	6.76608	43.1912	2.23443	7.37479	9.16593	20.4397	6.28357	7.36782	21.4155	7.8018	17.5466	12.4657	14.4186	3.35895	14.7119	3.90454	15.1361	4.49826	62.3611	13.6645	7.9449	8.44665	28.7694	0	6.06746	9.70368	0	106.333	8.69931	24.9975	45.6787	2.13605	31.7381	11.5775	44.3628	16.0537	36.4145	5.19846	343.086	9.64526	7.43478	9.56767	105.448	8.28681	38.4479	15.9586	21.1809	29.9618	0	12.388	11.5069	42.1695	12.8493	0	24.4871	8.11195	19.3592	8.72662	6.7125	130.371	4.32015	25.8004	46.8583	10.3999	5.60813
deoxyinosine	4.42134	7.58341	99.0081	7.3636	454.392	28.4307	0	29.228	134.699	442.723	20.4818	648.723	10.7595	19.1679	133.109	356.077	3.24001	229.577	17.5242	145.679	165.29	47.4567	524.789	645.687	1346.26	577.213	515.893	1795.64	85.1676	191.231	1168.56	68.8278	491.463	176.568	922.804	381.782	128.747	959.163	359.599	725.275	910.35	306.233	84.3935	52.6756	228.045	4.95163	540.463	333.205	156.069	3.93656	191.349	84.6552	53.8767	429.351	233.337	129.9	170.234	843.464	7.56926	27.7063	26.2022	1163.11	76.0517	264.825	13.5869	685.809	187.208	604.836	40.5659	68.6484	210.244	526.755	113.549	662.247	188.104	26.7739	228.271	0	171.965	8.3755	65.1631	1283.96	1040.18	125.997	362.857	13.7235	119.655	61.8204	449.852	669.019	266.96	1940.29	443.744	6.80453	203.381	546.771	1032.55	613.557	26.665	39.6598	76.2379	10.3595	18.6938	8.84423	13.8853	16.9391	4.16461	24.8524	0	7.07	15.609	3.61385	9.4348	10.9921	8.15149	16.4436	55.2107	11.3928	14.6302	98.6609	0	60.9722	0	24.4806	0	112.324	5.84411	167.865	11.2903	25.1444	8.49595	90.4571	188.234	23.0219	0	19.1492	16.3408	216.092	13.0923	124.395	63.515	255.765	26.4607	6.18643	290.887	8.63777	18.7827	22.6668	0	7.33173	0	8.36599	22.9839	139.931	92.19	117.547	129.708	130.837	1877.66	701.309	999.079	763.527	318.125	1587.33	1119.01	1260.4	859.694	5768.51	142.779	1430.36	452.946	4137.16	1164.71	576.702	967.464	3573.94	166.411	283.794	652.027	727.621	1180.7	51.5734	1252.78	2306.21	16.5876	850.375	94.1699	1648.82	169.799	715.489	196.968	1276.88	422.325	87.5317	1027.13	186.951	527.605	2373.83	536.558	1082.09	303.899	1147.24	1845.95	111.607	429.52	526.741	2732.07	2812.03	2698.33	168.872	1545.59	1133.08	1659.32	906.605	98.5996	398.9	1146.41	295.167	293.817	378.452
dihydroxybenzoic Acid	155.13	5795.78	369.897	325.144	733.481	97.8884	1349.24	955.209	911.738	337.884	1220.38	773.632	1626.02	2946.1	935.188	889.541	416.852	1922.51	871.639	592.177	159.303	352.779	2233.2	3634.79	231.844	1690.71	1273.35	243.5	1037.01	400.064	189.859	69.6978	190.558	1684.59	965.44	1951.99	425.508	4530.6	137.404	873.525	1811.49	199.791	1056.51	577.362	164.708	185.949	1130.98	230.832	225.201	424.358	746.103	1487.13	641.467	892.235	217.655	684.87	139.967	889.887	118.716	534.619	41.923	342.865	723.574	768.726	1361.06	322.673	135.576	962.117	115.692	119.078	693.227	3014.35	259.98	2217.11	5499.17	0	1588.5	480.081	503.895	124.412	222.112	333.961	343.414	154.5	17.336	140.244	495.095	293.16	871.106	108.101	1411.78	152.466	885.232	393.908	717.243	107.136	620.619	178.838	144.49	716.9	286.323	412.782	221.27	5401.05	172.317	2450.37	1031.9	1185.3	177.809	963.342	756.961	4969.85	69.9397	542.531	1273.61	174.032	59.3153	694.377	250.236	1183.63	1957.15	1252.61	1597.23	422.389	2929.22	1764.7	2711.35	480.855	774.274	1308.5	1525.93	1946.38	975.015	129.771	160.957	2987.23	519.302	96.9984	267.706	640.715	912.047	430.898	1132.54	583.593	924.209	1152.71	625.427	1476.19	1023.18	2072.55	1695.95	309.006	991.31	1072.22	1082.7	176.658	163.55	171.234	106.319	507.824	1261.59	209.791	141.457	446.447	270.781	815.112	1415.69	426.618	252.205	1503.72	142.61	576.364	144.975	184.166	1960.52	373.342	358.076	542.134	610.68	2513.25	326.127	154.242	902.148	673.452	395.653	270.87	393.662	2045.84	262.657	170.986	828.519	446.763	377.048	243.626	335.19	279.376	311.531	254.602	102.062	752.431	1021.43	464.804	1164.25	190.066	455.777	476.782	513.839	409.508	351.8	416.215	128.683	411.251	440.229	97.4153	83.9709	1947.9	1202.26	631.419	135.205	395.601
docosapentaenoate	31802.2	45.2582	484.028	7926.97	654.778	13612	1162.19	5149.94	1283.21	565.497	3535.39	662.656	205.612	1454.65	127.832	56.8181	120.6	1434.89	323.364	757.26	2241.08	1103.21	185.85	3020.3	142.908	230.33	828.898	121.666	102.157	1212.84	110.412	2055.34	26.9496	309.395	510.979	148.387	273.323	425.315	43.8662	63.0282	1438.92	33.9554	1823.96	1348.51	4644.81	3120.65	172.726	134.901	2000.43	15333.8	3073.59	215.117	11042.3	4438.78	945.986	1001.99	294.086	1529.12	189.835	1369.7	1275.28	2239.96	4974.14	2568.21	946.318	81.0558	66.7401	162.274	1721.7	3452.61	7706.73	1622.23	3475.22	1934.55	124.01	2830.35	2431.73	4449.75	3296.35	6536.31	47.541	7190.99	245.755	561.892	5006.44	2453.95	1375.77	4657.29	1624.57	2121.54	457.593	258.066	187.739	3841.15	715.218	3346.01	1102.59	233.999	808.447	821.056	4399.09	2065.78	87.5143	984.705	170.88	420.263	347.757	1243.68	998.933	2390.79	333.836	17904.6	77.5995	129.573	451.605	21.5369	339.083	6763.44	565.654	339.056	574.101	127.571	5787.63	967.375	2217.79	306.201	62.5684	1581.24	3376.33	4644.22	1541.77	3400.94	974.373	12724.9	524.382	1982.66	10954.8	672.708	6477.79	2231.77	487.386	294.222	6985.78	23.3086	1551.32	133.46	819.187	150.21	1256.13	3665.18	112.805	864.011	222.439	845.796	722.191	90.3507	332.489	142.645	241.438	80.3579	88.1465	56.0933	67.5652	188.246	205.756	1551.65	434.311	124.736	100.303	169.48	73.1305	360.327	48.9427	8248.9	141.444	12.1542	225.934	551.93	221.762	270.212	554.505	57.2768	1135.87	1539.3	478.327	2810.25	60.1781	3521.57	423.271	46.1958	1672.79	275.171	71.6259	1509	667.263	7955.6	1019.55	766.2	205.445	3966.12	4315.98	1538.92	18.8516	368.523	130.005	3895.46	84.4477	106.129	182.84	90.2502	431.182	4746.19	308.859	143.366	552.819	755.182	840.612	924.91	317.781	594.959
eicosapentaenoic acid	6560.82	45.2677	162.148	1020.76	172.915	205.988	780.134	35.4565	134.529	110.058	360.832	151.486	337.808	101.179	37.6483	0	112.283	641.728	94.5884	319.039	61.5614	1340.84	142.069	4636.92	59.0209	203.916	11.4542	53.4451	0	62.5142	81.2321	750.088	0	146.751	103.151	42.562	452.879	1109.94	50.141	125.244	90.8624	0	390.098	126.456	458.287	565.388	305.119	103.686	116.903	481.878	1394.67	24.9438	3768.16	1364.12	2118.47	173.438	233.536	1176.36	0	368.579	3393.96	210.278	99.0519	56.5749	175.572	37.3284	174.52	103.743	591.778	129.443	8868.31	111.81	433.611	2064.86	246.652	999.352	239.674	69.8673	444.782	2966.1	0	3521.41	502.668	125.052	1239.52	875.495	112.009	1207.53	41.0344	2745.17	173.678	176.673	172.192	1790.62	157.461	600.138	76.8059	130.891	2596.24	44.2056	204.24	1655.05	0	1047.84	157.278	234.247	185.089	4115.19	62.2713	814.277	149.033	25876.6	101.578	280.952	107.753	0	118.421	715.015	0	177.383	138.156	0	4661.99	65.7278	204.359	251.104	0	3709.04	1261.54	187.995	196.932	655.609	288.569	141.742	604.043	66.2784	493.592	209.368	942.279	567.485	189.305	123.597	841.496	0	769.798	101.256	157.165	112.48	9078.98	239.192	0	120.674	342.552	3766.4	76.4075	163.439	211.077	0	231.305	0	116.092	85.8903	162.333	208.121	70.3889	276.897	109.446	186.074	0	645.643	32.1896	71.2106	0	313.916	88.0838	12.6615	102.009	44.5888	92.0508	707.36	218.621	133.374	235.838	136.405	0	95.2755	39.4604	1761.44	0	93.1597	452.344	205.118	101.423	371.907	74.9617	14078	348.648	475.251	190.748	106.554	1187.64	147.724	0	135.412	0	1684.32	0	93.7254	90.3382	75.8442	154.54	509.338	197.626	186.199	985.701	195.603	498.605	866.809	110.296	135.088
erythronic acid	132.402	58.5786	197.944	78.3484	138.55	875.379	68.8873	117.922	250.491	1059.65	335.654	480.857	131.105	137.43	511.132	86.9453	142.734	763.638	657.667	1210.64	179.569	770.78	268.683	350.72	161.673	338.065	163.669	255.626	1164.71	57.3492	160.333	488.217	124.245	263.046	161.415	180.974	132.875	1434.95	57.0558	81.6544	89.6523	157.728	506.87	2900.38	686.94	577.809	154.104	1405.63	2576.04	961.772	289.596	225.372	331.635	157.316	1466.88	94.8224	723.679	1571.27	62.5711	110.845	7767.53	3041.97	276.716	183.181	663.524	173.837	88.2215	99.6689	1318.65	105.886	81.3511	4499.26	2493.62	282.353	2056.7	2468.66	166.071	637.053	248.274	856.814	246.474	354.128	205.141	54.5687	1473.94	1119.57	492.526	202.446	648.016	4168.96	207.822	194.607	222.808	1219.91	344.633	966.331	272.519	97.7658	2819.93	337.024	1536.44	91.6842	72.842	181.648	131.108	77.72	170.041	255.322	387.125	141.289	64.9049	671.401	85.8607	74.4043	113.266	78.545	75.1974	138.786	65.2086	71.4728	62.5599	76.2178	921.182	74.4477	342.788	251.532	52.7677	414.028	45.2504	304.95	2958.43	1211.18	3237.24	57.3125	921.786	172.045	146.705	3079.9	281.705	422.492	1244.81	245.961	79.7165	283.461	7231.82	75.0936	362.649	179.963	313.946	366.416	57.3698	1237.63	1167.11	521.712	371.351	262.938	317.888	1079.06	363.734	340.729	698.322	383.579	252.739	291.214	550.499	1721.55	1066.98	396.502	572.31	859.868	129.73	2789.77	358.661	1434.41	449.479	171.997	728.458	3048.27	274.65	1173.29	899.658	57.1431	947.872	532.258	392.968	1020.32	168.492	920.911	213.011	622.002	374.425	568.591	286.318	1460.42	337.148	165.201	678.56	2074.37	145.834	1448.39	2651.35	267.169	266.661	236.417	503.534	639.982	212.066	446.934	225.153	710.755	73.1307	469.835	84.283	51.3075	1607.19	851.982	302.211	1225.12	86.794	192.935
ethyl glucuronide	0	5.82079	0	0.928466	0	0	119.615	0	77.9911	0	439.655	198.173	90.3602	0	0	3.88408	0	41.2442	47.6086	1654.32	0	0	0	40.9982	0	0	1720.11	0	0	0	206.943	25.883	0	0	0	2623.11	0	0	0	0	122.393	0	132.766	0	0	480.938	0	54.4848	14.2582	0	1.07167	0	12.3316	3.46733	77.4396	0	13.9422	0	0	0	65.1994	1310.88	0	0	0	18.3924	0	21.5963	0	0	0	0	60.2404	38.1396	282.941	23.4622	0	25.6721	13.3056	13.4938	0	1258.12	0	148.369	6.5475	53.5267	0	121.794	0	113.604	71.2872	0	33.4209	0	111.584	60.8324	85.8043	96.2764	0	0	0	0	0	43.8346	0	1.47616	5.56897	0	33.0286	0	39.1379	1.5172	0	0	0	0	0	22.1065	32.9999	0	0	0	0	10.6245	0	26.561	31.1263	0.675314	26.9007	0	67.8732	204.594	425.956	0	6.04294	0	32.2061	8.83425	0	74.1935	0	21.4409	4.51886	0	0	28.3477	0	91.1257	94.1962	225.72	10.0669	0	0	0	0	0	3.92683	182.142	0	1.36468	108.327	0	0	119.843	0	272.869	0	0	0	100.086	0	0	0	0	0	0	912.752	4.02134	16.5732	3946.69	78.6389	0	80.5519	3519.55	25.7164	12.049	151.14	46.2389	32.0512	100.812	26.8691	176.267	396.014	5.05582	37.9673	47.2565	5.04407	0	340.723	419.529	0	0	89.0243	46.9774	43.5496	63.8489	21.3509	118.04	0	0	55.5169	0	609.095	0	41.5966	130.326	0	11.7199	38.1694	0
fructose/glucose/galactose	608.145	139.316	257.222	193.868	577.017	135.832	301.162	1895.61	766.843	1889.67	998.05	380.793	375.295	428.049	1035.23	161.435	391.406	1265.34	192.714	1043.33	1578.56	385.371	963.448	897.439	290.183	1215.19	640.267	1637.56	290.809	1144.27	208.169	1143.64	124.205	1133.72	449.668	747.539	1416.39	1115.92	229.757	340.582	172.194	243.375	741.877	1072.48	455.619	1206.79	1261.48	261.435	439.556	478.983	579.703	690.988	1125.29	607.348	349.265	250.238	1144.29	602.566	50.0848	209.334	891.835	1959.55	252.486	655.153	287.749	311.59	547.365	769.979	172.653	264.771	1100.79	1132.14	212.872	2563.94	776.202	1547.24	625.543	625.948	733.672	417.563	377.969	299.756	439.334	1328.12	391.469	221.101	263.156	633.32	785.799	993.851	968.99	224.748	648.676	256.789	974.637	577.991	906.087	151.748	204.903	203.128	1100.38	1402.01	341.806	500.455	177.304	1423.12	644.093	449.233	240.029	536.045	119.665	217.198	47.8944	112.068	110.475	268.623	84.6325	679.14	59.7159	975.909	254.418	154.42	828.586	726.005	1366.16	409.977	232.108	430.266	40.8225	755.334	108.661	666.75	0	510.035	282.496	625.743	624.677	2786.46	476.681	2787.56	1447.98	72.7936	747.933	46.8695	728.492	206.61	403.641	250.801	157.092	877.127	44.8158	406.021	431.171	635.069	324.784	421.455	629.25	306.044	432.107	366.209	728.684	237.855	265.295	508.652	392.5	1206.96	2276.95	867.847	469.735	2468.19	150.877	510.96	278.236	2093.28	2767.22	624.851	964.588	2376.18	671.75	1208.87	578.363	232.852	2230.65	444.776	1352.48	382.498	271.391	532.349	1066.93	1688.32	592.882	1449.43	810.532	1449.48	474.495	187.03	1075.52	1827.51	637.019	643.075	1592.89	2301.24	391.321	271.767	625.043	421.269	391.948	1682.95	1660.86	231.295	536.788	2251.06	947.457	490.375	485.394	664.675	1736.97	726.068	471.851	1576.36
fucose	25.6215	9.05772	67.0502	18.2726	20.4126	5.91638	26.7207	27.3625	14.1663	10.5374	52.4331	22.3332	17.9615	24.2502	26.767	7.16158	20.101	25.3438	5.68373	51.444	21.6647	45.8312	185.693	74.8729	13.188	55.3549	14.096	10.4894	12.4858	20.6829	11.8076	77.2065	7.66987	50.5296	63.8504	10.5146	32.4262	20.9046	16.7557	39.533	12.6873	16.8513	125.013	189.54	51.346	14.6425	42.7912	18.9374	32.1529	23.3754	7.77051	46.6172	52.3263	10.9677	30.8913	49.4965	17.4662	14.0723	20.0105	14.9814	22.1678	34.109	17.3662	12.6767	14.217	16.2161	10.4599	6.62868	53.7838	17.0598	20.8647	67.3813	19.5179	53.5561	29.1779	391.56	39.2021	41.0137	26.2941	51.9629	7.21534	17.0426	16.2693	126.138	10.8423	17.1681	32.5033	24.1932	32.927	22.5931	13.641	25.0328	18.5702	20.1863	30.5404	11.2907	18.1099	5.5405	88.3714	18.2637	32.4552	17.361	6.71873	18.5592	12.8313	41.3301	99.0114	10.9958	3.22736	39.1272	8.44969	15.9928	18.7141	36.82	7.94792	12.7673	21.6949	32.0022	15.583	59.7885	10.8076	20.4171	35.6273	395.622	82.9357	10.9898	17.8827	22.3579	59.4233	21.8086	27.1649	111.981	49.4036	20.2044	22.6399	20.6418	89.3304	39.3409	45.2985	30.8189	34.627	15.7059	53.5546	0	100.823	6.67182	25.3664	9.36076	23.5858	39.7288	12.751	9.84331	52.5815	52.8868	13.4259	12.9406	32.5867	53.8417	28.5112	18.6769	29.2056	14.2876	26.4578	20.9526	39.9789	14.1096	50.4847	44.7459	27.2207	32.9246	4.34332	53.4665	10.1102	43.5704	29.2667	24.7899	35.6443	66.5631	19.0832	35.6414	44.4638	21.1924	58.6271	14.0214	33.9342	44.9531	26.9933	14.2005	18.0014	31.4083	17.5369	19.0738	26.1418	64.6556	10.5495	7.83171	28.7967	25.1164	64.7529	65.1681	97.2171	92.1262	23.7359	18.1944	19.9908	43.434	31.0891	26.5582	16.4326	12.3368	27.0465	32.9194	37.0902	18.6606	20.1393	24.8944	29.4583	28.2698	28.0438	32.6716
fumarate/maleate	1156.86	125.779	2013.97	79.9481	2179.02	221.679	208.673	275.842	836.192	907.89	1135.68	841.329	222.585	34.7108	2150.39	1400.78	1147.52	1056.76	345.648	1969.69	1230.27	1483.91	1786.33	2456.7	1139.92	2487.47	1541.62	542.977	1734.85	849.229	1891.61	915.795	1367.57	2195.32	2183.19	1693.21	1676.15	1735.09	1162.08	2185.56	1189.43	1931.39	2275.61	1720.1	1333.11	684.097	2937.61	597.485	927.894	1473.78	1597.07	308.967	2124.64	978.116	711.763	162.423	727.417	1569.63	0	194.823	46.7638	320.923	755.356	1288.37	237.439	1472.43	1149.26	1814.03	376.829	907.309	1537.18	1496.06	1520.33	1796.06	2225.41	3215.14	1570.22	1185.39	1218.47	1693.58	1716.11	857.316	2397.05	205.741	2178.73	94.8487	147.428	1105.84	427.269	176.05	309.083	2027.83	1748.67	1475.21	703.255	2569.08	1066.87	1235.1	1262.55	429.315	675.399	908.169	141.596	305.342	449.854	151.757	262.06	143.032	102.014	282.657	66.79	102.022	127.487	230.174	251.178	161	226.178	284.587	138.141	317.525	305.317	157.819	157.786	160.191	166.186	354.293	112.671	836.056	96.198	1050.38	302.677	773.936	1991.34	476.303	369.888	469.655	127.782	918.539	153.209	1603.2	1672.64	593.697	207.24	167.238	2447.38	192.185	395.659	170.3	89.719	80.7197	80.9102	114.272	198.019	393.256	160.977	1388.33	1726.35	1091.28	1376.31	2122.27	1979.37	1591.96	979.891	1588.78	1743.18	610.841	2596.65	2494.99	1607.2	863.653	751.148	2954.7	1669.78	1485.79	1969.23	1491.38	2146.38	1560.38	438.98	581.261	1495.29	371.302	1095.65	1240.62	917.893	358.767	989.148	848.323	1005.7	273.811	279.346	1579.67	285.399	536.476	1078.77	593.671	1170.9	848.247	561.257	353.662	1092.92	1266.53	1945.47	1514.29	726.071	1488.02	76.8574	2100.71	1583.23	1362.54	370.789	747.528	32.2185	949.169	1374.87	1106.77	1009.55	1977.89	1003.65	950.777
glucurote	515.035	455.48	348.959	64.2846	1062.29	0	0	3558.06	435.657	1127.13	283.043	585.733	558.223	1734.64	1883.28	301.974	130.293	1422.73	701.586	393.485	165.077	1606.59	583.83	4189.25	1006.72	2744.54	351.007	330.734	659.317	281.37	413.66	695.233	334.211	2500.33	403.706	269.568	801.926	1434.63	389.496	1875.15	911.391	504.637	92.4509	1322.9	810.474	62.0474	3371	126.716	0	1318.19	467.115	470.745	579.403	702.248	86.7423	231.578	0	1294.75	34.8112	1594.98	65.7368	155.271	490.34	492.517	977.895	517.157	113.629	414.41	253.422	163.852	684.449	2235.25	334.209	1733.36	816.6	0	789.932	266.99	989.284	0	263.096	188.809	950.091	21.2228	165.319	0	15.2726	334.605	127.711	0	190.295	167.436	1293.8	484.73	460.213	324.762	283.421	437.656	0	18.0683	128.552	736.724	555.988	156.684	342.499	37.4252	0	0	5.73239	246.85	1081.44	26.7185	115.638	979.82	317.226	215.374	249.365	0	378.208	5090.46	2041.62	1840.95	1176.98	198.468	222.064	198.374	279.181	190.139	0	23.8501	191.877	0	0	163.161	0	0	36.4922	594.061	0	112.381	724.505	621.606	981.252	513.719	1010.13	153.028	46.1896	829.79	1235.21	140.672	81.3034	35.5129	28.3944	0	0	1496.14	463.328	439.715	229.454	960.697	1075.87	630.578	378.574	588.473	460.108	83.0082	2937.58	621.226	1501.84	425.484	312.881	428.861	291.274	429.497	2921.92	1701.26	615.203	1844.57	160.957	1619.45	1192.08	135.29	2116.61	463.911	886.842	74.2331	548.314	375.046	370.388	103.728	264.414	753.853	86.1974	62.0141	377.925	312.425	457.942	328.399	100.618	532.128	366.134	340.677	1028.32	387.965	1084.94	1752.74	215.104	1828.58	1837.56	195.139	590.402	431.072	58.774	470.088	86.8536	405.552	716.895	1555.77	638.697	489.618
glutamate	27384.3	3603.1	27757.6	3412.28	21130.8	4169.92	605.045	12232.2	18878	10778.5	12515.2	23164.5	2194.93	3516.11	25029.7	25362.5	29889.3	18473.6	6043	23186.6	25594.4	13069.8	29132.1	24618.9	25224	27457.6	25975.5	32053.6	25894.9	19534	36850.9	19460.9	25527.3	26388.3	31855.6	33255.9	18732.7	21015.5	37200	34526	25420.7	36022.9	19991.4	21538.2	9057.74	16392	40855.3	11207.8	41234.7	12428.1	9739.12	14218.4	25896.5	11673.5	14464.1	13605.1	16386.9	15979.5	4810.44	11833.4	25618.2	22634.3	20221.4	25819.8	16832.1	28710	27281.4	20414.5	26569.9	30526.3	20561.3	22326.6	20746.5	29291.2	23047.6	37297.9	21885.7	13122.2	20503	26431.4	37396.5	25562.8	36472.4	12506.7	26722.6	7321.39	21634.9	16361.2	16540.3	16552.3	14506.9	34955.6	19218.5	22377.4	16297.8	25409.9	28003	18912.6	25879	9471.99	24865.6	5117.74	4960.26	1492.01	10142.8	4976.76	433.148	2612.39	67.0635	6609.87	7112.03	11403.6	7094.73	10250.5	15810	3500.88	10760.2	9256.11	8294.35	11676.3	3437.24	13785.5	9400.8	2688.98	7611.65	10268	4992.87	4487.12	235.897	15693.2	8556.2	27780.6	2986	8658.69	95.2784	5368.18	3466.15	27066.5	3828.47	20939.1	17024.5	20723.1	2076.49	4187.7	25846.9	12023.7	8068.95	12866.5	1224.28	4086	1451.46	8221.14	21383.5	23705.6	31960.9	25014.5	21879.2	17838.9	31690.1	38124.6	28035.6	26797.3	26574.1	31639.7	32120.5	29800.4	32958	33044.8	28621.1	26885.2	15952.8	34636.5	24208.7	22864.1	27917.1	30034.8	31368.9	16527.9	13159.8	6011.82	23894.8	13461.4	29638.1	21636.8	15327.3	14312.4	14398.3	12792.3	15570.1	17166.8	13641.1	24357.1	12521.2	20602.1	15200.1	7937.69	14746.3	19859	23468.5	14391.2	18930	23764.1	33375.7	13208.6	12798.4	20519.8	24194	25475.3	33364.3	22449.2	13081.1	23332	14068.5	11857.2	15768.4	28172.3	27802.9	20720.7	18881.3	16906.7
glutamine	2314.9	110.673	1944.96	50.8876	1200.1	661.547	38.9332	369.741	1627.87	1213.78	1384.86	523.057	103.607	69.4703	1366.48	1217.21	908.597	1023.76	1356.67	2531.06	2390.42	204.226	2757.46	1706.91	2489.71	1052.22	2002.57	2361.09	993.86	1518.26	1558.27	4900.44	1325.78	1638.95	1497.4	1617.32	1397.77	1306.25	219.092	1045.97	2635.1	1438.81	2524.98	3207.36	1182.47	1146.06	333.796	760.66	2746.04	152.222	2243.86	151.917	6665.75	1933.32	822.317	324.569	5944.29	2625.81	27.7476	43.5653	10593.6	3019.43	2569.95	6646.62	1643.26	1869.16	1193.37	1264.88	9337.74	1778.84	1397.86	763.457	1901.26	5241.32	3344.34	2232.44	2058.78	1409.15	2546.58	6105.53	1698.81	2797.61	1550.32	2813.8	3598.49	2498.91	471.962	1887.25	1912.86	5108.12	2554.3	906.695	2954.81	2666.49	1541.16	6593.27	2348.97	808.418	2933.9	880.535	1370.11	337.635	49.8265	13.901	286.07	28.0627	50.7268	274.725	0	218.75	12.5606	1072.95	52.9567	92.3905	892.867	47.8917	219.169	538.465	298.536	50.9104	0	62.2688	46.2575	25.1038	5.54475	746.335	695.774	1082.42	7.08893	2145.65	58.7939	2491.08	515.892	133.309	0	1074.78	97.5229	5002.54	71.4852	4162.31	708.423	1140.08	13.5567	266.383	1599.99	343.024	1279.63	410.423	26.0447	19.8325	12.6262	820.742	1402.41	1930.72	915.228	1472.61	4247.89	1998.74	1717.86	1145.82	1949.91	1047.16	2134.08	1666.91	991.647	3869.88	2305.88	2681.96	1171.62	3116.49	1540.82	2339.26	1073.98	5122.98	1544.25	965.403	1410.85	2614.26	1168.14	802.777	1151.51	1855.37	5180.4	2170.09	4047.96	1704.44	1274.89	3045.58	1500.37	3922.87	2352.76	3660.89	1205.54	2651.68	1313.98	1002.78	1159.33	5472.86	2833.33	3702.33	1596.65	3571.24	3656.97	674.25	2263.05	2895.59	8119.6	2706.78	1262.67	615.983	1384.22	3727.28	1835.14	685.882	6586.79	796.357	4674.73	2860.34	2379.82	1340.19
glycerate	205.549	170.352	969.514	211.185	552.678	184.076	109.674	1543.03	887.696	325.896	461.474	629.6	358.543	508.832	627.008	283.786	1744.9	490.899	350.74	1680.67	1802.81	484.707	5225.39	849.976	907.057	3057.78	2209.14	457.392	2686.39	328.563	358.228	2268.3	571.124	3393.75	502.677	3342.84	605.256	3160.26	565.441	451.148	1642.63	767.089	272.049	523.103	1070.29	727.957	2546.03	987.866	595.644	818.185	787.643	1583.71	1459.5	265.995	1402.92	889.208	348.876	558.246	212.031	498.292	1000.44	875.022	375.946	957.943	985.785	398.412	327.933	151.547	738.462	619.292	610.31	840.243	838.878	3313.58	486.801	5560.57	659.406	221.562	417.623	4277.3	773.379	1161.14	1000.19	120.786	6353.36	305.351	635.523	424.623	366.707	650.771	119.032	190.807	2719.39	798.13	250.885	2260.04	1540.82	1025.83	483.667	591.186	336.274	547.048	540.134	292.151	477.091	188.299	232.035	206.335	255.681	324.572	635.163	120.241	574.977	1207.39	848.339	1224.28	561.35	310.706	468.175	950.966	210.012	1325.91	1625.32	261.078	1566.94	1122.04	95.568	317.74	42.9364	632.718	443.049	682.118	483.7	572.289	131.467	265.938	312.603	926.301	584.528	2170.7	286.072	1170.87	414.951	159.482	920.476	511.755	3632.66	438.532	83.496	311.763	94.1194	1256.17	1943.99	5558.11	2802.05	1234.35	902.875	457.086	501.988	2749.01	2060.46	1083.98	713.581	1461.3	978.839	1497.96	1678.44	772.89	1428.63	2494.83	465.787	2660.96	1226.13	1480.94	1211.86	1591.34	2241.28	794.002	196.186	991.023	2316.91	307.559	716.409	1319.76	488.867	567.821	584.018	442.275	293.895	232.43	511.125	1547.94	373.994	914.687	457.983	203.586	630.257	785.605	731.553	757.562	927.623	886.6	1388.41	349.236	506.71	2008.74	590.904	547.495	788.138	581.789	385.299	692.709	82.0549	427.202	1828.28	3583.61	1757.02	2072.78	311.504	646.371
glycocholate	1.07903	0	6.91435	13.0822	12.1008	31.0592	31092.8	548.069	11.9579	1150.36	36.453	0	11.9191	210.823	39.2583	2.98014	3.1481	78.7121	19.1392	149.609	2.61846	124.236	45.1709	24.3465	8.50489	17.1866	7.37436	34.5259	8.10857	12.7648	10.5639	8.11141	7.12119	33.4903	9.57506	34.9665	1.48357	29.9475	104.348	22.3986	1.85395	4.39733	47.9868	231.956	276.877	81.7122	5.32904	3653.82	113.494	985.802	10.0692	41.023	76.4123	0	0	3.39839	1186.71	40.1868	5.25233	21.2977	371.9	29.6233	107.156	5.37492	21.8698	3.91143	3.06169	2.37287	2844.19	6.04683	20.9586	12.5867	16.7806	5.15903	44.1699	0	153.123	32.476	10.1295	35.7092	0	55.6969	0	9.11903	0	4992.65	103.161	35.5647	187.96	5679.4	78.2125	0	46.2757	172.713	59.6921	7.5813	40.0617	0	830.063	223.741	331.45	7.94261	52.1928	24.6458	1.67482	3.95991	464.267	47556	907.079	59.7942	151.442	113.115	0	8.18249	2.94392	6.36141	3.38085	44.7511	4.43604	26.4162	13.3305	3.95942	40.4252	8.61681	16.4285	16.8471	1.64931	33.2732	185.074	30.8815	730.517	7.50618	247.062	8.58574	1080.37	11.7517	5.74526	24480.8	39.8655	240.527	29.257	24.1626	49.1345	5.81799	14.9396	62.5641	59.4113	0	20.9058	42.3867	0	0	292.037	145.303	168.603	6.33279	0	4.14758	38.4551	0	6.06063	3.75221	3.96883	79.2761	10.5301	54.9637	2.68319	0	1.7085	77.4409	1.88361	5.73693	27.6719	65.7782	1522.48	30.5691	2.60908	46.4665	12.2587	106.245	2.00966	4.21449	44.2024	19.4743	12.7581	276.63	0	11.852	0	0.945742	0	0	7.2836	21028.4	4.0306	0	188.288	26.3461	69.7904	47.0675	57.9829	1853.58	84.9962	13.2179	0	43.198	97.3069	55.152	46.9695	2.27718	0	31.6674	39.8806	19.5455	26.8337	0	0	22.8633	3.37412	32.965
guanine	47.6517	278.481	110.69	102.981	67.4795	0	0	39.2407	263.767	0	163.173	93.9226	111.111	152.09	0	9.61674	157.793	55.5031	94.9376	0	347.352	88.6045	428.344	16.7679	204.942	547.522	575.062	0	796.638	146.988	298.493	79.1968	50.7326	243.895	87.8324	99.9086	47.6971	271.326	25.3457	88.6478	42.4203	41.3234	18.9714	18.496	10.0045	370.858	98.2739	13.618	0	11.0683	55.9535	218.987	0	73.5053	8.2443	64.6135	0	0	161.458	130.51	0	300.506	14.7259	137.555	11.4944	17.6386	133.965	23.068	0	15.3944	45.2542	7.62738	24.5794	0	152.302	0	0	0	38.4226	0	112.427	48.3097	172.542	3.26069	29.3981	0	0	0	0	0	208.445	28.441	15.3533	36.4	24.5724	35.0106	0	47.8309	0	0	31.9762	46.4344	163.861	191.135	258.304	159.42	5.89557	0	4.01279	66.523	329.619	0	62.195	302.314	62.0416	94.407	398.717	68.5595	166.899	131.935	153.005	1084.01	220.95	214.444	135.976	646.846	108.773	11.9963	22.7323	0	38.5915	25.3796	0	41.9411	0	87.6342	109.47	0	187.472	0	0	381.677	34.9428	95.2913	14.2216	119.629	0	425.629	0	60.6923	70.1149	0	0	0	10.0717	0	24.8917	7.21684	34.6996	57.098	54.0781	55.6799	108.659	98.8962	46.7997	5.2347	33.2678	39.8792	25.6121	122.952	11.7755	19.8731	1.9102	9.485	12.5837	8.1911	21.1415	21.1663	17.9662	28.0802	50.7441	15.8524	14.3619	139.442	8.93163	30.9443	90.6744	89.6069	40.1793	18.6281	0	19.9058	21.1473	0	0	4.69996	0	16.8689	25.9815	0	13.0807	52.6403	185.781	26.5613	90.2624	0	11.8056	22.6522	6.79213	47.4773	22.634	5.0392	30.597	48.0146	17.3326	5.68161	27.6213	12.5265	43.5203	21.841
guanosine	0	57.3642	16.4622	20.0842	25.7757	5.01008	8.39461	29.0387	20.033	189.231	8.45208	3.05106	21.0655	141.339	41.9409	14.7719	2.48508	21.1214	3.1838	110.647	28.0309	0	43.3961	70.8069	177.495	83.0023	32.2183	396.39	15.3072	0	24.7223	19.9357	5.71253	9.08213	139.705	20.1486	30.6854	123.203	0	31.7987	279.557	9.89603	0	14.8486	29.0849	0	35.3535	0	128.087	2.66774	76.5772	15.8275	15.4606	20.5401	9.78934	171.142	86.1102	107.27	9.7912	69.2584	0	34.2265	20.2417	46.9133	135.927	6.9276	4.82506	9.3061	0	15.6299	31.0228	165.755	26.737	229.139	5.10343	15.5719	75.74	0	27.8206	18.6848	9.7646	8.77772	8.96052	19.7531	166.078	12.1129	29.2514	8.41594	123.147	185.69	5.96272	3.87721	187.383	19.7456	8.91201	136.056	617.792	0	11.71	77.749	0	2.64974	69.3597	62.2178	5.93199	0	18.0195	0	0	56.6375	22.0314	0	260.045	8.14693	54.7674	19.2627	27.0431	121.884	53.5381	53.1195	56.465	16.324	78.0487	65.2432	24.9357	32.6818	96.4418	60.695	0	29.8101	0	0	276.371	70.121	22.3197	39.2536	187.841	19.0291	55.7838	155.844	2.00394	49.6899	0	3.01228	13.9268	64.5349	25.2963	25.3317	12.5162	69.3487	3.83725	11.672	20.5401	115.747	114.043	11.7045	38.1893	15.2804	56.0058	34.9537	19.1375	6.2354	45.7854	42.5211	14.5269	649.24	120.415	79.8145	7.91739	372.726	40.2192	155.456	11.6774	415.459	95.9163	289.504	10.4471	25.8044	636.219	79.7694	12.6449	208.523	1090.66	115.649	69.0227	337.556	0	636.182	10.0639	14.4586	13.8655	54.5465	423.58	72.7102	33.4187	17.0789	26.8955	195.596	11.1187	375.285	2.32739	161.86	80.6805	9.96571	0	299.107	1763.84	40.7135	46.0578	0	810.912	228.897	810.845	30.886	1.83811	48.0165	3.22961	32.9415	49.4946	702.445
heptadecanoate	1055.27	248.444	1553.99	3713.86	524.457	958.78	792.769	5364.97	265.722	351.755	229.171	477.625	1215.15	1250.19	383.222	478.863	3042.73	388.463	110.291	434.846	785.907	462.199	428.631	351.321	258.37	443.049	663.385	4009.19	348.118	904.153	1902.88	276.662	1174.17	333.099	594.185	1643.7	131.493	227.924	3780.7	218.075	308.171	601.722	783.052	172.642	2871.25	488.522	1427.24	150.048	734.592	755.987	311.836	2768.84	369.454	134.94	800.141	4901.45	159.105	191.445	2246.11	1129.72	1363.6	1229.14	1464.06	142.54	677.292	238.483	1001.18	465.767	1725.25	9601.92	735.411	672.312	429.643	622.583	644.273	633.193	194.281	488.606	215.51	385.144	3882.09	309.668	693.952	251.277	1077.52	4515.69	841.055	1018.35	726.811	876.023	471.941	1439.97	179.465	529.226	279.783	368.684	330.952	3028.22	487.886	2539.7	199.005	1098.1	495.668	3351.1	4828	3814.05	412.813	2095.06	1316.74	1732.4	2996.02	5236.69	1516.89	5607.76	769.938	406.971	2420.99	3794.77	3401.88	2138.98	1903.59	2263.9	1503.45	2681.71	3172.55	3322.61	869.23	191.992	1461.88	823.562	4300.08	889.934	338.564	3222	1493.19	609.957	3620.96	634.984	3376.85	325.003	370.052	4223.82	3075.08	2341.73	668.553	4746.92	355.501	4909.35	485.751	5067.99	1288.53	1557.06	1689.32	3175.42	774.766	823.269	447.674	646.824	1129.3	303.458	286.771	1366.44	2978.28	350.63	473.949	146.428	381.254	1515.84	255.06	176.947	279.19	421.736	902.256	190.798	577.787	155.041	217.178	0	590.25	211.115	1218.35	744.016	444.312	429.581	157.497	273.717	455.606	664.168	145.403	558.294	329.583	311.432	179.525	289.874	1822.02	157.759	310.065	486.805	776.32	879.609	567.076	494.952	318.34	721.013	41.0354	652.938	95.0747	261.993	463.924	1188.34	299.372	639.139	135.967	98.79	305.035	686.9	184.466	179.054	183.608	77.7116
histidine	216.059	135.477	76.2215	65.3455	130.409	22.6219	369.255	102.406	118.885	63.2438	460.257	115.33	74.369	56.2155	46.4988	139.184	71.6302	100.883	129.372	582.707	80.2993	362.564	302.631	46.7203	208.979	478.948	1075.96	513.285	59.5451	188.935	1058.63	1765.61	182.632	92.887	138.161	887.477	394.366	849.565	429.783	706.23	1054.93	109.788	427.619	210.94	351.603	328.517	127.531	67.2414	1363.01	186.483	1861.46	254.837	1248.24	362.505	796.004	256.506	362.052	1394.27	92.0452	262.235	2918.86	187.445	128.85	489.872	988.363	116.983	124.077	50.3969	980.751	138.498	200.62	114.141	208.278	257.365	189.143	1353.9	532.923	2891.13	90.391	1061.98	32.6387	132.719	47.7432	83.6419	267.327	168.672	188.354	52.8006	58.0101	297.668	356.131	28.2095	54.0213	523.591	87.4535	2083.65	59.546	0	1825.22	519.076	297.881	1406.18	58.8339	163.049	240.409	103.66	335.273	2192.33	48.8356	176.307	76.8226	636.053	114.925	66.6332	263.273	109.687	158.284	473.371	210.33	177.542	50.0967	105.229	72.1423	84.7458	137.33	588.616	372.929	549.924	63.4692	187.613	1419.36	325.406	107.392	567.974	364.188	357.712	114.68	324.897	87.278	1208.5	839.033	832.065	167.38	219.039	138.494	120.927	816.358	355.974	1317.26	82.2801	38.0539	193.667	66.4285	391.127	155.752	57.7646	1360.69	124.365	159.842	68.208	112.149	23.2049	74.7	274.647	628.604	424.702	63.1383	149.004	36.6716	877.569	94.5038	758.765	50.2984	453.154	202.363	127.645	389.877	549.326	81.9323	595.151	29.4459	17.0999	656.84	709.706	143.002	1262.7	44.9416	178.087	431.937	1534.23	269.519	315.762	110.279	667.075	47.3402	235.712	2254.96	2580.04	1081.99	763.757	66.4326	211.546	931.577	91.4607	454.601	510.504	505.611	192.48	970.218	1361.64	117.38	220.173	420.315	194.076	36.8909	284.495	205.728	374.321	197.104	123.955
homovanillate	41.7083	19.4142	536.594	12.6806	137.784	1253.45	15.41	97.2281	174.026	62.8513	0	0	0	0.434576	419.721	653.278	391.399	39.1215	34.5188	246.632	330.304	4190.36	431.3	244.86	820.153	408.028	74.92	502.827	300.717	682.496	732.493	245.314	669.528	323.591	196.143	425.698	115.525	271.753	538.624	381.892	44.4979	163.604	463.995	136.095	287.474	56.6188	1201.11	1793.87	351.395	65.9095	44.0162	240.745	151.908	195.037	490.362	3.66813	26.7931	440.793	0	0	782.638	262.167	600.152	533.321	5.48265	1015.54	2921.97	156.736	377.953	2288.91	57.8123	61.6026	90.7875	291.971	442.096	709.504	446.405	9.77002	75.4154	278.137	541.203	320.307	342.592	62.7094	1200.01	79.0462	165.324	11.6983	32.8244	74.5158	8.55496	320.577	660.077	536.581	22.8846	928.27	288.494	4.40415	318.593	0	22.2388	51.8014	0	19.4772	20.7335	17.8892	15.7042	146.267	213.717	22.016	0	428.027	0	3.75518	5.48658	0	19.8684	0	33.1705	9.9135	0	2.99172	15.5818	3.86135	102.204	0	0	93.1013	250.11	193.101	149.864	372.024	206.024	50.1484	288.985	22.3512	0	181.718	0	96.3553	1944.44	95.1764	37.2947	0	608.547	2.25586	367.316	0	7.74501	94.8096	0	0	0	110.324	19.7948	354.279	554.961	270.879	182.548	1084.51	1042.39	727.823	607.528	263.296	756.58	110.871	453.481	1580.66	1561.48	151.092	94.3117	125.909	1825.05	72.3976	309.755	980.844	847.236	47.4576	36.9381	12.2642	179.185	97.0328	339.888	21.0411	7.41201	41.7703	45.7701	108.243	35.8102	61.361	76.1765	174.891	17.9862	123.626	12.2137	8.89964	579.997	301.918	57.2066	53.9737	2494.78	150.873	352.286	19.3369	140.466	454.22	25.2628	459.843	181.43	103.558	0	40.3357	52.4183	73.3805	4489.4	9.4593	92.763	167.657	24.3963	31.6428
hydrocinnamic acid	134.198	144.214	6853.62	176.001	162.624	0	0	242.451	139.574	1291.34	536.243	2336.06	2830.84	3840.36	260.844	17456	107.885	509.424	31.237	1042.22	39.7341	0	14174.7	10440	2396.18	5092.8	133.276	1628.85	9101.74	10072.2	3636.29	437.389	3862.02	10914	3325.88	266.598	174.319	465.078	12678.2	6483.54	206.97	8814.2	113.511	532.004	8.46034	162.717	9014.84	0	1.77383	32.3056	326.294	85.7133	129.373	191.231	24072.4	760.989	0	270.38	949.687	1051.29	0	165.743	4509.44	4207.63	192.292	3330.18	4514.28	581.378	0	74.6254	432.196	67.0138	75.4105	312.973	1429.35	6251.86	8.17684	1576.4	290.638	26.4185	5809.06	303.383	1599.16	21.8977	18480.4	0	410.806	506.891	476.79	160.714	136.305	1093.81	13342	6.31559	346.909	70.096	148.901	1261.23	5.56528	124.494	462.656	1396.53	4870.52	196.715	671.241	76.2272	131.653	0	63.2251	46.1874	14177.7	0	5509.91	6479.46	13079.2	13584	1424.29	45.3899	45.2389	4295.3	12792.5	23091.4	122.232	84.5079	545.292	2141.73	48.6175	88.406	26.3247	27.6377	101.254	12.1708	154.456	215.919	18.6408	104.878	394.536	0	460.512	46.0177	253.434	309.085	3914.89	32.7095	314.101	1766.08	80.104	2390.84	189.852	0	601.282	23.2005	147.293	1378.43	3894.01	2216.18	779.526	23.1688	1638.44	4033.4	11666.2	4499.91	2755.02	21660.7	6804.99	5484.19	5490.12	6568.42	3293.61	18003.2	5586.77	4924.36	16.7804	157.528	33387.6	8657.02	3988.43	631.289	6473.2	552.093	2457.98	3375.73	312.343	9908.92	50.3239	2850.32	1019.54	835.294	33.8006	421.978	10110.4	4756.93	23.2661	0	1250.32	864.652	6.03759	109.921	1129.78	118.749	0	312.91	6008.5	395.162	593.916	125.992	15393.9	3234.81	2489.58	6787.06	1421.32	28565	1095.28	14407.8	0	1347.09	12616.4	946.996	2088.27	259.455
hydroxyisovaleric acid	187.254	64.6808	4023.77	86.5631	97.6904	335.148	82.3141	579.43	1319.95	289.737	622.882	207.808	111.6	306.047	272.469	586.733	740.908	841.878	804.462	2210.85	436.613	6078.19	661.109	1752.69	271.321	730.252	311.57	162.386	326.274	407.599	833.244	1039.15	210.213	610.158	201.264	378.677	152.508	839.541	469.482	1165.76	189.812	34.9343	778.278	2949.3	372.867	549.306	755.974	4402.56	1347.24	428.31	2035.42	260.422	1046.21	1054.32	8506.4	122.093	310.96	178.706	105.32	62.8541	1190.18	2725.3	392.706	375.447	623.434	952.408	571.875	415.443	666.05	983.932	85.8441	822.206	115.626	194.952	239.921	1913.01	99.1806	72.686	467.99	1195.31	291.744	985.188	360.14	983.075	3703.01	64.1549	546.353	1458.59	234.399	916.719	205.789	400.294	279.346	615.797	438.189	4509.06	682.235	100.017	5826.59	102.271	850.336	2723.71	65.3794	76.736	289.146	171.79	111.154	364.121	642.696	338.373	144.042	642.745	106.806	131.682	188.017	152.311	367.317	89.3682	110.851	269.82	24.5963	123.431	150.385	166.041	650.846	175.515	63.515	1944.35	248.405	549.188	1069.98	1183.1	827.411	176.659	286.835	140.144	131.926	1238.65	156.056	1227.75	3850.46	270.595	276.88	404.947	3977.62	66.4985	1864.96	128.537	256.139	296.219	30.7244	49.2514	133.543	228.873	792.143	111.542	176.252	97.4073	150.343	919.764	424.907	975.779	130.353	130.674	466.91	367.379	299.161	231.39	317.239	336.017	139.583	302.509	331.261	146.553	348.782	516.023	424.654	485.517	165.514	3577.3	98.9981	65.3272	1947.58	416.603	71.4594	386.761	175.626	1449.08	58.9295	88.8905	541.938	189.027	278.698	332.988	235.811	227.88	858.538	278.639	195.004	1021.92	4801.65	456.466	267.485	159.336	247.73	100.764	272.198	181.177	210.041	161.104	207.472	257.483	91.6015	682.862	4098.25	146.214	124.606	1618.32	133.667	824.74
hypoxanthine	1920.48	970.34	6000.43	170.964	5383.29	920.285	73.0215	1910.07	4526.08	3570.92	2245.45	2931.53	1326.6	342.854	5345.66	2515.27	4757.41	3409.01	1151.42	4659.44	8555.21	2438.29	4357.69	6898.17	5592.62	7282.27	5561.01	3561.33	4448.19	2839.3	4267.52	4727.54	3400.15	7236.92	3787.87	4518.9	5119.32	7115.93	2762.74	7542.28	3681.9	5243.14	2031.99	2097.14	2170.18	1336.26	11637	1386.05	2327.45	1748.22	4746.88	2382.44	5345.28	3891.89	2396.55	1903.78	322.913	5772.82	535.486	2168.31	2207.11	2099.62	6158.99	7790.93	1608.42	6900.72	1554.81	6338.31	2111.04	4948.75	5096.77	5218.31	4817.78	5653.21	5563	16741.4	6533.6	1462.07	3516.49	7447.8	6830.47	2359.41	9369.26	873.607	5089.82	0	247.924	2007.98	3892.86	1622.01	2691.25	5406.73	6895.27	4673.39	3975.83	5864.89	2864.82	3036.81	1199.46	115.021	2303.69	4668.82	1000.45	172.532	1236.29	737.042	402.564	1223.69	176.146	1997.35	1371.06	219.362	1403.24	1663.8	2816.16	1436.8	1173.2	828.891	734.653	1670.94	699.155	1173.26	676.838	1287.8	2399.36	1548.89	613.409	2859.01	309.093	5271.01	62.4565	2624.96	1980.55	2314.68	0	728.558	565.282	1038.87	1299.24	2134.4	2980.34	1248.35	1400.34	29.1333	3701.06	546.043	554.588	1318.24	346.83	321.034	569.65	379.669	742.383	1675.15	595.974	7470.6	4462.71	5191.13	4868.7	12006.5	11167.4	8807.05	4017.15	12786.9	9759.23	2766.63	9328.23	9385.35	7039.67	10856.2	2383.36	11197.6	7244.04	10034.5	13743.2	10502.6	9708.94	6149.14	3837.39	2735.5	7686.8	1562.57	10090.7	6018.99	3707.88	1750.65	4153.59	3257.3	3623.45	2926.7	4113.14	8961.48	2054.14	2238.16	3529.08	2091.68	2633.72	8227.45	6700.09	7104.59	4034.21	7778.15	5309.88	3092.03	3763.93	8001.49	4810.44	8878.48	11852.3	4785.78	2373.5	7531.6	2054.26	3488.93	1821.98	5428.4	4258.39	8130.76	5637.78	3454.32
imidazolelactate	22.2161	53.1684	29.0283	11.8511	19.4046	133.631	43.3909	36.2629	45.9429	317.661	218.305	42.7123	24.3943	12.8601	108.825	21.2245	10.1124	88.9802	154.836	1238.15	16.855	64.0796	50.0723	35.8111	72.5225	152.957	53.0038	49.3837	143.622	13.0787	60.9232	289.162	53.9677	61.7321	57.2657	141.174	46.4319	591.179	29.5717	36.9649	45.8804	113.988	100.303	15.8671	1710.07	35.7655	94.6678	73.0174	840.446	553.695	163.47	177.15	4.43231	64.2355	225.642	83.0256	68.183	251.04	32.3322	24.7357	306.96	2113.06	5.50376	10.42	24.8351	12.1192	19.8711	38.7182	182.868	56.0159	100.135	32.6966	16.9779	84.5381	18.1619	958.601	122.922	908.26	22.2143	59.8804	46.7432	72.0929	58.3178	7.74729	104.566	50.1575	103.145	69.1427	128.616	821.719	66.2797	37.8336	21.8182	1067.74	30.3742	532.757	65.3274	40.0778	144.486	71.0767	6.04359	237.806	27.3706	58.498	68.194	43.9148	146.906	216.663	231.116	827.563	42.944	93.7516	43.7485	61.6284	27.8114	29.3903	73.6673	29.4664	40.0447	72.2406	18.1074	68.9506	48.8981	14.7276	46.9779	42.5434	39.936	122.137	98.6284	13.4738	655.039	252.095	209.953	16.8487	464.251	72.6664	71.6064	149.444	17.0028	354.58	512.983	146.017	38.3971	21.6249	2848.88	24.9715	196.412	31.4601	336.732	30.9103	13.7213	161.367	51.9459	46.7768	84.5591	54.4204	83.3945	26.5557	40.7162	71.5552	46.3735	41.9884	61.8155	18.1636	21.4498	19.0912	98.1958	18.8289	72.1499	77.8414	21.7476	64.5784	49.6991	11.0399	70.7362	37.4165	47.8655	679.847	47.5701	731.978	51.6878	38.2698	1193.61	55.5398	18.6652	168.14	51.3602	49.1425	21.9999	49.7462	33.6827	46.4114	48.6947	154.7	42.3218	130.132	212.661	25.6733	32.9657	112.46	344.601	46.7336	43.7677	56.451	35.5579	28.4089	35.3953	50.5732	66.6204	63.2534	66.3867	307.903	28.3044	21.3085	868.849	92.7385	26.74	16.5658	15.3261	427.752
inosine	102.989	175.039	62.5715	48.2679	414.085	0	38.9056	22.9909	67.598	716.378	43.7669	4.77004	23.9777	212.967	53.2878	98.9136	64.8811	27.7578	16.0906	137.648	141.455	4.49971	64.429	174.4	993.13	460.969	41.4188	668.536	132.72	113.051	116.993	48.2461	109.221	36.252	716.185	88.9155	200.76	1138.34	46.5905	163.059	419.294	225.269	0	46.4163	145.618	0	89.0549	0	252.847	3.84934	241.702	47.0554	28.7788	44.6968	0	124.488	103.759	267.694	0	87.6265	2.58249	28.1845	165.641	359.34	131.084	113.652	45.7959	484.862	0	122.585	70.0054	426.997	82.7336	418.835	110.115	1100.73	268.844	11.1816	77.4481	112.845	66.0465	28.3747	715.197	20.337	275.977	7.18619	134.26	122.999	279.698	198.909	0	93.3495	428.748	114.783	90.6903	177.256	677.372	71.4718	38.0932	60.5041	0	0	86.9582	396.453	6.63038	9.44002	107.228	47.1502	0	118.063	64.9541	13.2723	350.16	34.1923	132.357	55.522	31.757	234.113	93.6942	35.8881	356.881	0	294.268	69.9897	25.3789	26.5101	94.9388	181.947	12.1011	74.0351	127.736	93.0689	204.559	118.717	53.9213	89.5564	129.741	10.1377	63.4561	289.982	0	46.2066	12.072	5.89926	0	66.5122	65.1875	30.5617	88.6552	219.875	19.3876	12.355	8.27254	55.2393	463.749	379.876	137.288	156.089	274.027	445.795	267.405	201.762	375.099	400.618	788.368	598.494	907.991	203.358	149.409	1628.1	103.329	441.456	116.47	1421.44	322.486	1202.16	443.727	132.807	1369.04	481.062	302.264	447.455	1512.26	620.936	195.814	414.95	0	1564.06	84.0559	0	73.2492	219.509	1056.36	151.41	261.243	296.396	32.708	527.946	47.0681	1240.19	62.3216	177.794	82.1292	72.5229	206.801	869.823	2497.08	135.309	301.565	73.7887	1965.31	1240.89	1077.34	169.387	4.0113	107.035	0	197.789	432.833	963.867
lactate	289.984	642.96	4611.32	116.765	462.173	424.034	20340.4	375.717	215.782	531.503	95.2509	132.802	684.545	1002.82	497.194	217.507	579.911	554.697	412.859	6822.11	228.703	8060.44	579.682	5738.16	1173.9	317.319	324.842	158.978	270.555	201.32	69.1334	21101.9	265.703	1113.68	486.979	397.82	515.142	841.752	600.68	6449.53	721.466	215.526	713.977	106.784	1465.92	1220	1474.36	3012.31	21255.2	2118.24	1378.7	303.337	24390.8	626.367	34653.7	293.135	16339.6	562.845	136.167	221.318	74532.4	969.006	1021.62	1267.67	425.88	229.913	921.938	222.934	42966.3	434.899	799.261	557.076	113.782	786.812	4156.45	106322	138.541	93.2565	223.799	59209.2	145.766	3377.19	1952.17	870.48	53349.8	9067.9	502.753	8104.85	864.14	20523	249.155	93.8764	417.692	1309.56	684.192	17180.3	598.754	106.135	20056.4	2152.85	407.229	438.758	1432.48	507.243	212.379	992.039	4745.89	3139.14	416.349	845.414	1229.76	467.2	257.552	316.553	149.316	313.092	259.871	131.521	748.04	278.438	503.524	343.377	522.022	169.727	5471.48	238.258	363.6	16658.4	612.125	1445.96	10072.8	4695.06	54063.7	121.741	1363.48	142.228	414.003	26636.9	459.265	29817.1	2340.1	279.828	573.898	218.173	7633.23	141.482	5443.31	205.785	112.925	490.141	345.786	4084.01	577.114	3819.65	555.474	246.253	213.145	153.916	293.798	403.342	496.545	670.426	275.758	585.764	1797.37	4618.9	412.338	196.396	322.291	740.602	555.85	602.593	130.53	306.246	616.133	1144.29	387.743	463.11	241.937	84.7396	263.329	382.129	529.026	317.26	416.882	2203.21	150.62	665.363	207.076	337.349	1116.01	283.316	1076.37	9279.94	350.914	677.37	1008.44	219.917	1737.85	213.646	585.392	486.616	130.962	233.633	251.624	141.4	274.793	1103	221.529	111.646	2029.4	110.992	760.107	464.812	8116.94	189.581	352.483	1521.38	114.364	886.266
lactose	614.656	23.2725	67.4919	9.56054	110.929	155.258	13.5861	161.053	111.937	330.801	70.3185	23.1805	13.0409	19.1839	148.566	43.2407	129.545	214.151	13.4311	91.8147	207.847	102.667	119.127	119.678	72.0739	141.198	212.713	971.932	46.1098	152.458	51.8575	581.371	15.6222	120.372	14.527	58.7247	35.6109	138.794	45.2102	133.105	11.5388	41.6847	213.232	389.387	49.6874	1625.35	161.757	242.8	57.4416	57.2782	133.617	74.516	692.639	27.2522	365.115	19.3319	84.854	553.353	8.54944	57.1863	487.699	511.133	761.456	158.302	351.837	162.82	37.6366	187.498	405.631	116.521	168.084	104.938	143.993	2419.87	133.137	39.5297	138.124	1694.06	117.288	109.012	44.6197	325.871	32.8972	0	27.0457	146.785	158.578	16.3702	316.717	104.515	0	69.3691	85.4115	71.8567	111.156	156.582	1188.69	30.0583	319.596	0	86.7975	86.2203	16.9084	72.0474	10.2006	55.1373	20.5307	21.5017	65.6651	84.4808	69.9712	31.1782	5.89017	80.9259	55.0871	47.3053	9.98607	203.556	13.5902	216.395	17.9176	87.1303	129.528	76.7721	231.689	90.9721	20.7795	39.3699	72.0102	143.385	16.7086	219.01	0	22.1136	76.111	57.135	26.087	306.212	47.7925	3171.37	200.824	37.0502	64.138	5.81885	1349.23	6.0906	18.8071	12.1947	85.6373	114.894	15.0601	527.947	65.8012	0	539.483	50.2782	822.017	468.112	207.481	123.463	276.948	130.595	113.263	51.4512	99.127	966.879	120.199	209.167	138.378	462.417	82.8309	72.9102	55.7401	730.117	612.668	195.035	172.364	452.982	79.7202	133.275	72.8759	53.2992	207.339	69.7949	163.518	84.1049	43.7905	59.9729	207.45	158.483	83.7739	144.52	5.57493	162.321	76.2955	23.343	152.056	372.751	49.9671	429.482	574.649	285.879	141.006	40.1579	133.333	38.7603	174.065	165.862	75.9212	40.9466	82.8775	404.685	110.164	237.922	139.666	46.928	241.952	66.4322	75.9148	128.656
leucine	36008.2	2017.01	46864.9	2025.51	19265.1	42331.5	1026.32	6703.08	23948.8	30793	34661.1	30121.9	896.385	2602.87	25818.3	19547.3	26102.4	27719.1	25106.9	29302.8	34174.1	25113	28832.2	27780.5	34282.5	19244.6	31864.8	30573.2	17542	20164.4	40808	72560.6	24789.6	30269.8	22616.7	34293.5	15343.8	20747.4	29977.2	26970.6	29609.6	24006.5	45684.2	30274.4	12965.9	23294.9	25223.8	11879.4	45828.2	15732.8	68559.8	4888.87	55856.5	39559.1	27003.6	6576.36	34022.3	39637	2345.63	7588.68	44143.7	42282.2	33934.4	48147.5	19548.8	39915.4	30210.6	17538	72200.9	40744.3	27998.5	15060.9	27370	23804.4	39910.2	72830	29364.6	53647.4	40332.4	71122.2	35377.9	42290.9	31702.5	24091.6	46415.3	30764.7	17163.8	21139.6	23229.9	46560.9	25584.2	26536	25453.7	32125	19004.5	75593.6	38418	20001.1	21619.2	15438.9	18129.7	10261.3	1842.08	779.521	5037.69	1970.17	1360.09	8188.75	839.86	5547.61	369.587	19679.4	1434.26	2303.03	8962.75	1751.57	5059.65	9137.57	5812.05	6531.94	210.286	2837.37	909.89	2297.1	1535.01	7557.85	8958.86	37520.8	8605.6	49632.3	4476.45	19124.9	36533.4	13982.7	3956.55	11250.5	2748.99	34631.2	4403.87	41027.6	24533.8	13989.7	4173.69	3667.08	29662.8	4771.3	17914.3	6639.88	3192.45	803.983	122.37	41132.6	17610.1	39552.4	31569.8	26351.3	44809	25950.4	45591.1	31093	43165.4	38243.1	37394.6	48282.4	46403.8	42411	30061.3	41184.1	22316.4	53129.9	24475.8	48750	22638.6	42088.9	41849.3	33231.6	30170.8	29635.7	18685.7	15597.3	26322.3	20661.6	56517.5	31184.2	35014.1	30588.2	23356.3	39465.1	21447.9	44184.5	46996.2	37103.5	19555.7	29782.2	21700	18747.8	40491	45152.7	47283.6	39981.6	56704.8	38623.4	52652.9	12625.7	61418.7	27763.1	65707.4	38086.4	30313.1	26864.9	25562.3	31570.6	34596.9	23312.6	41100.1	13521.6	42095.5	48987.4	33383.6	20621.3
levoglucosan	186.473	166.283	402.919	202.288	253.373	93.9984	500.475	421.749	3955.88	3095.12	1828.71	2114.08	129.509	203.133	2702.66	243.31	554.984	21.8107	547.979	3591.52	647.355	1465.33	2246.21	2287.8	4560.97	1865	654.32	630.386	723.823	496.171	538.215	794.533	1996.6	1858.6	387.139	631.165	883.217	699.839	761.277	1426.06	422.509	512.724	443.931	1503.38	403.391	121.725	710.174	3922.25	5943.61	4527.63	2072.85	559.654	574.408	2662.3	640.628	257.923	136.668	5746.16	132.58	265.714	1897.04	687.145	690.369	906.584	1456.75	425.369	284.06	5542.52	1806.52	805.753	300.374	542.113	79.8148	614.199	936.668	55.6809	685.888	890.917	771.676	304.304	170.684	1017.17	458.58	436.897	71.3649	353.451	1105.22	350.534	1135.18	559.76	628.477	835.134	1121.79	727.073	872.418	615.048	389.865	108.897	7121.15	762.595	336.615	54.7776	290.958	142.57	236.923	168.351	1291.74	142.499	2482.48	5027.29	188.386	87.3516	346.419	352.531	609.833	130.365	155.593	140.473	191.81	411.022	174.134	478.542	723.635	194.509	443.953	107.73	521.712	1368.43	294.687	1445.14	1249.93	3536.83	18277.6	71.5313	3731.3	176.01	303.712	274.238	564.057	143.145	4108.52	270.774	359.044	146.388	17197.8	208.542	409.584	250.443	71.5953	0	54.9203	362.933	213.239	0	242.72	335.015	670.109	2095.85	1197.33	2122.46	1541.19	1773.61	327.89	534.431	265.459	656.097	1975.27	1439.01	659.026	429.941	286.152	2343.57	157.633	2252.2	317.92	3758.71	699.172	6368.49	398.504	512.552	448.079	363.786	290.085	266.464	432.658	0	2777.96	484.673	513.097	464.125	871.442	1477.13	176.916	153.689	303.563	240.452	9240.41	0	3043.18	464.072	830.921	504.625	716.426	684.862	851.633	570.727	1310.3	1759.57	959.389	125.776	213.738	386.912	423.077	592.431	1220.73	195.771	285.322	536.39	388.398	0
linoleoyl ethanolamide	85.6486	21.7682	16.0664	32.983	603.631	102.32	83.1964	86.6676	105.893	3786.84	842.954	168.044	12.999	96.9039	136.058	33.6593	23.2555	236.811	66.1057	670.461	123.19	2876.74	48.3205	280.23	28.7726	158.444	107.959	20.0451	136.338	42.8842	15.3548	293.869	17.715	220.623	39.5216	19.9304	95.1893	369.632	15.8069	84.7614	450.941	54.1638	1001.63	1321.43	2625.9	1792.05	138.701	115.29	303.511	1856.03	310.754	57.6228	262.246	159.241	427.19	88.4992	99.8468	1211.18	22.523	14.8981	423.432	330.305	2998.02	246.462	84.8642	48.8431	11.7358	13.8832	810.772	569.976	3216.06	252.055	66.4761	89.0227	96.5072	0	906.744	307.041	1544.34	84.9204	13.0455	22.8768	24.4118	20.3888	18.42	1246.5	693.341	187.346	1037.83	459.404	231.14	15.2622	117.803	1118.34	225.278	24.512	989.292	11.0674	1617.49	258.896	1441.08	383.308	137.867	10.8475	173.174	34.0839	26.8756	156.219	423.825	1565.2	30.4456	595.247	14.9603	49.3162	55.4718	99.8887	33.2046	1377.5	21.7544	17.528	12.4957	40.5126	10.7778	111.554	87.0544	133.595	24.5043	31.1042	68.9826	327.796	349.43	2300.13	851.624	653.79	279.519	405.481	301.737	1621.17	269.296	53.5767	1141.01	31.4068	249.013	4.931	141.903	10.1933	0	15.2416	0	1287.08	16.8818	35.9628	22.2453	69.7609	24.0741	33.72	16.373	42.3757	40.4009	109.033	109.323	46.8677	33.9691	54.1871	51.0609	368.385	208.459	39.0019	81.1847	135.668	77.4864	61.1318	29.0342	884.083	119.557	109.632	63.5381	131.969	30.9696	341.896	41.3459	25.7197	307.479	34.6212	56.2347	111.109	111.857	33.3862	82.0852	31.8882	178.651	51.9748	21.6775	85.1168	84.3819	8.28856	445.351	70.4532	70.5163	465.373	1174.08	320.289	38.1742	41.8993	16.0245	542.648	34.592	205.811	24.1384	18.9097	20.1745	3454.53	62.9938	24.4964	2000.96	190.82	135.374	349.46	223.959	368.29
lithocholate	17732.1	5349.94	11069.7	25275.4	22733.7	20.5055	0	12103.5	12640.8	3643.5	8426.76	10630	5378.32	9310.37	12097.7	19890.4	30945.1	7177.52	3.52792	7698.78	14874.8	10.2503	4130.08	11522.1	12004.2	9899.24	11329	15919	9808.9	24885	18172.4	718.643	10981.1	11159.9	14222.2	14418.5	7366.66	6751.41	23713.3	12671.3	17995.2	9453.07	13130.4	15939.3	18.7795	25287.6	14327.9	0	0	23.3617	69.1579	9046.02	8919.09	3102.74	22.363	24063.9	0	1840.35	27743.8	16763.7	0	10178.1	39151.3	11632.6	9305.35	8873.15	15351.5	8890.76	0	11472.2	21665	1519.55	20842	4615.35	27567.3	0	10794	42769.8	18665	58.1734	21574.9	13992.4	19253.4	25477.4	199.475	0	21.071	23.9246	129.972	0	6985.42	15884	10991.9	30018	20230.2	150.674	21760.6	6829.05	0	4430.48	8751.71	5899.8	11404.5	3270.47	6694.46	16813.4	597.267	0	0	368.697	10619.2	14.6795	1807.42	15654.5	12543.8	4947.8	10823.3	14389.2	18111.4	17557.1	27033.2	16572.6	10416.9	9561.62	7537.58	15793.2	4651.27	8.18328	0	0	13.2535	259.339	78.4623	16884.5	69.0287	6083.57	4503.96	0	16030.1	71.7359	460.928	6977.38	2871.96	11027.8	0	15154.9	214.113	9459.55	4940.34	51.7457	4612.66	1813.3	8108.13	5692.14	6187.78	10682.1	11483.7	5601.61	18641.8	21573.7	17826.5	21417.2	30968.2	18537.2	9375.34	18916.8	16187.8	23494.1	5664.35	7988.78	21889.4	11001.4	14411.2	733.986	17769.1	9030.36	21320.8	61.671	5663.04	3545	10993.4	20067.8	2394.42	12480.2	6817.25	7.1506	8542.43	18.1979	10390.5	8146.83	644.352	10441.4	4426.67	0	12983.7	2524.21	126.532	8903.39	49162.2	11800	46.3718	28425.8	22692.9	12894.3	1443.99	999.734	13628.2	24999.8	16545.1	23920.3	2326.65	27958.8	18761.4	9689.04	0	9717.09	10862.4	278.939	10708	8588.11
L-phenyllactic Acid	466.811	8.75268	1415.57	20.07	322.676	663.512	35.1146	233.356	744.051	289.51	168.339	124.068	6.96212	24.461	1250.83	1522.39	964.275	468.875	457.847	1239.54	777.502	3686.62	271.49	578.078	913.337	176.17	143.127	504.021	150.086	508.623	1350.38	483.308	1407.47	1000.63	583.833	1853.24	787.027	191.56	586.624	1643.96	185.595	405.711	404.822	1148.84	283.903	985.392	1764.72	6504.61	858.245	514.831	523.551	59.5452	1015.4	4117.38	780.832	14.7431	67.7525	389.661	0	12.8875	7699.49	1659.57	1191.79	688.536	127.489	1865.69	2244.89	1680.93	3227.19	1963.29	172.349	270.103	515.635	1253.74	1473.28	2481.18	249.299	39.3892	78.3608	927.879	784.534	871.547	1269.47	477.723	2228.38	108.845	382.747	26.3849	298.612	136.322	204.988	1414.56	900.508	3658.9	239.549	5752.98	614.729	35.8595	1152.54	92.8908	128.076	724.761	9.60371	39.0891	39.9749	23.2352	23.4885	448.026	426.265	18.2773	0	1684.82	0	6.10431	0	27.5542	41.8223	18.1472	11.7186	32.8869	8.04131	5.61676	30.5722	30.8658	383.018	34.0182	6.81915	1398.99	397.698	161.076	289.277	540.46	354.148	92.7402	413.019	92.5144	6.60932	731.558	326.752	386.503	5638.24	68.2286	217.44	20.3436	1135.23	11.5369	966.707	8.80545	20.3377	95.0872	0	36.992	80.7753	136.484	24.7931	1919.07	1850.93	571.194	287.504	3598.72	1095.05	1295.49	366.305	520.663	1150.64	116.801	1395.56	1745.22	1434.03	415.843	334.444	256.42	2390.46	1114.76	648.733	866.934	2952.6	116.815	220.361	68.2358	593.865	114.298	514.602	67.7819	147.944	26.3819	251.535	2774.45	379.45	216.797	219.611	486.438	37.6531	435.292	195.743	218.004	2013.25	832.828	513.341	166.008	6438.95	374.74	2278.45	268.166	716.961	383.742	0	620.288	700.214	311.425	50.7815	121.739	20.094	436.512	15504.9	74.4525	334.747	1199.15	92.5249	394.599
malate	9547.11	1043	18768.2	759.124	17977.4	1986.35	1862.62	2995.72	7158.84	7899.34	10407.4	7103.79	1959.64	1024.32	18002.3	13234.3	10332.8	9632.27	3471.29	16257.5	10760.4	12659.7	15549.2	20739.4	9416.37	20582.7	14061.7	5221.87	16275.4	7686.12	17386.6	7839.04	12101.7	18017.4	19540.2	15776.3	15004.9	14411.8	9652.79	19256.3	10755.5	15890	20249.1	15102.3	11135.1	5991.2	25126.9	5270.77	10195.4	12934	15163.7	3924.18	17664	8310.89	6940.54	1632.86	6980.88	14075.3	572.689	1810.87	2325.54	3174.8	6162.34	12221.3	2295.81	12752	10886.1	15287	3324.27	8708.92	13246.4	13381.2	12513.9	14387.9	19255.9	26123.3	12582.1	10598.4	11522.4	14181.9	15343.9	7611.79	19708.6	1739.77	19310	1734.66	1689.43	9138.08	4128.41	5341.33	2904.05	17936.3	15383	11887.3	6447.27	22933.9	9041.11	10108.1	11686.3	3929.83	6468.36	8990.75	1228.49	2568.43	4165.9	1305.17	2223.45	1523.58	954.047	2592.97	996.496	846.808	1730.53	2230.73	2089.81	1543.3	2070.87	2307.27	1170.59	2733.17	2958.98	1895.04	1369.73	1556.62	1479.48	3115.93	1115.43	7955.9	931.246	9511.72	2985.36	12720.4	16943.6	4122.19	3707.79	4224.65	1264.4	8498.26	1441.63	15081.3	16061.3	4888.19	1933.72	1368.07	22101.7	1858.12	3819.94	1710.51	905.554	1240.13	710.851	1170.19	2384.49	3612.66	1500.99	12450.8	15924.4	9210.23	12217.7	18550.9	18443.1	14413.7	8478.04	14017.4	16228.9	5551.25	22093.6	22499.2	14763.4	8457.18	6847.03	25797.6	15239.8	13964.1	16467.4	13169.4	18049	13667.3	5208.84	5342.52	13972.5	3416.22	10875.2	11268.1	8196.61	3252.23	8577.95	7396.75	9216.39	2407.65	2695.02	14604.9	2818.38	5092.24	9629.41	5339.9	11299.5	7327.6	5281.71	3557.04	10610.2	11163.9	17026.4	13009.3	6643.05	12538.9	2406.83	18852.2	13843.3	12403.9	4087.43	6661.7	838.361	8203.66	12082.8	9723.87	9404.3	16819	9185.78	8023.7
malonate	174.406	82.2969	154.547	87.201	73.0385	31.9592	265.957	81.0969	311.906	1598.33	72.4507	233.588	615.267	47.9396	466.346	86.8752	40.4927	742.179	415.391	415.201	290.797	209.131	135.852	239.714	68.1723	387.209	67.8009	167.635	119.2	68.2163	361.247	489.558	87.3235	154.678	1266.77	113.53	345.263	102	80.0313	90.8778	336.728	71.511	1319.2	109.893	96.8375	183.279	373.267	938.439	193.492	611.075	1144.97	388.103	1225.41	615.096	126.863	162.513	236.013	305.642	77.6038	80.5936	348.517	166.043	65.7352	18.3678	457.364	92.7776	64.6461	55.0972	426.583	36.1245	58.0243	3369.49	122.011	308.369	1851.52	42.5267	65.2756	757.698	1051.88	165.868	55.7463	343.186	234.711	50.1352	82.552	321.485	489.064	909.076	478.056	69.9323	329.842	111.371	175.94	88.6208	79.5076	284.216	90.1311	42.8346	1134.22	173.23	874.84	238.74	76.5325	439.995	220.579	109.71	164.979	511.679	212.975	454.06	117.638	119.426	103.817	161.909	109.658	92.3298	84.5598	39.5691	72.1218	76.1368	143.864	136.621	139.061	58.8593	179.691	239.765	171.987	2108.86	1364.58	806.291	2014.03	1063.83	597.571	22.8993	90.1943	669.901	75.43	412.49	73.5427	296.968	621.178	223.779	112.273	82.5208	1143.54	80.2729	1125.21	219.262	1319.94	755.807	70.4462	640.829	380.049	2241.96	133.865	114.123	78.6888	40.4725	50.3707	86.2536	159.643	59.4257	83.1845	100.466	191.292	249.598	807.643	173.633	59.8428	497.084	70.9886	381.624	84.6933	606.674	219.534	82.9972	351.429	412.465	41.5312	722.56	54.6221	68.4203	1015.8	507.654	133.102	1155.6	40.6649	123.023	41.5636	36.2087	221.25	694.454	123.807	439.449	119.358	34.9688	191.846	1339.62	34.6898	1174.61	1100.23	163.231	285.094	64.5172	333.463	260.004	1132.1	109.776	59.4595	47.4681	45.123	29.0174	21.0085	101.628	106.592	69.2117	224.241	256.669	54.9555	873.038
methionine	9396.75	1138.61	7012.95	699.965	4512.82	10314.6	0	2272.06	5727.05	5453.48	4726.15	6244.44	312.527	722.6	5470.3	4450.74	5805.35	6796.12	1862.4	6949.39	11610.6	8904.63	7949.66	6931.96	8313.5	5754.51	7619.66	9843.96	3757.76	5046.88	9673.71	3816.26	5446.99	7477.21	5921.67	9594.76	4237.97	5004.79	6872.73	7549.77	7257.66	7096.34	4326.01	5269.53	3529.57	6619.18	6126.08	2036.42	6734.36	2837.43	9289.12	2279.74	12956.1	3998.64	1682.91	2049.13	2643.2	6838.44	857.409	2864.98	10663.1	10663.7	9520.61	11129.1	5120.75	10257.6	4511.75	4722.83	9866.02	8061.87	5120.62	5893.33	6031.43	10880.3	8872.3	10332.9	6759.66	5257.41	5747.89	11331	6567.48	9276.15	7944.84	5378.32	11595.9	3211.86	4796.15	4381.22	4729.06	4190.31	5548.63	7401.02	6142.54	7912.78	4641.7	16015.8	8461.39	3461.88	2820.11	2863.64	4532.79	677.012	829.924	213.847	1680.85	433.138	121.471	0	86.8021	1910.8	140.894	1718.6	794.792	731.439	3488.66	363.572	1158.11	3553.46	2118.42	1018.29	60.7911	1160.96	260.877	920.015	713.142	2722.93	2502.81	7330.02	186.363	6037.9	497.118	4253.43	5518.99	3880.89	58.168	2906.15	826.662	6414.49	867.323	5572.84	5336.69	4095.62	303.792	1140.09	4397.76	2249.36	2446.25	2263.71	71.3782	362.765	25.0873	2157.74	3316.29	7004.09	5495.17	6082.66	13549.1	4397.23	8730.88	6166.84	8376.36	5561.53	6352.29	11393.5	10329.5	9378.56	6374.71	10525.2	4201.18	11285.7	3831.04	9179.43	3480.36	13011.9	8974.35	6853.89	7452.17	8969.48	4136.36	3046.55	5640.02	3865.09	15674.3	7611.73	8525.31	6710.4	5458.99	9717.78	6656.16	11968.1	5130.53	10425.5	4552.27	2799.93	4879.68	3295.97	5613.1	15594.2	9297.43	10540.7	7573.51	8237.76	12856.9	2108.44	5564.95	7320.39	15169.1	10793.1	6866.48	6252.73	5073.45	8633.27	7275.22	4413.7	9155.19	3663.81	10953.6	6811.02	8232.68	4692.96
Methylbutyric aid / Valeric / Isovaleric	12632.7	3377.95	9039.04	1696.21	9414.49	976.355	0	4527.2	2045.86	4617.45	1698.67	2256.73	844.345	2977.79	1398.57	17076.4	11906.5	2458.93	1616.17	2030.87	5079.58	8032.07	5543.76	5010.94	6587.19	2884.22	11690.9	6023.22	5262.85	20572.6	7460.71	134.125	6547.86	6476.49	9514.09	8849.6	2312.29	1105.37	30682	9553.81	5405.13	10377.3	8252.94	8305.86	6213.62	5114.16	5955.7	1669.39	1096.11	4253.61	640.792	2402.97	4347.7	1342.46	1983.77	1735.67	4.8794	10420.1	3156	2584.39	10.1714	3819.22	17555.1	17365.9	4659.94	7818.34	4456.84	2883.88	0	11825.4	14246	3674.98	5871.71	4954.12	9302.5	903.399	16222.3	14133	5734.54	131.56	11438.8	5332.58	4821.15	3422.46	5391.6	49.0253	2452.84	2376.68	3035.31	745.42	966.058	9427.3	8532.74	4767.6	4787.91	3204.3	5099.52	2612.93	13.0817	1397.34	5819.84	756.661	4082	260.822	1719.81	1157.83	91.6419	13.4189	737.404	5424.12	4184.98	26.274	3366.28	3328.34	7599.7	8003.23	4897.54	2094.21	1364.8	6239.75	6459.54	4133.07	1381.03	1337.55	1740	714.413	917.141	1098.6	1216.52	4618.84	964.31	6190.39	46.3944	4053.96	405.481	464.929	714.984	560.955	2415.24	307.109	1085.86	1410.44	5604.69	1184.77	3917.33	1912.8	1637.7	1570.34	90.9777	1443.58	684.108	258.257	2310.04	1100.94	2577.6	4217.15	10743.4	3105.25	5424.76	7399.69	6053.32	4292.7	7150.95	19517.8	6606.15	5771.61	3993.71	10559	2333.42	5809.61	7728.07	5548.68	4237.5	3581.74	5880.82	6062.1	5209.41	1361.84	3987.52	2487.85	5082.93	6988.72	2667.07	2649.54	2886.72	1266.2	2218.16	6860.94	3601.16	4036.14	5974.55	2894.18	1275.17	48.5266	4116.81	1464.09	259.692	2358.16	3067.71	2318.95	4820.96	6707.95	7259.21	2473.43	5681.84	7943.04	4042.87	3834.26	6584.44	12899.3	1359.26	9906.42	3833.49	7096.02	1455.96	2004.86	6119.16	3614.76	2593.08	2188.22
N-acetylglutamate	965.789	846.722	326.911	435.35	619.097	578.953	331.174	854.201	1371.44	186.312	390.188	1382.58	605.833	342.341	1374.02	2875.63	2581.27	668.863	244.115	784.441	881.207	2281.77	3000.14	793.132	3546.15	1479.47	1469.05	3276.51	2969.23	876.867	2621.58	294.338	2917.95	1332.96	3432.69	2856.79	1342.24	732.439	3629.75	2478.08	1225.13	3946.23	1008.2	1192.62	905.141	543.133	3981.99	371.319	1110.94	780.003	112.025	2098.42	1869.66	303.959	951.824	1844.42	388.913	312.684	1218.07	1415.4	1307.37	975	479.277	772.281	850.544	1582.54	2672.04	1251.28	891.918	1028.74	537.75	917.144	522.763	1490.24	742.539	513.794	453.513	273.376	1179.96	265.047	4759.53	1144.87	3578.58	478.092	587.886	466.982	910.823	419.964	780.638	419.344	852.52	3483.24	1635.35	601.169	523.471	354.799	1534.58	901.362	2186.67	930.303	1771.88	179.809	486.361	185.169	2390.27	710.325	119.737	2554.38	12.9652	373.467	1638.6	356.256	1613.09	3464.11	2258.82	856.631	3203.71	371.653	956.517	2907.98	800.91	2439.18	1800.82	401.226	1287.36	1067.04	306.176	81.2314	67.658	1780.73	2382.51	2592.24	542.506	141.062	163.443	221.716	378.329	638.956	245.351	283.148	917.34	3096.92	309.053	860.897	883.031	3786.66	507.362	2043.8	283.355	370.431	558.88	151.142	1558.14	1815.52	3833.13	3267.77	1358.98	526.442	2894.31	2511.59	1731.29	2765.09	3784.02	2674.54	3383.5	2200.5	1907.38	3621.04	1819.17	1953.44	1576.67	2088.79	2958.86	1698.66	955.684	2906.33	2264.68	746.91	649.1	274.407	1408.53	2367.97	1407.72	2374.69	748.403	443.209	1216.75	1620.44	688.724	471.957	541.186	2035.18	729.669	1203.98	752.729	532.894	403.162	1818.57	1583.67	1947.24	2391.13	1133.26	3396.68	581.608	716.181	811.487	1631.9	1120.08	1881.22	649.441	649.072	1871.43	502.728	264.372	2052.6	1706.16	2161.8	418.256	1063.46	3897.88
nicotinate	1674.25	384.634	304.723	309.057	1050.75	140.15	17.7549	1462.44	1230.26	1027.49	1096.19	974.836	301.79	595.992	3891.11	968.908	1019.58	1204.4	368.578	599.478	889.901	434.535	1557.57	1128.64	812.187	2809	1271.51	1110.92	1933.67	1163.71	1116.11	360.947	549.018	1983.36	2116.84	1690.28	1285.47	2019.85	1660	3378.47	1290.12	1699.05	573.364	2566.52	399.713	1021.41	2487.12	334.332	247.474	464.239	370.571	1734.97	942.698	582.071	107.64	1485.98	30.4827	1476.62	298.043	1213.79	78.8029	1092.23	941.712	1743.9	1114.35	816.007	612.517	584.569	167.908	887.618	1418.9	1465.29	821.758	1562.88	1906.16	358.611	1270.06	238.544	920.897	260.814	1305.67	674.486	1234.21	63.132	280.559	86.9249	243.616	363.103	1164.38	90.5374	634.126	1518.5	898.523	878.668	689.409	282.123	1415.93	334.613	236.467	196.191	1268.03	574.025	808.948	484.803	656.119	320.245	189.019	127.549	57.8595	815.072	716.661	60.6247	567.386	1090.4	1401.35	1200.95	658.802	528.707	569.067	2643.29	1114.81	1865.58	1210.16	241.454	1577.29	616.168	204.468	205.864	85.037	386.591	93.7476	557.392	475.35	422.842	93.5422	301.508	252.021	77.2209	701.299	218.745	1357.66	1107.7	833.356	139.233	1403.1	283.999	349.702	592.917	506.468	358.251	62.75	481.386	838.872	754.97	1371.07	700.244	1221	426.956	964.832	2500.23	1218.52	570.617	734.892	1427.27	1014.42	1500.58	2043.28	2205.59	1588.12	1360.18	566.676	1460.92	620.201	1115.21	2084.71	1883.89	1892.99	1030.01	609.991	621.571	916.587	233.954	1386.57	477.231	329.697	275.381	311.496	527.62	350.381	115.169	365.057	846.376	245.986	33.2037	385.715	122.887	674.618	1503	473.723	547.857	786.881	2010.17	1878.73	226.341	562.981	898.338	1116.13	1140.69	1545.8	419.527	236.531	1847.4	156.843	594.654	97.0989	947.968	1330.51	844.383	773.086	911.846
orotate	4720.99	33.5933	2671.97	76.122	4470.46	1913.13	54.9082	912.006	2594.58	401.372	3403.35	1364.31	46.0653	237.904	3413.89	5421.05	6499.11	1400.09	580.763	1050.24	4329.83	4353.85	2516.44	622.118	2337.5	2231.64	4201.36	4520.56	1492.53	2367.25	5496.64	1129.34	3457.01	4138.55	5429.45	5828.33	4042.55	1736.63	7098.19	8132.23	855.141	6158.85	1355.81	5280.75	352.319	1190.09	4150.93	389.051	1654.11	2926.5	273.405	449.296	731.356	988.083	8447.66	287.047	1267.89	3212.25	167.681	212.143	2483.32	762.255	2517.14	3238.78	826.694	4585.41	6790.7	3422.09	4210.25	5174.05	1988.49	1999.15	4465.73	1963.96	5896.98	567.784	2493.41	3907.92	2631.93	67.3422	8204.57	541.992	2654.19	774.054	291.254	5728.86	100.546	431.924	859.665	5090.9	364.618	7258.9	1011.61	2532.45	3025.2	182.595	432.039	3591.21	158.304	51.5503	2650.02	181.052	147.143	54.2464	265.687	110.065	42.5957	5077.15	2.72484	43.4864	199.135	980.757	106.43	126.291	193.28	112.963	250.749	73.1516	78.9567	52.5908	37.0813	322.878	298.344	77.9728	210.815	347.306	32.1361	91.7741	3227.16	373.438	1054.31	4433.44	145.61	394.909	869.122	39.4699	116.781	1228.51	117.086	317.192	2297.07	614.052	131.493	180.217	695.543	493.334	154.227	148.737	10.772	47.1743	32.1053	63.045	171.335	423.587	120.863	2890.04	2613.34	930.272	4556.68	5816.67	3217.98	4044.04	3847.23	5696.62	4654.52	402.448	3109.57	7277.5	3614.41	885.276	1101.79	1164.37	3512.65	1020.07	3237.76	5183.11	5003.48	3358.51	473.752	118.659	5031.37	658.518	1160.93	1397.05	910.573	47.9685	603.375	136.002	888.785	919.273	154.08	2238.85	461.481	199.013	1205.18	416.09	139.565	575.022	2620.92	232.636	835.22	1446.19	2760.39	285.843	1416.72	854.045	268.904	3958.5	5190.01	4534.06	868.974	1036.35	206.448	2322.26	6020.29	1504.88	1793.62	1324.65	3616.8	2068.91
oxalate	812.05	22.8656	270.038	27.9785	2769.11	600.942	43.715	11.6181	514.681	1324	397.081	151.609	16.6817	48.7262	350.855	120.798	109.997	214.557	282.765	594.557	375.273	1261.92	442.424	804.536	82.2851	1396.33	212.446	84.9523	272.751	77.4511	138.723	3546.36	60.9813	481.013	475.086	203.742	913.118	544.912	75.6809	140.594	152.904	1351.46	1425.42	1685.32	1611.91	108.581	718.844	418.287	1376.6	3378.8	231.111	25.3117	367.8	697.997	631.214	32.2509	884.943	992.93	32.7391	21.5134	299.809	176.176	100.163	79.48	9.36749	76.9727	94.8611	144.439	2548.31	72.3712	997.704	779.296	1169.48	378.218	442.505	633.112	792.801	402.971	193.393	680.052	108.815	104.488	166.236	88.966	1521.36	1207.36	139.412	2823.43	155.093	835.367	180.585	230.718	465.153	509.854	139.889	670.613	619.797	69.1797	96.9305	314.551	243.132	889.606	48.3998	139.211	0	60.6254	71.441	51.9132	92.811	45.9716	66.6859	26.6943	19.1422	0	11.9722	22.9519	0	33.5867	0	0	275.678	38.5542	96.3187	38.2651	186.77	0	22.6664	317.85	41.5958	1316.2	102.729	472.553	4057.04	8.50805	266.506	15.7757	61.4891	539.561	93.8114	2784.74	541.242	26.6723	185.196	13.4472	1792.22	20.2921	1727.05	0	139.81	31.8956	118.732	199.002	2619.51	1963.73	2027.76	195.691	199.103	602.351	66.9164	81.9206	124.279	56.2775	47.4389	319.479	47.0709	74.5158	501.894	194.334	691.708	105.77	64.8761	187.8	72.3499	47.2218	426.683	136.442	70.3082	735.318	85.8544	1088.66	1593.45	28.6143	293.002	129.337	61.5832	1177.69	36.4715	248.07	157.217	40.5439	124.833	96.3903	68.0181	102.8	189.885	146.623	272.421	156.082	48.5276	53.5932	107.206	77.3023	942.488	97.9273	48.305	235.103	283.44	548.036	612.1	102.799	111.044	111.797	35.3718	1072.34	650.828	211.251	172.89	1362.13	765.571	102.432
pantothete	5165.85	4778.97	1410.28	1788.74	4537.87	2979.21	464.117	4616.2	5208.33	14685.1	2812.88	5511.2	3402.3	4724.98	43279.3	3682.14	3503.51	21484.1	835.637	4157.09	4919.07	2449.15	11837.1	9948.58	11645.9	11929.4	5340.19	6195.17	11151.2	1604.75	4094.69	7404.38	3175.01	9897.87	6736.3	8221.82	5633.35	11116	7028	9014.48	5415.24	8348.57	3899.22	7770.57	2505.43	4467.38	18286.7	3025.93	4459.3	2058.61	3583.44	13648.7	6603.19	4215.58	3660.76	6437.09	8527.3	6076.33	1022.77	3852.45	1673.62	5532.92	1499.22	7467.02	7022.27	3288.3	1347.62	1488.1	3400.52	4570.1	4741.43	10635.7	3150.83	13786.5	3186.39	1677.67	4075.46	595.59	3728.44	2769.73	4905.74	2363.21	9132.47	456.658	7517.43	791.155	1930.76	9007.67	2099.7	1756.46	2234.94	5141.65	7159.54	1459.68	3212.86	6775.9	5476.48	1815.79	2416.01	501.25	3341.73	2572.83	6902.67	4054.69	4287.59	4201.7	993.333	1791.65	2288.68	5553.14	6212.03	943.562	8885.47	8780.16	12425	9183.76	3102.93	4173.65	3762.53	7217.7	4332.31	9859.52	12058.4	4539.04	7203.14	7266.6	3988.26	1433.4	1912.29	6535.49	6281.39	12062.4	2534.29	2331.54	4257.96	3881.22	4105.66	1103.66	4468.62	6555.3	5407.88	13718.7	4912.98	1159.35	18348.3	1434.72	1888.45	9006.76	344.491	4229.07	2169.54	1204.98	2502.2	6080.92	7507.73	5706.73	4491.88	1495.46	2652.41	11390.1	6541.68	3676.28	2309.83	7553.82	7195.85	7669.46	6952.76	5849.58	10298.2	15056.8	1349.05	9841.28	4470.38	9742.88	7942.43	6483.68	8523.89	8088.31	1681.32	3833.31	4509.51	973.721	11896.7	4332.19	2011.29	4810.56	947.744	5586.31	1832.13	883.294	4134.68	7466.1	1093.11	1394.36	1336.75	242.209	1771.78	4089.01	1538.92	4222.41	9701.4	3783.29	8967.97	1332.04	1889.25	3788.14	6232.33	4388.67	6102.13	1941.66	743.667	4025.02	823.575	1176.86	317.997	3006.31	7880.2	8186.58	3578.48	2596.3
pentadecanoate	18344.7	3070.72	25506	12292.7	3954.14	2710.35	329.261	45786	6158.24	6868.25	1727.32	9397.67	9179.33	20939.2	7067.65	9363.74	36249.3	6554.26	688.092	5602.18	18998	1001.36	12405.8	8312.47	11835.7	7001.24	19115.1	47657.4	5954.35	20764.5	38389.6	202.376	17292.7	7770.12	19571.1	24316.9	1627.03	10494.4	68806.8	6238.02	10758.3	9806.35	1443.66	306.517	25598.1	5066.79	22258.1	852.537	4089.54	7703.81	1889.91	30583.8	388.628	2632.48	3574.24	25421	183.726	4268.47	18759.6	14008.9	1196.54	24783.3	18506.4	6627.61	7920.32	9398.89	11690	10876.4	1465.32	69482.6	5269.42	418.756	15004.7	8545.94	6438.25	417.848	11562.5	11649.7	3808.51	787.511	30706.7	4562.29	23531.1	5858.47	4724.89	7611.98	4157.91	347.84	7609.38	2292.98	7309.53	15167.7	5877.96	8567.45	5456.73	1551.45	12088.2	18411.3	431.405	7302.76	538.5	5820.1	5332.73	10263.8	34181.9	20183.5	972.743	1804.13	7399.63	15293.1	28360.6	5994.91	7798.3	44152.8	5913.97	2871.45	20926.4	26375.8	27522.9	16798	27224.8	37186	4785.99	15372.1	12531.6	20097.3	10623.1	261.569	2393.93	2411.04	2130.46	421.332	1427.09	22440.4	13386.1	3051.12	19942.2	548.02	18614.4	878.322	3783.33	33493.8	29282.1	11906.1	4486.49	29956.9	1376.5	27839.5	1672.3	17217.9	4953.06	2036.69	14900.5	8211.46	6056.96	7460.55	11257.7	12228.1	15696.6	12031.1	8052.05	20587.6	39456.7	6931.01	13630.3	4236.71	9394.15	12045.8	5019.52	7005.06	9373.08	15875.6	9898.23	3780.06	15240.4	3271.6	4590.45	2309.76	8433.97	358.586	12621.2	9376.67	8704.86	9816.17	2573.55	4499.66	11239.2	6570.03	4587.32	9281.26	1854.3	5448.4	3395.27	451.335	20431.5	1301.55	10837.4	7915.1	10699.5	8521.72	4743.59	11265	4880.41	5287.77	697.654	8224.32	4593.39	6491.45	9046.43	10432.7	6732.84	11656.8	2903.91	3219.68	668.798	8250.76	3556.32	1676.33	1441.73	2135.49
phenylacetate	743.538	348.924	649.08	246.533	559.341	20.7311	0	400.381	150.371	250.265	195.879	90.0502	79.7228	228.392	67.6498	948.713	664.415	169.874	44.3807	131.313	363.726	570.089	342.011	168.343	340.842	85.7157	649.869	448.466	298.894	710.208	442.397	7.52963	429.373	406.652	544.208	585.081	215.381	4.39604	1503.21	509.753	341.497	510.551	1066.46	916.248	223.682	330.919	159.709	108.304	28.9592	456.845	29.5878	206.101	248.716	24.5863	27.8042	182.043	0	539.284	324.69	197.745	0	287.608	814.458	1319.06	280.918	422.28	322.836	171.732	7.70369	577.269	784.572	305.785	372.693	162.841	954.902	0	522.914	569.131	323.503	4.65777	722.077	349.628	231.63	240.615	78.5833	4.83953	158.183	304.838	289.591	34.4693	57.0602	429.229	533.781	315.742	233.574	89.5801	308.541	116.797	7.80248	177.295	574.992	16.6959	400.603	11.9397	220.727	184.415	29.895	0	102.271	378.466	322.768	0	335.119	394.414	662.175	488.419	469.764	212.597	176.767	218.576	394.572	252.105	247.876	220.09	163.528	41.9626	113.23	15.1038	352.777	503.481	132.127	484.549	17.1352	304.784	130.206	40.323	93.0398	23.6858	463.399	3.5352	36.1516	173.23	849.887	176.677	612.213	274.237	155.702	161.211	0	89.973	73.579	38.1834	132.203	62.9854	198.1	228.986	594.983	148.153	322.212	396.276	376.297	301.085	448.709	946.551	266.309	342.334	105.099	482.286	76.0987	212.218	427.553	300.811	243.923	250.847	94.7066	302.628	174.826	109.091	183.959	139.974	251.624	449.968	162.616	138.824	146.378	102.403	139.253	439.725	208.601	172.407	324.786	160.756	70.2818	6.83464	339.447	67.5299	7.40344	191.481	156.388	220.743	303.696	417.373	331.925	130.375	112.978	370.363	228.946	139.003	314.217	739.92	72.4941	58.1282	198.41	589.497	58.4575	90.4468	305.007	186.46	124.629	178.873
phenylalanine	25213	2123.06	26444.5	1566.16	11626.1	45655.9	686.972	6567.03	18585.7	45877.6	28832.3	17763.8	1128.33	3063.13	16094.9	14316.1	15961.2	20548.4	29433.3	22934.4	27486.2	12796	22073.9	17129.4	29263.8	12941.3	21253.2	29569	11613.2	17595.2	24174.9	47190.5	14297.2	21310	14568.3	23805.4	11481.8	14448.8	16902.7	19116.3	21843.4	15154.2	31179.8	22127.6	8355.04	15800.4	16033.8	7811.79	39715	10370.8	51532.6	4912.2	46767.7	31529	10888.5	6366.54	24140.6	33430.6	1781.92	6581.16	41593.2	37151.6	42570.6	33781.1	15816	31530.4	17956.3	10853.3	58365.9	27203	15255.6	14468.4	18358	27835.5	25960.8	43946.7	18158.2	41294.1	17845.4	45930.3	20410.7	34886.1	21258.3	16908.5	31154.1	19848	21154.5	13451.9	19717.2	30386.8	23487.3	16981.5	20019.8	20904.9	14213.2	68862.5	30038.7	9902.82	14940.2	16794.5	10690.2	7260.72	1613.39	1663.98	4280.07	1791.36	1438.73	6482.52	1963.21	6126.48	428.272	15680.6	1677.05	1544.39	9771.98	8675.4	4424.98	8844.1	5489.03	3507.31	194.356	2718.38	833.097	2591.47	2960.44	7515.23	7114.83	36908.1	5412.72	25290.4	3637.27	14282.2	31649.2	12329.2	4463.21	10195.4	2109.83	28997	7781.48	41211.3	29599.5	10948.1	8118.64	3534.92	20456.2	4581.55	13313.8	5005.89	3269.99	2135.44	93.535	26545.5	9228	24624.7	19233.8	15828.2	34884.2	15955.6	28226.8	18685.1	26827.6	23076.3	23200.4	30714.1	29788.8	36508.5	17943.8	23933.9	12976.6	29870.7	16000.2	31555.6	13202.6	35895.8	28422.1	19666.9	17471.5	25649.6	10566.8	22314	13883.4	13048.4	47828.5	16611.2	22983.3	16661	13882.3	58195.3	15577.8	37150.6	18100.2	26416.2	13716.4	15243	13406.5	7729.58	32008.5	38616.1	25508.3	28417.2	42952.7	25618.5	33488.9	5883.79	53484.5	21707.9	48780.7	23624	13606.5	17308.3	13599.4	23394.6	20065.9	12450.2	39459.9	7913.87	31855.9	38877.7	20226.3	13074.3
proline	4887.87	137.489	4990.57	179.975	1720.89	796.063	15.8799	698.658	1799.42	1338.42	1057.5	3092.66	124.538	174.346	2672.15	2450.99	4267.22	2764.54	532.523	2841.6	4971.6	1464.41	2969.68	3077.22	4408.94	1193.6	2870.9	5007.27	1347.92	1761.82	4282.63	2382.47	2857.07	4248.38	3099.41	4252.23	1101.26	656.28	3847.15	2143.95	2953.82	2296.9	1466.81	1490.83	670.153	2212.27	3174.84	1227.05	9153.1	1671.69	2226.14	561.452	6721.84	1497.07	1227.17	636.794	3304.3	3067.2	251.796	420.478	9912.4	6632.63	5049.05	5640.07	1867.04	7652.24	4611.33	1884.94	15032.1	5455.19	2348.68	1450.62	2939.23	4623.35	4135.56	10819.1	4980.66	4262.85	3085.55	9474.25	4177.32	4622.48	4874.24	2302.45	6822.68	3204.31	191.813	2427.26	2345.35	5269.51	1813.64	4295.41	2788.28	3826.62	1640.89	11064.3	4832.03	1887.9	5435	135.111	1186.93	409.684	221.642	103.262	356.183	319.573	62.4339	1334.94	204.058	803.174	115.041	2972.08	252.722	299.163	860.92	74.9073	533.556	1375.63	502.135	628.086	55.7357	269.711	115.689	215.883	243.099	614.223	695.23	869.009	44.8114	3241.99	160.462	2100.49	2318.77	1648.52	1348.11	1158.56	418.748	5544.2	373.525	6510.61	12973.4	1501.44	100.94	278.435	2860.48	408.208	328.266	683.783	101.06	204.784	40.5376	278.646	247.579	369.907	446.808	3057.46	3039.49	1765.85	2704.12	4281.38	4560.48	4388.43	4221.82	3452.92	5671.16	3486.03	2972.62	3747.8	2264.46	3987.43	1959.37	6197.38	2886.33	5369.21	3303.29	3095.27	3230.59	2066.36	864.007	552.94	2988.72	2034.85	5095.44	2083.68	1825.09	1264.03	1440.04	3088.83	1170.78	3022.61	1877.93	3561.74	1123.14	4845.82	1509.33	591.603	852.605	5982.6	3285.62	3324.4	4555.18	3184.24	4036.62	751.124	1371.41	2710.47	5367.15	2866.17	1725.12	3544.59	1488.05	2592.76	2005.13	1095.43	7031.79	1142.76	2807.81	1891.95	1811.38	679.51
propionate	2007.78	236.264	1484.12	350.573	3417.04	360.706	82.2737	1521.32	1754.01	3602	1235.8	1049.1	199.069	714.75	2375.9	2879.63	2112.72	2163.24	558.424	1654.01	1159.57	1425.66	2720.55	2983.68	1973.84	3065.69	4449.13	1617.01	1516.82	2867.83	1661.24	816.437	713.789	3154.57	2030.36	1810.99	913.463	4193.85	3374.04	2630.32	1768.4	1446.12	1868.22	1423.82	1221.7	669.8	4542.18	638.579	965.505	1453.77	334.388	880.433	767.1	1460.19	378.365	398.949	32.4214	2520.96	308.565	158.981	0	831.913	1531.26	3814.66	1671.7	1410.5	547.856	569.293	9.94008	1649.77	2765.82	963.079	1111.81	2097.98	3270.91	15.6084	2962.4	2915.5	1359.03	90.5157	1348.85	890.913	1333.36	367.709	2018	218.688	751.183	237.957	1487.81	953.364	880.532	1399.57	2270.71	734.313	1295.12	1208.63	1270.25	533.5	0	610.291	1057.51	1994.41	240.845	264.656	189.585	223.355	229.294	168.906	597.636	770.977	531.575	55.8157	405.723	296.071	1273.82	983.44	320.405	542.594	76.0505	2454.89	813.359	574.832	525.886	330.7	747.983	305.266	101.792	180.772	168.547	947.477	223.066	458.216	204.813	171.339	108.927	222.4	219.28	16.7427	361.74	839.364	1990.4	185.77	1078.29	46.9364	4103.64	89.6565	825.934	319.969	148.023	964.801	66.8942	119.195	983.842	525.185	1334.6	713.104	1773.47	768.221	1285.08	1912.53	1020.06	688.436	717.727	3991.87	999.769	964.359	1675.31	871.861	731.895	3278.57	1129.72	1709.64	538.169	1338.42	2788.71	1160.7	1538.37	1788.62	1028.13	1302.3	1018.18	586.515	2414.25	947.37	755.631	549.422	480.954	1999.52	755.123	460.432	1037.99	935.135	284.351	134.283	1634.08	312.139	2594.32	1116.71	432.925	800.13	3779.62	1785.44	1306.25	429.517	812.379	1492.88	1637.79	1524.88	857.65	975.527	216.319	1631.83	296.65	2575.29	679.519	918.009	858.132	2534.44	634.179	1606.8
pseudouridine	131.853	0	192.618	0	465.838	0	11.3023	349.92	479.638	475.295	198.205	44.9378	5.02552	31.2703	498.641	1107.98	445.044	321.953	45.0094	200.385	603.349	378.947	356.561	635.234	1772.52	877.824	238.456	1661.83	664.204	648.179	862.483	242.05	541.826	480.011	1968.78	519.316	595.13	576.854	547.126	679.934	171.885	1055.55	54.3801	130.813	228.042	87.1886	1047.58	0	265.932	107.768	154.781	76.356	270.053	370.618	72.3558	21.3868	273.083	127.818	14.1006	32.5232	483.56	2077.58	266.543	465.311	63.0496	1062.25	742.824	3481.28	25.8724	465.207	345.105	0	192.303	2149.69	461.868	507.64	259.108	74.0076	110.858	460.991	743.974	229.021	1569.84	105.95	439.3	308.828	9.07527	132.667	240.939	2004.91	168.677	1221.78	343.44	350.63	308.927	260.453	254.405	341.146	630.195	15.1243	49.7964	380.886	7.37662	1.36398	11.6862	13.3236	3.5409	318.45	37.4381	13.2216	9.35146	2.72864	77.5653	32.5217	19.5204	17.4119	25.4842	5.02286	17.4752	143.227	12.9395	10.7158	5.59278	10.593	8.22818	45.4704	16.4928	32.1997	0	3.14835	7.34586	8.18964	0	49.8605	7.76782	6.6122	18.2602	210.093	13.1807	622.977	0	113.587	11.9514	6.33779	8.92661	38.3355	19.647	15.0133	179.149	20.8164	0	12.3038	10.2508	17.0806	11.0455	592.121	431.717	124.862	325.019	1092.39	773.61	945.188	712.303	1043.05	1109.5	111.213	1206.43	1027.1	334.105	1449.92	113.493	663.544	647.275	1162.63	1173.85	1681.09	1078.72	43.9779	124.621	3.5788	731.553	741.48	1079.44	440.471	110.914	16.9266	225.239	350.444	151.165	42.7122	94.4456	994.353	210.814	277.133	220.065	87.2091	779.451	1282.63	243.61	268.117	3.17108	691.907	347.903	34.7485	62.3186	201.673	124.629	1616.22	1234.83	581.849	829.934	732.288	171.604	191.928	105.437	283.954	64.9338	461.539	202.549	110.161
pyrocatechol	23.5702	42.4987	13.9084	23.0509	234.976	3.56562	0	12.4725	210.903	67.5122	86.2992	64.2385	79.9179	47.4746	37.875	234.586	32.6063	4.75074	38.4279	236.528	5.39033	2.07247	172.897	196.463	28.2489	679.034	24.0933	28.9496	116.457	18.21	137.535	3.52272	20.3337	77.3859	38.7931	61.6017	52.6008	119.791	99.4404	135.563	47.3099	209.426	466.058	22.6332	43.2389	21.233	113.768	7.84189	0	7.7004	155.253	165.936	19.2221	11.0305	4.05146	40.1066	0	24.8812	32.7642	24.4913	0	13.6633	132.576	25.5361	31.9872	36.9114	22.5428	45.0486	0	20.3732	158.047	1058.07	30.7624	87.3517	128.242	0	189.799	68.6694	69.3817	4.11497	153.649	12.08	21.1467	14.2529	0	9.40648	32.5385	69.2239	76.6831	11.0088	65.3624	38.1904	76.5905	109.087	42.91	7.17213	43.239	40.3442	12.1843	9.42985	42.6784	91.0897	33.2599	134.887	43.6792	49.3611	31.036	135.87	65.5866	55.469	315.505	2.22633	40.5715	65.8384	96.2161	162.025	22.4977	178.156	20.8146	55.2831	118.229	350.091	76.4116	36.1671	131.799	17.9023	12.9157	83.0895	95.48	50.4005	31.8475	299.558	119.233	11.2749	38.9962	109.873	10.0646	0	70.475	6.17234	146.6	22.0514	157.024	28.571	76.5858	6.39642	9.17121	29.5241	148.988	98.4685	12.0638	11.4652	16.9625	13.8199	9.60915	13.7465	41.4979	17.1095	33.8365	98.3507	43.9377	11.5936	21.1622	71.2185	39.474	31.0265	68.9775	140.415	50.5973	118.089	10.662	341.568	103.662	32.462	20.8376	34.4058	35.6063	109.273	69.0574	40.7468	148.602	60.7323	98.8654	16.2321	14.6692	6.18253	10.6365	14.222	17.7344	22.5351	18.1743	4.40617	35.5575	0	45.1714	5.62709	45.8973	22.1456	16.2575	102.195	91.5193	29.1499	64.3548	18.0187	76.9108	6.92692	18.8387	19.8466	8.89574	109.528	17.6632	64.2837	24.7939	10.1316	4.66278	75.48	42.4564	25.3214	36.8165	167.805
quinic acid	10412.9	40.4478	11473.9	452.397	243.026	722.796	50.2249	5479.4	10613.6	566.3	623.96	465.343	92.8828	1424.22	609.344	655.812	103.357	1719.94	1492.9	203.175	181.168	163.78	1232.92	189.58	137.066	141.567	207.411	37.5472	760.427	50.8419	387.237	562.154	582.523	933.011	138.46	288.367	1183.84	391.772	115.113	608.223	9168.95	953.923	11241	1091.1	2264.45	142.291	60.9384	2322.95	1917.9	5353.43	461.583	1471.65	301.344	237.948	586.218	940.009	1267.4	529.921	1337.74	135.426	38269.9	12596.2	6121.86	345.7	132.911	326.103	316.319	758.409	3578.72	247.494	13867	3447.12	287.657	495.682	4556.87	11.0531	8416.61	184.242	315.382	1275.62	315.623	6675.84	514.774	1243.14	2441.64	29093.7	13868.5	3106.16	5123.4	28739.1	634.338	378.609	291.616	100.349	8727.07	350.951	9095.99	298.899	97626.2	9844.46	781.489	5870.85	579.575	311.543	135.376	91.9698	73.3118	8401.54	1972.05	650.63	1012.85	610.065	479.038	691.34	46.1429	694.196	329.155	30.4848	1055.2	394.079	22.401	8289.9	429.122	5121.61	712.101	561.738	1216.65	400.916	1439.46	1562.36	3086.03	41200.4	55.6556	296.585	356.094	35.9743	54.0921	15913.9	3513.36	7044.81	1266.05	282.046	163.437	13.189	1058.9	146.131	1628.75	20.9598	1995.98	1408.79	56.4682	138.673	1586.96	19034.8	150.595	785.971	139.216	5603.68	816.998	898.945	285.622	647.53	456.756	177.233	7768.43	1488.54	1117.43	1016.28	1044.83	5187.05	693.319	3819.22	889.556	2777.37	1606.89	1338.67	841.633	280.745	44786.9	718.486	2516.94	925.107	7050.83	4859.6	3448.08	8999.93	655.898	75.8354	201.439	50.7164	546.097	1303.03	542.057	19410.9	33.9208	108.283	2084.99	1643	22163.7	2510.23	408.029	1253.84	920.877	584.209	5928.94	190.27	2636.58	384.499	1156.74	70.7846	1078.7	1103.14	124.164	2715.05	5074.26	399.024	1195.97	1912.92	6896.31	18738.6
ribitol	17.7946	18.3749	52.3568	8.49972	8.94483	3.23761	137.765	35.9041	50.3719	10.8773	35.2095	15.8839	14.304	23.6773	31.7111	27.0856	36.4772	91.9871	10.2365	79.0376	12.6278	61.5417	68.351	21.2475	74.9866	61.986	11.2776	34.4497	88.7256	29.6742	27.0323	61.3007	36.4441	30.048	18.3343	29.082	25.1272	23.1071	51.1377	34.0478	22.0887	54.1194	19.5201	21.7578	19.3157	24.8427	79.0784	51.0601	118.653	19.3834	45.6858	40.1184	11.8379	31.6369	24.2352	26.2644	80.5825	126.973	15.6007	12.8146	73.5318	127.764	34.4321	50.0375	15.8333	27.5593	21.4476	51.7447	556.538	27.2181	7.83048	30.4414	9.10783	29.8158	16.6926	92.505	8.70539	3.11743	5.97892	90.7679	59.1218	18.0298	83.2327	5.28677	7.18565	237.81	13.2093	14.8627	7.34006	258.714	28.9398	37.1135	28.6621	24.5193	13.1671	10.2925	13.3811	19.9044	262.038	6.2128	21.4263	2.72359	10.8289	21.428	21.7654	15.8879	22.0457	134.279	20.8076	15.4138	22.7988	14.7804	14.3807	41.1112	14.8524	14.9915	12.4686	8.6345	16.1868	23.4806	5.31245	31.7739	17.1335	8.11989	13.6183	44.008	11.6698	32.2273	173.855	1410.4	270.912	68.0547	250.106	11.5622	167.069	12.1747	6.0926	34.4092	8.39788	74.0779	190.6	33.388	10.4923	8.20106	46.9635	13.5183	6.33276	33.4084	11.5663	14.1537	12.2518	12.723	19.6193	77.9728	32.038	50.4645	106.992	36.2455	78.7014	216.852	61.0352	86.6316	27.5449	71.2284	97.4463	30.6814	40.7649	151.269	46.802	66.7966	39.1962	85.5416	90.3717	23.8905	34.3431	35.5296	45.0735	19.2177	16.462	27.4427	30.8496	35.2188	18.9434	45.3218	12.4803	9.56909	19.0502	10.0618	16.299	19.7988	10.1884	33.3515	21.9263	209.131	17.2442	0	165.773	22.8261	49.22	11.3927	48.7061	30.1708	86.2566	20.0215	12.3839	23.8608	31.2881	33.4553	29.674	101.492	8.03717	20.1256	11.2504	3.85326	154.961	23.2095	22.3396	11.8967	42.1433	5.30399
riboflavin	7.48121	15.0843	6.60221	6.42076	6.94303	0	0	7.23457	8.06273	4.85848	24.6561	10.5771	6.75534	4.39778	7.19908	10.2903	14.4155	26.0164	11.1027	6.76655	13.6245	6.1012	7.38917	27.4035	10.3675	12.1563	4.42364	6.55862	6.62517	9.17339	15.5078	13.8642	6.93186	28.4641	18.4902	7.68208	8.52163	5.94662	20.0472	14.0291	3.93163	12.267	7.54388	4.65998	13.8976	6.41301	11.6475	13.747	5.42899	7.57391	16.3317	8.12313	4.3633	6.96644	0	16.2082	0	14.0538	0	4.87955	0	15.1495	11.9904	8.27865	3.08472	8.35836	7.24498	5.67102	0	12.2051	5.02618	8.42776	10.2003	7.78473	9.43284	3.79544	10.9369	5.86517	4.96835	2.71027	17.4094	6.59588	7.87666	0	8.98262	0	32.9449	6.77166	4.90527	0	8.96103	33.6394	12.6655	9.38602	5.63304	5.18991	9.46679	10.3994	0	5.41178	30.4753	4.74983	21.5821	4.46961	5.42067	12.0962	0	0	2.93007	7.18894	8.19119	0	6.00289	12.4325	5.67797	11.1731	5.3217	13.3816	22.0902	11.662	11.2953	13.1475	8.87528	10.6393	7.36924	8.47439	5.09536	0	5.95794	6.17232	17.2876	7.86698	7.01147	14.1824	12.6839	5.60067	8.36434	0	21.4021	0	6.30027	17.9015	8.30187	3.15827	10.3336	8.17795	3.50775	18.5256	0	9.89938	3.64522	7.76549	8.24306	12.1367	17.5731	8.54916	38.5208	5.36265	13.2015	23.5141	14.1442	4.91076	9.50836	30.5234	7.30189	11.874	9.15273	24.7877	16.4289	17.2872	11.8856	15.4275	8.66601	18.4995	15.452	14.5883	19.4578	24.666	6.29779	4.86738	13.8147	3.56773	11.2738	13.7845	10.2995	8.9178	5.13107	8.34341	9.64185	0	4.22486	5.5952	4.3206	0	6.10977	3.01972	2.48272	66.4488	8.12846	12.3039	22.8988	12.5407	22.3781	5.28175	5.96014	7.21172	12.4095	12.9936	12.5268	12.646	8.75928	10.4055	5.69894	8.59184	25.3853	11.4842	16.3793	49.4992	14.5786	9.38818
saccharin	838.432	6125.06	197.122	126.677	0	0	45.4201	1128.27	305.604	28.6614	36.3755	10463.8	61.951	0	389.631	1018.52	70.9544	41.0539	16.8721	101.944	3052.1	60.0275	17603.9	511.133	68.5253	857.411	76.4151	85.2726	0	14460.6	34.2367	65.814	0	50.3011	22.9497	16.7183	416.571	56.4064	36.6488	32.3386	1131.71	349.331	112.232	174.415	9298.36	322.054	132.246	126.039	370.744	488.477	0	26.3088	517.238	150.754	0	61.0939	1777.12	397.952	0	0	0	0	716.451	0	104.694	16248.7	0	139.937	0	5950.88	32.3323	15.2974	47.8796	208.956	0	0	0	2123.91	58.2133	203.413	0	123.722	0	22.38	34.4465	0	267.984	66.0542	66.18	48.5171	46.6282	18.6764	83.8532	69.1789	30.357	49.5634	738.964	37.3225	0	156.39	9.61363	0	45.8147	98.5712	32.6924	75.1559	4.29732	0	0	34.3041	27.6955	0	0	36.5353	211.03	12535.7	0	0	75.9342	2441.22	64.5721	0	1161.49	374.729	86.0013	151.532	146.092	0	23.4496	0	0	171.104	60.774	9159.23	27.3781	0	57.0509	299.539	97.5264	0	1.87276	88.5096	8.98794	68.4173	114.578	27.254	245.421	127.648	0	80.8038	246.391	0	0	14.3177	61.9265	0	0	73.0591	13.4255	2833.51	103.763	516.736	26.1788	391.372	92.2469	378.729	565.608	0	5305.67	253.016	40.2646	44.6392	0	34.532	2155.94	26.6466	52.2864	1801.1	17.0255	0	0	0	21.3702	32.5791	2026.59	5808.25	47.345	9.70359	2550.61	11.1429	12412.2	1632.32	2743.76	4701.11	1173.83	54.8412	41.7511	455.457	0	52.1082	6049.72	255.637	32.3776	283.219	52.2297	251.023	204.19	657.337	12.2873	70.0968	1033.66	8.68263	124.711	0	11.5457	13.9017	13.7675	1343.37	184.485	2444.94
salicylate	19.5119	307.444	23.4939	28.2053	321.344	250.63	284.822	157.649	54.9032	122.768	249.931	150.515	161.474	91.311	176.147	38.3333	18.0912	116.667	115.305	529.079	0	110.171	164.173	4741.76	73.7698	113.925	45.1212	23.0627	196.357	22.7688	37.3788	95.5363	31.3019	304.525	65.2144	58.4628	200.644	210.756	17.5519	106.3	127.498	23.0208	95.3766	88.5758	21.1468	389.623	235.619	40.5384	59.8322	216.883	357.05	132.806	144.813	1849.07	91.1021	4.54078	34.8389	468.08	10.2775	317.099	46.0196	81.9906	29.7863	53.9555	257.263	21.261	139.328	39.0931	31.0478	56.0828	139.148	564.103	15.2775	41.0028	58.18	22.4902	425.63	674.259	216.46	637.44	48.164	25.7554	72.3712	3.27098	59.2298	49.3117	303.639	824.086	871.822	75.632	639.123	0	375.734	17.4013	88.786	284.7	61.3813	181.589	72.7195	394.768	268.753	236.288	93.3233	736.069	27.1289	37.3487	129.902	165.05	73.6645	58.0757	67.8788	139.85	32.463	52.3311	42.7029	68.1534	44.6752	41.1931	50.5093	59.8614	116.954	113.338	398.085	26.714	97.0178	845.46	69.5518	457.632	986.172	524.643	933.915	296.782	255.768	32.1595	208.004	1237.14	99.1998	266.34	57.2072	216.118	485.159	679.612	162.251	70.9388	430.942	58.4691	625.557	352.039	143.423	2825.43	43.1078	498.851	1125.83	83.3437	29.6016	53.1298	402.579	63.7253	0	14.6352	483.429	11.1113	19.3742	47.9639	13.6103	36.3925	82.0065	21.8151	41.9542	223.721	0	13.4201	114.089	146.019	284.937	53.2044	0	89.1699	93.6887	92.2771	24.1019	146.263	41.8142	116.67	30.7476	17.6124	39.4221	76.3335	30.6781	178.847	71.6116	112.066	117.196	94.5501	42.1685	48.9101	49.8642	40.5623	92.8928	20.6191	79.4903	4.29201	55.2485	17.577	44.3234	40.5151	44.4304	261.605	0	0	38.8132	28.3119	22.6968	9.01633	17.9747	36.8087	109.601	224.529	22.6765	20.969
sebacate	85.6156	64.9505	320.96	15.1069	38.4974	6.46664	8.36293	22.7269	98.6156	18.3031	15.0415	36.4261	52.1373	66.7343	50.5554	650.035	206.995	20.5304	10.7071	14.3533	92.3614	12.6809	304.85	111.194	273.429	198.336	424.069	618.753	299.162	212.998	642.386	7.51726	988.53	127.781	484.945	312.92	38.629	124.423	711.557	362.222	88.3048	218.109	105.055	41.369	15.2405	475.719	361.916	16.795	9.80768	20.2581	10.2237	283.793	25.8814	10.7638	8.23523	104.76	4.32301	15.0278	36.0732	167.544	3.78027	49.2537	37.7254	64.8145	43.657	539.585	430.623	136.999	90.9107	74.0884	50.4724	74.7555	55.5656	58.9158	87.6885	6.77017	34.7751	34.6137	59.8959	3.80317	531.78	35.889	214.518	182.974	10.8171	0	10.2909	14.2782	26.4279	10.1552	28.4809	195.261	250.483	27.4338	33.7723	4.00897	165.958	146.523	9.76344	50.2808	125.994	7.76877	160.92	65.8475	319.25	69.8527	10.5052	6.95584	8.70051	33.7837	274.655	3.6594	112.124	356.042	108.604	61.5705	167.72	53.5318	73.4869	885.149	203.694	326.281	100.384	70.6622	171.867	122.849	25.5342	5.94719	8.14015	19.551	7.07396	18.2495	0	7.32015	0	520.027	49.9031	17.5154	24.403	33.1299	14.816	319.062	24.7337	453.335	18.3245	133.614	8.15555	837.422	18.6199	27.1103	35.7865	10.847	15.7722	69.452	65.3161	343.483	95.2404	93.1004	150.888	237.907	212.138	491.224	549.989	369.007	213.764	78.1085	196.2	172.162	137.828	79.6237	338.427	219.543	429.499	100.548	94.1522	291.872	115	21.1234	99.1733	24.0236	17.7908	622.682	17.5503	92.7606	97.0584	16.8804	154.147	15.4123	52.6397	56.7672	11.6778	75.6092	107.928	10.0234	222.981	50.2964	18.7243	38.2369	13.571	10.7443	44.4808	90.6683	92.0551	52.8094	22.2585	43.6983	99.1429	139.806	45.1282	258.678	63.6721	23.2498	203.659	39.0732	9.47391	132.736	207.312	47.1939	109.248	56.4701
serine	2143.75	67.8587	1475.64	61.5749	1108.46	573.069	0	255.538	1473.54	1215.18	1366.43	1465.69	44.7584	60.8604	1175.81	1260.25	1107.95	1919.56	812.367	1542.35	2150.4	945.359	2439.06	1761.6	1598.15	1054.36	2050.41	2485.28	836.651	966.932	1574.48	2781.58	1332.82	1321.04	1370.6	2520.66	874.66	1293.57	1488.71	1422.32	1558.24	1319.14	1480.61	2023.45	707.595	1011.16	952.68	547.608	1058.63	576.611	2263.23	185.236	3814.79	1027.52	1919.77	182.545	1020.3	2407.81	69.2834	211.482	5328.99	2253.14	1517.68	2782.86	1027.01	2164.3	1810.8	1127.76	4624.55	2419.89	1583.7	870.78	1886.9	2497.81	2674.31	3846.83	1602.62	2082.5	1592.77	1879.18	1891.38	2287.79	1133.71	851.356	2108.76	913.724	380.458	1128.71	1170.82	2238.33	1639.35	1429.14	1910.17	1213.62	1236.42	4883.54	1711.37	895.333	530.552	651.084	1012.12	460.304	77.9773	33.8564	171.773	69.6777	45.108	56.8659	23.0089	146.276	20.4267	87.0128	73.4327	95.2416	383.884	34.3453	127.553	478.215	260.425	243.883	13.5732	122.38	30.565	77.1336	50.289	385.467	308.576	502.721	36.1448	1485.56	32.9975	961.53	936.003	426.226	18.9822	352.649	124.833	1985.12	101.193	3137.46	1075.81	490.361	29.5994	133.068	2014.72	180.1	648.986	246.508	16.5853	49.6196	0	624.301	793.493	1270.42	523.668	1522.8	3260.4	1554.7	2571.35	1525.92	2472.31	1992.49	2185.5	3964.66	2656.07	2123.48	1355.65	2879.46	945.917	1962.57	1417.3	2313.99	1129.15	3267.6	2496.54	2141.1	1854.16	1991.47	995.632	489.267	1606.34	952.749	2898.05	1483.5	1867.34	993.299	1122.43	1715.69	1267.14	2889.26	1263.44	2360.16	1224.49	978.172	1228.49	847.288	796.702	3695.67	2258.98	2190.87	1164.02	2170.33	2816.48	574.339	1692.92	1608.92	3141.87	2700.28	1483.41	1679.66	1265.93	1779.8	1567.3	1563.3	1230.48	753.077	2428.88	2273.31	1930.07	1024.14
shikimate	70.2232	15.6617	24.6546	4.95989	0	79.6537	6.3943	0	189.713	13.9005	44.0239	2.8124	5.11058	79.5412	0	0	0	6.21758	4.86341	6.43565	0	9.62401	94.2114	27.6409	53.7661	0	0	43.6624	43.2974	0	272.568	19.0398	137.136	0	93.8115	0	21.815	0	2.66386	361.958	47.1903	56.4229	0	7.05223	16.2581	0	0	0	15.5835	22.8326	10.3912	37.4637	5.02088	11.4171	9.51561	32.3168	7.8265	0	182.947	0	39.2403	29.2773	7.8924	2.72262	0	4.34916	21.019	176.884	10.6902	161.412	123.301	32.2606	0	0	32.9165	0	9.55105	1.4269	0	3.35947	288.906	34.4877	39.3771	3.19572	0	47.8171	155.52	26.3566	32.0177	44.7949	15.0029	190.12	0	1.74379	87.4054	2.70153	110.18	94.2939	637.404	34.3822	23.5832	29.2556	16.6953	0	45.4811	0	2.22596	0	19.528	0	18.5409	0	13.6285	15.2392	0	0	76.2202	0	7.08417	0	0	43.5298	0	8.24339	0	20.1466	0	7.85878	30.8863	12.5704	42.8087	91.3236	0	0	21.0172	0	0	70.7523	0	41.1135	3.68977	93.0069	0	0	0	0	0	4.1709	0	20.2566	16.9854	7.55004	74.9416	4.30342	0	123.993	3.23655	247.859	349.183	0	13.9618	188.534	160.917	6.11016	251.964	198.037	78.5004	284.127	208.506	241.729	525.262	221	230.259	6.28771	207.919	174.061	103.038	0	540.639	0	209.776	489.718	30.8607	21.2007	31.8354	92.9251	86.1174	3.86809	126.939	9.37394	77.7558	39.7443	78.1723	270.181	1.76919	4.28326	33.8508	0	309.412	10.1367	16.0319	295.666	196.858	229.466	59.335	2.67756	184.414	50.7261	291.009	12.736	145.977	21.8232	515.809	27.1075	34.7809	10.8901	254.524	0	107.184	131.062
sorbitol	31.6747	40.874	100.49	44.718	35.6774	114.5	78.4124	24.2478	146.019	87.599	55.3609	67.2519	39.7963	38.1939	31.4453	49.875	23.3865	1186.54	28.7115	2538.55	12.3126	89.6839	152.924	203.705	61.3889	157.592	25.0225	12.6104	63.3103	21.4388	85.474	862.789	74.5139	61.8654	129.423	35.073	101.84	27.3515	50.3924	78.4358	23.9995	105.643	68.3644	339.771	80.6602	50.1445	50.4848	258.366	92.901	234.62	388.868	67.2223	50.6384	132.769	1005.7	55.0877	309.775	245.596	38.0883	29.2918	6191.93	163.028	37.1374	13.4917	24.1006	120.889	45.5247	113.291	4159.84	43.4312	15.7942	330.513	25.985	150.844	60.0819	22.7212	34.5431	20.9703	26.7684	36.1573	29.2572	96.9892	100.633	20.0639	21.1356	8645.4	66.5523	50.4101	27.9624	391.308	71.7323	80.2762	127.842	42.2524	74.6321	24.5658	79.5594	37.1223	1625.31	23.9345	90.1948	60.9008	25.638	110.874	39.0858	29.031	72.5112	68.6112	117.746	53.6364	46.4147	29.7488	26.3443	43.0979	57.5217	39.0964	60.7321	25.6734	63.8075	47.5405	40.9805	49.6122	95.4261	29.2685	45.2685	63.5385	48.2161	24.2522	154.492	67.4789	159.049	200.365	155.409	391.647	223.103	16.2141	32.2113	208.683	21.5783	1814.92	333.013	51.0213	14.5226	41.9796	1145.42	40.1533	30.9083	34.6764	44.6223	84.7411	36.2567	61.9626	49.7261	4382.02	77.3341	59.2288	47.2455	136.245	70.8151	168.39	104.262	31.1361	93.1965	161.325	73.568	81.6847	65.6117	140.921	92.0266	149.401	29.983	76.8413	55.0024	102.295	39.7629	48.1492	124.347	54.5834	50.7827	278.124	56.8263	52.3632	105.707	46.162	56.6937	194.284	52.7336	40.5582	28.7164	124.002	54.4595	141.366	311.361	663.05	22.8183	12.3764	1181.06	49.9785	80.8026	71.8087	1362.21	85.8978	185.628	32.976	57.5489	158.645	125.076	179.054	153.293	954.413	32.3742	47.3741	40.9358	56.7148	2747.84	126.138	80.3429	60.3479	56.241	32.6327
suberate	78.2271	42.5463	235.723	16.833	59.3884	12.5557	3.79424	42.1342	84.0037	21.3694	33.071	60.6407	24.6681	48.1515	75.3855	257.443	214.185	50.6963	30.6531	20.278	151.849	22.2639	99.6068	43.7509	83.2367	112.309	161.116	271.683	99.5418	206.2	217.672	11.7342	578.237	96.2947	263.413	380.722	43.2383	81.6449	354.527	450.997	99.4232	211.671	191.766	95.4684	38.8731	26.9064	121.135	37.2686	9.46961	37.1665	16.0792	96.8534	92.8874	51.4765	9.54359	55.5076	7.91841	32.0238	48.3789	86.8174	13.87	84.2933	34.2346	120.071	64.3346	367.16	276.735	65.9853	89.6955	136.552	62.1531	147.248	91.5707	104.573	81.65	8.11342	57.7445	37.7944	23.3556	6.04815	519.452	62.4114	205.708	95.21	14.4629	9.68422	20.7284	25.832	37.4036	23.91	61.0208	146.366	103.909	28.9259	47.3074	6.57387	83.885	178.053	22.0494	70.2725	59.1712	25.7923	51.9283	26.2818	140.282	119.413	10.2069	0	7.22309	50.9675	76.0088	6.09957	34.6572	238.493	71.4627	21.0151	168.732	21.1053	38.7564	192.002	46.8561	191.982	27.0274	40.5972	64.7752	57.0641	22.2259	20.8774	15.6742	49.0206	20.9678	194.893	8.85477	4.83033	15.5216	13.9301	114.583	67.0828	17.3301	20.2305	48.1449	195.154	19.912	142.192	16.0357	93.2033	17.8705	103.179	12.8923	18.6479	13.721	20.0453	38.6092	79.9151	88.7362	219.166	236.062	265.022	182.704	163.985	166.532	317.089	564.253	202.469	131.98	38.0352	105.16	178.673	117.263	46.6987	416.226	166.146	286.515	48.3908	33.5589	143.97	72.4233	47.4841	37.0954	34.9863	46.9105	408.438	23.8354	74.0948	71.6906	16.0912	42.9813	34.0544	80.1838	48.6709	29.3564	43.7339	32.3117	15.4343	73.0948	33.0116	9.54785	80.5129	59.7177	20.3878	24.7951	52.2287	106.777	36.9815	24.3551	30.8046	45.7601	123.07	44.8004	164.777	54.7137	41.5672	66.292	43.8401	10.7768	93.3422	72.4466	49.7987	49.4495	46.8917
succite	3971.72	304.615	5562.84	859.569	1778.24	248.211	4121.43	1426.52	2239.85	15081.4	2998.37	2217.08	820.505	1223.72	2877.48	4202.48	180.429	5546.67	3049.63	15634.4	3438.02	5535.41	4656.12	2040.36	4478.29	2696.6	1120.4	3098.5	1524.13	445.694	5978.28	5048.98	1077.01	3708.8	1835.26	2974.02	2693.88	5720.1	1767.83	3256.02	2923.68	1696.12	10887.7	1017.58	6670.95	942.66	14980.4	3475.31	39550.7	3835.46	35038.1	2716.95	4270.8	19535.4	26468.2	1850.73	10683.3	8847.56	796.466	905.573	11565.2	4871.24	1398.01	3007.19	3323.35	1231.33	1196.55	194.41	4981.07	1238.4	976.124	987.509	1139.92	7076.16	3453.2	2549.79	1255.63	395.6	29539.4	12511.7	2374.07	3394.78	2552.96	1111.09	12520.6	13602.9	6572.41	16431.6	2202.17	16897.2	5738.34	2008.22	1758.51	1676.98	2930.25	19371.3	2818.19	334.827	4512.09	3121.41	33226.2	23868	890.085	9633.36	1246.65	895.738	7351.18	17412.9	5492.9	3688.79	1029.27	238.57	1173.9	1623.13	2663.66	611.476	904.765	557.589	609.632	3762.61	1351.3	765.755	1847.85	461.796	3219.03	1997.51	592.113	16929.2	450.67	16389.7	31370.9	35178.1	33565	643.947	12752.7	15839.3	653.842	19034	1850.49	18160.8	2212.8	996.397	6062.46	458.774	32209.3	549.406	24949.8	823.08	18918.8	3047.65	172.61	41870.8	4917.11	28493.5	8649.51	1367.44	772.434	773.036	1558.46	7507.75	984.991	1288.44	1518.85	1489.68	793.995	6388.06	8244.96	883.232	2261.18	2943.99	1238.01	1170.97	1950.77	1147.83	1276.76	1560.87	3026.13	2539.29	562.669	23898.8	583.522	1930.41	28755	5150.47	2093.6	8998.6	92.0481	2386.7	808.922	450.903	3505.1	1929.07	2036.08	6479.3	614.511	4130.87	22529.5	2849.56	2212.55	28088.6	1350.65	2073.24	1656.13	582.006	1153.66	1575.61	4887.89	1118.83	1319.52	527.136	372.737	2641.87	809.103	456.633	549.885	1513.02	1718.21	1580.64	397.453	872.404
tartarate	8.16617	19.6743	4.07029	24.172	7.76224	6.35739	166.857	15.4275	27.8963	52.2205	144.844	10.7891	986.043	47.2604	4.43757	13.2248	0	23.5929	75.4116	92.9801	8.4266	113.505	15.872	16.309	8.30445	7.51414	10.1281	0	12.5062	5.76998	0	2985.79	6.56763	108.963	3.22391	10.0107	47.1097	46.8914	0	13.1388	8.84928	9.44574	11.49	14.345	16.3597	5.52829	5.09346	117.564	31.2416	165.057	5.73054	895.277	2.91617	3.86598	113.737	186.462	17352.5	4.50058	14.8911	217.27	446.784	33.3066	6.13641	11.1088	35.623	16.1903	2.80175	228.688	734.887	0	10.1554	17.4554	18.1417	11.8459	5.42145	9.6814	23.4911	2.54268	6.96241	947.353	15.3044	10.949	10.0496	7.44549	7.46417	465.482	28.0242	392.89	39.2614	93.2184	18.4833	22.3407	138.905	23.44	5.54458	26.9489	29.3452	9.98355	52750.3	74.298	2.39721	8.13724	60.5985	117.589	113.955	40.2632	4010.72	39.6671	141.816	20.2431	90.2613	83.9418	24.6309	175.724	57.3049	12.643	171.069	30.2184	437.171	324.072	599.685	341.187	63.0768	9.66739	381.517	192.657	40.112	663.9	325.506	9.27292	420.734	224.745	875.771	30.4207	25.2288	254.192	14.0064	99.9991	4.64426	112.844	189.491	90.4518	156.238	75.6418	112.415	522.552	672.505	88.5106	124.824	1832.63	16.1927	31.4828	71.4446	25.4322	171.308	7.37483	0	40.598	0	16.9607	12.6783	11.2282	3.53361	10.1298	14.617	14.1247	25.0932	0	111.477	89.2806	3.31917	9.54542	14.3632	18.7182	20.4079	33.2977	69.4596	56.972	15.9501	205.426	27.9672	0	39.7296	55.4636	8.50542	32.3002	29.4756	31.0404	54.9608	9.62741	14.9364	18.3444	58.8415	86.2975	65.6546	162.639	27.6283	54.3432	0	34.9266	79.7131	97.4125	8.6211	15.3428	107.375	134.992	18.3812	40.5534	28.9765	0	91.1176	11.0163	4.98676	12.473	102.829	731.722	439.927	519.033	27.4103	25.4886
taurine	20885.2	105.458	4765.4	2368.36	31.8027	11354.2	408.301	6287.32	11026.9	7840.14	8302.74	12048.7	1201.11	80.4196	3733.41	46.924	135.045	6229.68	3116.58	16863.4	13263.5	2063.41	635.293	1090.22	69.3066	1297.91	124.977	125.485	7084.44	112.598	114.143	13505.2	15.1796	859.555	134.301	19405.9	4845.26	290.171	112.831	259.374	10617.1	128.415	5937.69	13287.5	6078.86	25.7937	1169.65	3531.65	4809.17	8048.65	12871.4	260.809	19783.5	8327.47	4873.62	74.2651	11093.3	9182.28	61.1395	46.112	4598.59	1121.27	12203.3	290.511	96.9675	160.504	60.3461	695.548	6816.19	60.8231	11889.3	12358.4	15019.9	9069.56	6999.28	39104	38.9965	33.8806	6310.13	27743.4	80.1545	10763.3	59.0525	545.964	10859.4	1374.48	113.245	14718.8	12422.4	6318.64	4889.99	121.947	521.436	15084.7	14203.3	24572.3	10344.6	785.245	5582.39	10172.8	12874.9	576.865	90.4623	1267.63	56.9521	614.986	759.087	206.879	2317.58	163.35	37.289	2632.91	2294.37	177.616	56.7427	111.211	159.791	461.166	17.8554	452.783	63.0131	72.11	3910.9	2423.04	333.32	48.403	2484.24	6844.31	274.388	6865.23	3522.54	6119.64	11928.3	57.4073	3706.74	1108.42	128.47	2130.76	700.595	6599.34	6836.9	40.3553	420.005	4.37315	8479.25	257.118	1569.33	123.851	1459.95	5482.45	98.9259	6782.21	949.895	1176.03	145.62	127.201	150.461	24.5925	220.389	151.343	259.343	61.6485	83.2673	235.492	79.4178	10346.8	994.663	170.588	193.701	330.929	71.1204	170.672	57.5135	222.685	2653.15	159.192	165.561	7019.44	4348.15	1869.53	156.736	102.321	9702.57	198.655	139.896	7821.65	6097.53	15588.8	109.379	13343.3	4633.87	3171.87	13624.5	1740.74	3448.09	7175.12	7509.26	17564.6	211.911	7911.72	15276.4	331.062	88.7758	415.384	987.717	228.299	129.285	974.4	54.0646	578.264	12345.1	56.7462	10784.8	17.3887	3228.38	899.301	286.125	14931.7	11811.1	6744.97
taurodeoxycholate/taurochenodeoxycholate	142.87	26.8873	105.003	69.274	8.67092	63.6734	6922.54	66.1754	102.486	54.3087	41.816	79.7691	63.6585	51.1173	49.0418	38.2808	0	32.3821	14.2236	347.748	40.1265	44.7621	24.5965	35.5694	12.1487	9.49147	16.1809	7.89419	76.6362	13.6282	14.5791	19.6005	26.6236	6.6123	20.3308	71.0829	63.222	11.553	28.3604	23.296	206.981	46.8161	31.4333	172.364	14.5486	10.0649	50.1596	1130.98	2690.3	126.323	39.7456	48.2577	63.4382	5.29281	22.1547	24.6195	2701.95	12.9666	31.3743	44.3354	22.8365	0	2048.52	8.93042	26.6756	41.4511	15.1843	7.3312	10.754	1.45831	120.841	340.075	112.235	138.057	81.7359	15.6533	47.2695	0	41.4924	21.5167	20.8055	188.633	1.12126	19.5727	7.29355	5444.22	21.8227	626.641	115.483	2949.38	48.3724	26.6515	24.3682	5795.19	294.602	16.63	186.81	29.774	9757.75	122.833	175.938	0	67.8505	61.4605	27.7818	49.285	500.832	12643.4	15.1336	20.0897	247.912	48.0485	39.7077	91.9923	52.7566	27.034	28.2876	16.5569	27.1158	35.4852	88.385	44.9211	138.934	36.5243	26.3462	49.7535	40.8127	97.2594	65.0392	38.9646	2829.16	179.94	151.693	15.7583	593.218	12.0348	76.2067	4706.6	43.2437	229.993	27.0546	35.0117	77.9349	17.9993	0	58.9877	21.913	49.6711	445.646	267.259	7.4282	21.0111	28.2334	103.263	24.1956	12.2581	41.4638	20.1238	24.1956	34.8345	25.3112	100.17	32.821	42.1552	16.5642	270.786	115.517	28.7569	28.24	32.7243	28.9406	19.9766	0	18.1282	141.288	25.011	29.3753	229.107	24.3204	218.024	16.6663	120.301	197.242	36.1779	16.0049	2006.27	74.8822	14.5835	24.0844	17.9003	16.631	32.9112	61.3423	1895.14	11.442	11.5238	512.254	154.112	0	159.9	191.426	144.972	31.6617	17.248	26.1569	8.59072	68.9496	24.4885	37.8896	48.4596	32.1328	38.6072	172.021	17.2819	41.3704	44.5023	15.4171	20.6962	62.2252	52.8249
threonine	5052.04	122.235	5117.71	92.9119	3468.78	894.149	49.7467	1117.05	2681.03	2590.69	3387.81	3424.42	59.4125	245.539	3844.39	2537.72	2024.84	4181.1	1478.51	5011.92	2963.62	2128.2	4902.25	4987.44	4203.04	3370.75	4674.34	5441.9	1766	2583.65	4383.16	8598.1	2811.9	5554.72	2916.25	4628.12	2337.51	2891.1	2547.28	3572.75	3380.73	3188.93	4573.46	5028.98	1620.34	3176.66	3329.48	1062.3	4130.23	2087.32	6364.42	343.034	8779.66	3304.82	2987.32	678.293	4170.37	4438.16	142.805	457.274	12236.4	4555.76	4295.32	8285.24	4006.29	4127.08	2984.19	2874.97	15268.4	5669.42	2877.22	2447.71	3959.46	7048.95	6727.94	7441.78	3807.79	3409.06	4219.12	7332.88	3643.84	4545.06	2692.52	3667.84	5684.83	3268.37	714.407	3821.73	3341.58	6441.06	3964.34	2492.73	4939.21	3214.31	3138.88	10765.1	3943.63	2491.39	12389.7	1226.85	2321.61	728.463	150.953	19.1102	410.983	170.655	68.8651	141.515	31.9289	462.091	27.8445	147.74	126.228	210.094	1335.71	102.387	391.958	1045.32	683.793	213.593	39.485	187.914	60.7152	216.896	131.107	1180.65	995.926	5724.04	53.3499	4015.5	129.885	3035.45	2242.24	2246.85	23.8498	1355.85	436.253	7477.48	362.844	8287.63	2761.2	1740.26	78.5646	497.98	4599.81	778.634	2175.28	514.526	71.3808	126.914	12.4525	1438.83	1914.18	2683.32	1629.89	3169.37	6115.17	2911.07	4782.78	3239.39	4708.46	3071.89	4837.22	6911.49	5097.94	4444.07	4513.6	5125.71	2458.64	5248.93	2596.56	6404.33	2602.38	7654.39	5616.46	3630.28	3590.64	2994.04	1733.04	889.04	3475.45	2406.59	7345.71	3310.19	4997.29	2632.61	2888.28	4051	2457.04	6679.74	3660.01	5847.88	2291	3276.21	3337.82	2625.22	2271.23	8677.82	5292.99	4874.81	2221.6	4350.26	7224.37	1343.92	3126.04	3434.02	6353.84	5488.58	2608.48	4863.9	2721.24	6051.92	2615.03	2663.49	3393.38	1984.68	5924.87	4790.12	3536.11	1849.83
thymine	249.132	34.5946	2389.58	78.6808	3736.01	459.872	189.921	625.624	2869.27	973.146	232.574	1535.33	47.5144	123.545	1763.29	2894.72	2807.03	1552.49	212.737	1305.44	3043.83	709.834	1152.19	1649.72	1970.7	2228.27	1047.29	1667.75	615.841	2131.59	4113.47	550.739	1512.58	2028.57	1824.25	2338.07	1279.81	1493.66	4240.31	2430.82	1144.6	2958.34	162.155	460.447	1104.85	446.546	4687.35	331.694	873.884	71.2041	604.047	214.063	455.389	2768.36	2136.11	218.781	510.921	1173.98	51.5886	102.249	801.45	935.161	2124.91	1399.12	125.069	3446.57	1134.04	2286.41	673.841	2226.76	920.198	392.126	1591	2041.47	1406.51	36.4413	1568.85	760.258	649.247	203.178	2772.61	1064.28	4472.58	875.829	939.894	102.86	197.967	2754.78	489.05	896.931	545.374	2279.89	947.377	2935.84	736.746	534.023	1230.79	1981.34	62.9895	179.891	284.355	1235.31	54.7559	47.6426	70.0244	91.0717	20.7676	610.8	26.6872	49.3577	27.4748	14.0914	37.8798	96.8102	97.9088	78.3451	163.646	201.349	62.7809	398.391	60.0106	145.153	17.9039	99.2135	42.8191	259.249	83.7352	688.7	599.235	822.725	123.33	128.857	333.092	215.747	32.5538	106.042	85.5179	326.042	62.3148	247.811	570.584	913.412	228.678	51.2071	1030.25	133.527	152.054	186.337	13.3071	311.402	13.865	60.9547	251.931	477.61	364.047	471.462	1366.01	1192.67	1827.74	2764.04	2444.65	1980.72	982.805	4936.81	4235.13	807.514	852.868	4721.39	1576.2	1152.56	364.899	1353.42	2029.62	1435.96	1447.23	3624.6	1308.32	1189.68	649.512	366.115	3027.44	180.431	1913.6	1173.62	240.473	300.119	371.696	665.338	295.276	804.084	914.752	1435.58	203.314	707.359	793.381	439.458	354.51	1028.73	2464.61	712.654	389.749	940.585	1215.68	603.997	445.683	617.215	822.109	898.837	2232.96	2290.64	738.865	522.772	768.876	595	450.304	659.639	888.075	613.339	706.34	227.216
tryptophan	2939.98	172.269	2775.83	117.995	1350.27	645.641	156.658	525.49	1717.76	7770.21	1764.74	2000.03	158.351	254.886	1798.13	1400.64	1009.22	2770.63	1212.4	2946.18	3152.66	1120.97	2166.32	2153.18	2369	1464.57	2538.98	2369.66	1068.5	1505.69	2196.67	6301.56	851.147	2480.35	1405.11	2471.92	1268.91	1451.95	1487.39	1780.31	2462.24	1566.39	1936.86	2887.11	1059.16	1971.99	1399.35	902.293	4506.09	1905.93	4166.77	355.56	5577.06	3621.95	2425.31	441.878	2445.95	3918.82	158.915	569.48	7496.55	2951.46	3858.62	3783.02	1676.51	3208.76	1613.86	1315.42	12255.1	3419.44	2069.79	2388.11	2742.4	3737.86	3066.29	5634.81	2485.52	3906.73	1924.82	5173.83	1504.01	3068.2	1248.61	2130.72	4118.18	2432.65	4812.95	1301.31	1832.85	3695.05	2019.77	1387.06	2392.82	3335.52	1718.74	4765.59	2999.45	1376.68	14376.8	1065.87	2245.55	314.543	138.462	66.0912	324.027	256.035	81.2573	977.374	545.452	527.844	57.4607	3614.56	108.847	159.814	833.179	180.227	283.998	770.422	404.571	334.714	58.2405	246.248	128.661	267.84	1099.65	499.274	746.606	5291.92	140.864	3331.43	151.562	1655.45	5694.14	1324.02	89.6532	2377.17	187.388	4752.4	351.623	5055.51	7574.82	819.735	367.334	254.129	2534.69	317.466	956.767	415.407	55.5155	127.685	57.7219	2201.66	1080.6	2774.89	2314.83	2185.04	4704.06	1908.55	2820.76	2133.08	2924.35	2038.27	1873.32	3552.22	2714.94	3731.74	1843.28	2554.58	1320.89	3223.72	1695.13	3170.47	1159.34	4806.52	3748.1	2016.72	2051.9	3360.35	1179.8	729.697	1533.54	971.515	3906.09	1866.47	3348.4	2023.1	1407.27	2881.49	1900.38	4696.81	2247.3	3590.49	1767.23	2371	1551.38	1074.53	1432.54	5411.61	2418.67	4773.9	5904.11	3269.48	4634.69	634.794	2889.82	2875.17	5358.68	2742.64	1499.75	1876.33	1363.16	2805.17	1755.1	821.627	1155.76	838.995	3552.59	3030.57	1561.81	1373.01
tyrosine	7143.14	764.318	6681.02	517.431	3879.2	11748.6	88.3169	2094.59	5114.65	6394.72	8720.71	5086.46	339.943	978.202	4801.92	4364.59	4425.29	6295.27	9410.35	5887.16	8359.6	1575.27	6800.19	5185.95	8063.99	4263.18	6530.65	8618.21	3256.16	6465.28	8100.43	9210.9	4348.56	6084.87	4927.97	7104.35	3631.76	3989.83	5854.44	6454.02	6478.97	5377.99	7059.63	5418.83	1069.63	4592.31	4591.63	2278.95	8150.58	1084.15	13567.8	1296.83	9931.64	9289.42	2640.64	1503.43	4740.1	8836.48	512.873	1787.36	354.892	9769.31	10768.8	10305.8	4001.61	9973.02	5879.21	3570.75	9175	8170.53	5204.64	4123.54	4787.86	11012.3	8373.3	9338.97	5800.38	5246.54	5361.47	11099.3	6134.22	8731.21	6645.49	5121.05	9401.99	2076.12	10051.6	3486.84	7662.53	6634.46	8122.89	5270.45	5614.87	5768.88	4382.09	19857	8245.52	2794.26	343.398	8597.29	3807.23	860.171	513.255	402.512	1051.23	420.181	259.671	1203.08	656.76	2065.66	130.013	554.71	542.922	484.6	2585.19	3359.31	1030.55	2320.49	1309.6	888.968	93.8562	692.187	474.224	641.634	1096.96	1819.22	1718.26	9979.32	1072.6	7224.92	943.199	3908.72	7405.12	3086	466.796	2570.84	456.597	7605.29	1180.58	7628.09	5491.81	2643.59	166.962	695.15	4126.55	932.854	3629.52	1481.12	226.28	704.796	23.9522	7879.18	3697.89	6986.68	6387.17	6046.22	11476.8	4586.93	8892.05	6396.1	7713.87	7266.28	7024.17	10218.9	9182.8	9664.46	5553.46	8019.85	3753.52	8621.61	5052.77	9966.99	4167.61	11935.5	8937.97	6565.8	6257.42	6790.39	3723.18	1608.54	4165	3676.96	12045.5	5223.09	7160.69	4429.72	4079.49	28360.9	5159.92	10750.8	4332.2	8086.08	3350.25	3343.99	3948.32	2531.03	2906.82	10978.7	7631.65	7004.19	7455.89	7453.36	11872.6	1787.03	13430.4	6688.3	12210.8	6979.56	5216.07	5324.25	3407.14	7596.19	5438.75	3797.56	3310.62	2879.46	9225.53	10678.9	5422.44	3993.68
uracil	1143.26	65.0007	5492.72	167.95	7881.59	655.398	148.735	4016.22	7455.36	3543.5	3169.11	4959.81	635.196	746.786	2900.83	4899.07	7962.2	4946.62	2233.76	6936.22	7426.95	2738.2	5329.09	9142.31	7730.33	9616.45	4192.55	6145.34	4473.22	1882.39	6889.63	2266.75	3569.47	5426.5	2335.69	5687.56	3964.07	6826.36	9221.53	6370.23	2493.71	9214.37	2402.23	2481.8	3613.92	1380.64	14667.7	740.969	3371.91	1780.86	4451.65	1233.03	2665	7621.36	1631.66	1385.36	22.9687	4207.16	206.208	961.965	954.133	6069.32	9471.42	6471.91	2428.82	7171.86	2892.6	9339.21	1875.67	4018.97	2914.57	2658.56	3122.06	11520.9	8870.09	3123.54	6028.34	2811.08	2202.31	2469.8	8419.39	2489.92	7415.88	2583.87	5370.21	318.891	828.185	4159.03	3455.08	1555.16	3817.55	8109.91	6251.72	8841.57	2636.3	3708.24	4956.3	6690.27	523.932	484.402	1396.55	4175.85	207.261	33.4154	331.119	414.466	0	1304.38	140.151	997.782	48.4828	80.5567	752.029	592.906	1074.44	1083.33	847.623	1006.47	234.106	3557.4	1009.81	592.875	66.1236	495.735	371.195	1114.05	808.939	2529.44	548.965	3931.13	49.0632	775.858	1475.19	2663.35	0	915.308	677.135	1248.83	1121.73	2335.38	3679.9	2319.98	583.711	378.993	2993.85	611.893	374.175	1262.75	13.2516	668.203	88.907	895.194	1185.57	1564.19	86.3907	5696.61	6239.59	1782.89	5552.46	11678.6	6767.56	5403.99	5957.08	17456.5	4559.7	3334.62	7197.89	7006.57	4547.93	9168.33	1391.97	12148.5	8387.19	7986.08	10415.1	8609.18	5684.54	3182.2	5942.31	2070.98	6875.65	2066.09	4897.71	2818.46	2554.75	755.281	3095.85	6038.03	2236.87	1632.93	2534.53	4106.42	1918.92	571.633	5312.53	1859.65	942.998	5619.07	3561.18	5634.71	2178.09	7537	6918.3	4469.57	2336.92	5641.21	2601.88	6738.93	7232.83	5793.15	3269.23	7346.62	717.205	2622.76	2291.12	7059.78	2972.49	6973.97	4201.74	2831.2
urate	983.554	479.314	3666.58	640.691	458.678	74.7262	447.372	2648.04	2479.52	338.52	408.145	1149.04	266.491	1096.66	3096.43	2521.13	5859.94	2065.02	223.156	2519.37	2381.98	398.118	1504.4	731.286	5169.83	944.392	1289.83	3796.36	1894.99	3133.41	4220.82	977.749	1489.39	1366.89	4995.15	4379.94	453.469	149.814	3635.39	1635.98	1370.54	839.503	144.969	765.477	1339.85	4305.58	3246.3	473.849	217.744	151.463	148.98	1727.47	1162.5	443.319	3322.63	2000.24	8003.6	457.546	622.471	1370.51	16830	29251.9	1848.83	3957.4	2666.56	4011.41	1435.3	1699.76	34473	5230.62	778.992	787.064	1672.03	1305.49	1571.81	227.772	421.391	2004.92	421.351	4908.34	3192.04	4914.59	3441.71	2165.48	68.0148	10366.8	1933.46	228.658	472.3	7310.3	557.206	1623.44	1091.23	1581.07	687.261	589.514	9686.47	805.822	39312.4	708.669	246.241	551.343	1062.81	140.748	1113.89	876.241	648.878	3075.9	20.2472	455.139	347.384	72.2686	536.88	883.586	1834.51	394.252	1447.21	1932.81	1860.19	589.526	412.684	2041.76	531.569	816.421	86.1389	2887.07	1190.15	241.739	51.1347	766.097	136.129	699.039	7439.47	8464.23	15.4059	1513.95	612.051	15209.5	830.794	4271.12	450.435	5390.61	203.014	1053.48	1191.57	1383.1	909.818	1459.87	13.1911	50.5201	61.3293	118.823	432.492	814.871	1845.19	210.602	652.114	251.129	1596.4	1414.62	348.163	589.278	948.567	826.084	954.27	4237.38	299.845	759.042	772.746	1394.4	157.592	954.424	424.494	888.131	610.312	486.212	360.152	175.286	88.1696	41.6046	466.063	184.623	718.733	419.917	148.992	772.817	98.3387	2888.12	665.387	301.894	435.681	294.356	112.44	21159	468.845	106	463.423	502.771	694.739	36.9777	224.751	1365.03	1467.32	363.476	55.1901	273.771	813.53	76.6186	761.277	2849.17	100.361	447.191	1203.98	124.311	88.2542	130.799	1368.87	129.487	195.544	198.629
uridine	43.4791	779.622	99.0469	271.17	611.721	0	135.413	732.926	534.184	1569	138.306	418.379	308.309	1470.24	464.672	409.121	89.4734	680.11	48.4732	1223.84	448.412	0	538.923	804.273	2426.21	821.444	226.726	1720.77	353.532	164.686	784.358	193.935	181.405	378.537	565.872	449.901	240.765	1896.39	84.3872	506.004	1247.69	416.241	382.829	166.346	710.928	82.3456	228.89	0	1970	110.844	414.522	424.622	278.833	353.721	287.169	1588.05	1171.2	864.584	188.609	388.708	0	2192.94	772.496	973.283	846.047	285.534	72.3407	522.689	23.9744	277.483	517.242	2541.98	277.324	2574.85	151.272	1716.45	958.849	42.6035	253.399	127.591	231.503	61.125	561.593	210.669	1441.29	94.7447	137.184	314.095	1219.57	2272.42	300.604	199.829	2428.03	113.543	1274.9	1779.02	2936.97	110.199	150.312	308.79	120.936	91.8392	713.333	685.683	171.136	1319.49	234.719	125.959	52.7243	1122.22	694.294	62.6045	1781.77	254.19	830.913	433.428	407.277	1485.43	607.242	817.041	280.449	413.182	630.858	1726.76	508.828	889.92	927.165	1054.28	99.2557	602.08	207.495	422.681	2508.07	2694.15	170.898	870.826	1350.83	763.534	401.753	1162.43	102.998	181.979	267.807	140.133	193.089	633.52	645.537	675.91	73.386	694.408	390.273	395.023	390.246	677.827	1046.68	192.244	307.907	233.791	535.159	841.481	325.634	139.876	348.529	1514.4	551.132	1796.71	1077.13	393.667	173.613	3459.88	284.184	3435.11	606.441	2607.68	1901.27	1672.78	353.091	758.206	2503.05	752.928	174.899	300.086	1408.67	380.21	596.197	940.972	38.206	3559.82	927.474	199.375	434.308	803.245	1178.55	685.22	1255.88	351.226	824.193	699.401	14.9671	4263.27	260.794	1707.97	2235.69	392.559	378.58	3166.47	3864.07	1377.89	2260.81	95.8586	1723.95	2766.31	1264.63	214.307	44.0957	1089.35	453.455	979.284	493.04	2558.83
valine	29184.9	894.347	30172	1047.39	15037.5	62285.6	482.521	5880.17	18435.7	37952.8	32306.4	22303.4	447.625	1474.28	17276.4	16159.8	19206.6	22976.5	24168.8	26579.1	35447.5	34451.9	21922.1	21634.2	29806.5	14780.2	23529.6	32037.8	11395.5	19444.3	32238.4	46340	17549.2	26938	16549.8	26911.7	10585.2	13942.7	24444.5	20403.3	22142.1	19311.9	31235.5	22370.6	9532.26	18840.9	20445	7798.12	34447.6	10507.4	41624.8	3048.45	47512.1	35527.2	16081.7	3848.34	16701.4	27813.7	1503.18	3177.78	38713.8	44274.7	35503.4	37860.3	15022	46004.2	26738.5	17395.8	58239	34858.3	18953.1	10371.8	21952.5	38087.5	32305.3	38831.2	22011.3	34856.1	60435.4	43917.7	27768.8	34338.6	26977.7	17767.8	35358.7	16459.9	22406.8	14959.5	18793	25993.2	21139.1	24230.9	19897.3	28820	15051.2	64054.2	33112.5	15196.7	28055.9	5892.2	10238.4	7567.31	908.075	1172.16	3158.94	1242	756.012	4062.71	724.037	2814.81	264.523	16445.4	709.916	1390.89	6750.28	906.007	2586.05	7474.6	3862.14	3732.1	176.218	1699.27	609.082	1495.09	1276.36	5427.84	5441.79	29660.4	8347.03	30719.8	3537.94	14550.5	20492.9	10336.4	6121.97	7238.13	1844.48	27707.4	2528.93	45286.8	29978.6	11641.4	3578.1	2460.98	22155.5	3559.44	8729.87	3799.86	2943.86	533.884	75.5781	29488.7	6848.72	18719.1	10990.2	25505.8	47615.2	21145	39393.5	30740.5	38491.2	32747.1	33685.2	44233	42244.7	37415.7	25877.1	41184.5	18756.9	39100.7	21512.9	41913.8	20566.6	52471.5	37406.5	26733.4	29156.5	26315.8	13903.8	14112.6	22860.5	18241.6	49151.9	21985.9	26551	20616.6	19530.6	26075.4	18182.8	42248.7	31166.1	34381.9	16625.9	18361.1	19027.1	11696.2	32194.4	50512.8	35571.7	27796	73419.7	33423	44055.6	9350.75	50622.9	23978.3	56115.8	35117.5	20014.2	24766.4	19992.8	40106.9	23097	22750.3	45817.6	11624.7	34269.1	41904.4	26241.4	15240.7
xanthine	10964.2	1056.03	12451.7	404.082	14820.1	1825.25	678.229	4830.47	12405.8	10970.4	3719.1	11838.9	806.404	2239.23	13373.7	11639.5	16147.6	10229.4	2852.71	13426.8	12729.6	6950.34	15707.4	13925.1	13477.6	17286.1	11390.1	10754.5	10435.5	13209.6	15411	12099.9	9110.86	16045.3	12365.5	13794.4	9466.66	10251.3	20301.5	15131	9745.96	15373.9	7465.61	10908.9	6624.54	6298.09	20120.6	2943.44	4077.12	6305.87	10455.2	3082.44	12511	10995.7	9462.84	1453.6	660.247	10989.5	444.458	2051.63	5680.6	10665.2	17874.4	13809.6	4004.9	9755.83	7585.92	9827.18	7508.25	11373.8	12810.3	15252.2	9613.13	17027.2	11814.6	12435.8	15764.8	9086.02	6740.13	13690.3	12565.3	9719.49	15849.7	6281.51	12276.2	0	1432.07	7775.11	7443.41	7747.42	5751.52	15266.6	13904.2	13528.5	7899.3	11620.4	12435	8306.59	883.016	388.022	10134.8	8406.69	2291.19	231.766	777.399	1408.52	138.584	3763.44	172.735	1815.49	1309.51	46.1998	1321.21	2093.28	2534.4	2597.02	1592.3	1695.87	1321.32	15574.1	1024.49	3287.85	895.406	1746.68	2300.59	2446.73	1773.47	7091.95	304.858	9298.48	177.534	4923.45	9991.34	2037.17	87.1721	946.667	1511.56	2648.73	2333.17	6095.8	8932.64	1305.91	2763.66	247.867	12662.8	1981.61	485.282	1507.62	29.694	245.817	296.094	510.385	2008.58	1770.39	1691.58	10108.6	16342.7	12428.1	13306.3	12291	14158	13309.4	11190	19362.5	16559.5	8346.14	16230.9	19514.5	13309.3	21782.7	8127.26	19776.3	10663.6	17672.6	20438.9	15874.1	17389	13383.4	11014.2	5711.83	13080.9	4874.09	17645.9	16269.1	9092.89	2635.88	10670.6	10936.1	9913.58	10920.7	13612.8	15660.3	7382.44	3938.95	12649.6	8182.45	5043.58	18804.7	12982.6	17007.7	8845.72	17132.4	17412.4	10517.7	8721.26	13735.8	9314.4	16976.5	14100.5	12475.9	10358.1	16197.7	7052.39	9630.22	2425.97	12105.4	11389.5	18839.4	12298	8949.59
xylose	85.3097	0.870127	105.129	0	116.503	0	0	182.364	35.3891	104.348	5.40224	14.59	0	6.88211	154.726	107.766	194.592	70.1681	0	64.8925	134.447	4.75274	198.425	59.807	122.214	59.6933	92.1152	175.269	100.57	34.4565	192.104	73.0319	104.081	134.642	9.88187	199.114	87.0379	166.861	184.838	209.723	147.051	228.962	91.5149	123.057	244.66	15.2827	352.201	4.55579	102.321	34.1389	115.979	40.4009	110.55	12.1867	47.5691	63.3852	3.34528	90.7214	17.7531	21.5485	35.6377	340.678	141.63	339.99	26.9439	231.704	99.4936	114.476	42.5672	92.8701	186.071	44.8221	52.6485	334.275	227.972	17.9975	249.426	51.4666	75.354	45.5701	271.232	28.6141	255.951	26.4321	138.655	10.7922	44.3549	67.752	165.576	62.1136	62.8364	323.363	239.739	174.63	147.334	163.758	142.427	154.185	0	18.2351	23.1368	145.247	0	0	19.7872	22.9542	3.59907	28.2493	0	37.2981	12.0163	8.0756	61.8206	77.5968	96.9899	56.3219	43.0363	6.71303	48.5097	112.699	0	91.2588	37.911	31.0801	9.05651	82.6102	44.4264	28.1771	15.0326	97.0547	0	59.5849	0	176.426	0	0	0	50.8222	13.4588	77.0863	0	32.099	6.4319	0	106.779	51.3311	40.4676	26.3414	0	0.912737	17.9502	42.4271	70.4502	120.307	55.1693	332.699	102.487	143.976	235.946	555.266	313.22	283.005	245.527	660.252	192.946	103.113	248.079	351.614	168.562	357.073	58.818	528.667	319.709	279.214	683.697	453.088	220.763	113.754	243.293	10.8056	172.024	86.0742	232.728	300.854	114.966	50.9138	304.151	250.214	139.81	87.5268	169.668	172.431	147.886	29.1002	256.928	136.483	40.9903	192.047	122.841	192.101	42.4131	416.445	408.396	179.265	119.679	410.864	136.153	322.693	593.53	154.164	86.5334	389.715	67.1728	115.427	105.911	350.944	133.586	443.126	122.966	55.9739

metabolite_name	featureID	Method	rtimes	quantified m/z	HMDB	Adduct	Compound	featureID
1,2,3,4-Tetrahydro-1-methyl-beta-carboline-3-carboxylic acid	HILIC-neg_Cluster_0622	HILIC-neg	3.81	229.098	HMDB37942	[M-H]-	229.098_3.81	HILIC-neg_Cluster_0622
1-3-7-trimethylurate	HILIC-neg_Cluster_0480	HILIC-neg	3.83	209.0679	HMDB02123	[M-H]-	209.0679_3.83	HILIC-neg_Cluster_0480
2-Aminobutyric Acid	HILIC-neg_Cluster_0032	HILIC-neg	3.04	102.056	HMDB00452	[M-H]-	102.056_3.04	HILIC-neg_Cluster_0032
2-hydroxy-3-methylpentanoic acid / leucinic acid	HILIC-neg_Cluster_0113	HILIC-neg	3.66	131.0712	HMDB00317 / HMDB00729	[M-H]-	131.0712_3.66	HILIC-neg_Cluster_0113
2-hydroxyglutarate	HILIC-neg_Cluster_0169	HILIC-neg	7.21	147.0297	HMDB00694	[M-H]-	147.0297_7.21	HILIC-neg_Cluster_0169
2-Methylglutaric acid	HILIC-neg_Cluster_0161	HILIC-neg	7.17	145.0503	HMDB00422	[M-H]-	145.0503_7.17	HILIC-neg_Cluster_0161
3-methyladipate-pimelate	HILIC-neg_Cluster_0220	HILIC-neg	7.31	159.066	HMDB00555	[M-H]-	159.066_7.31	HILIC-neg_Cluster_0220
4-hydroxybenzaldehyde	HILIC-neg_Cluster_0079	HILIC-neg	2.53	121.0295	HMDB11718	[M-H]-	121.0295_2.53	HILIC-neg_Cluster_0079
4-methylcatechol	HILIC-neg_Cluster_0084	HILIC-neg	1.37	123.045	HMDB00873	[M-H]-	123.045_1.37	HILIC-neg_Cluster_0084
4-nitrophenol	HILIC-neg_Cluster_0133	HILIC-neg	4.08	138.0195	HMDB01232	[M-H]-	138.0195_4.08	HILIC-neg_Cluster_0133
4-pyridoxate	HILIC-neg_Cluster_0335	HILIC-neg	3.84	182.0459	HMDB00017	[M-H]-	182.0459_3.84	HILIC-neg_Cluster_0335
acesulfame	HILIC-neg_Cluster_0232	HILIC-neg	3.48	161.9863	HMDB33585	[M-H]-	161.9863_3.48	HILIC-neg_Cluster_0232
acetylalanine	HILIC-neg_Cluster_0103	HILIC-neg	3.92	130.0508	HMDB00766	[M-H]-	130.0508_3.92	HILIC-neg_Cluster_0103
adenine	HILIC-neg_Cluster_0120	HILIC-neg	2.27	134.0472	HMDB00034	[M-H]-	134.0472_2.27	HILIC-neg_Cluster_0120
alanine	HILIC-neg_Cluster_0015	HILIC-neg	3.3	88.0403	HMDB00161	[M-H]-	88.0403_3.3	HILIC-neg_Cluster_0015
alpha-hydroxybutyrate	HILIC-neg_Cluster_0034	HILIC-neg	3.87	103.0399	HMDB00008	[M-H]-	103.0399_3.87	HILIC-neg_Cluster_0034
alpha-ketoglutarate	HILIC-neg_Cluster_0159	HILIC-neg	7.76	145.0141	HMDB00208	[M-H]-	145.0141_7.76	HILIC-neg_Cluster_0159
alpha-ketoisovalerate	HILIC-neg_Cluster_0062	HILIC-neg	3.52	115.0399	HMDB00019	[M-H]-	115.0399_3.52	HILIC-neg_Cluster_0062
arginine	HILIC-neg_Cluster_0290	HILIC-neg	4.26	173.1041	HMDB00517	[M-H]-	173.1041_4.26	HILIC-neg_Cluster_0290
ascorbate	HILIC-neg_Cluster_0299	HILIC-neg	9.5	175.0245	HMDB00044	[M-H]-	175.0245_9.5	HILIC-neg_Cluster_0299
asparagine	HILIC-neg_Cluster_0112	HILIC-neg	3.96	131.0461	HMDB00168	[M-H]-	131.0461_3.96	HILIC-neg_Cluster_0112
aspartate	HILIC-neg_Cluster_0117	HILIC-neg	5.35	132.0302	HMDB00191	[M-H]-	132.0302_5.35	HILIC-neg_Cluster_0117
azelaic acid	HILIC-neg_Cluster_0365	HILIC-neg	7.13	187.0972	HMDB00784	[M-H]-	187.0972_7.13	HILIC-neg_Cluster_0365
butyrate / isobutytare	HILIC-neg_Cluster_0013	HILIC-neg	3.91	87.0451	HMDB00039*	[M-H]-	87.0451_3.91	HILIC-neg_Cluster_0013
caproic acid	HILIC-neg_Cluster_0064	HILIC-neg	3.73	115.0765	HMDB00535	[M-H]-	115.0765_3.73	HILIC-neg_Cluster_0064
caprylic acid	HILIC-neg_Cluster_0156	HILIC-neg	3.6	143.1074	HMDB00482	[M-H]-	143.1074_3.6	HILIC-neg_Cluster_0156
chenodeoxycholate/deoxycholate	HILIC-neg_Cluster_1360	HILIC-neg	4.05	391.2852	HMDB00626*	[M-H]-	391.2852_4.05	HILIC-neg_Cluster_1360
cholate	HILIC-neg_Cluster_1403	HILIC-neg	4.21	407.2798	HMDB00619	[M-H]-	407.2798_4.21	HILIC-neg_Cluster_1403
citrate	HILIC-neg_Cluster_0392	HILIC-neg	9.42	191.0195	HMDB00094	[M-H]-	191.0195_9.42	HILIC-neg_Cluster_0392
citrulline	HILIC-neg_Cluster_0296	HILIC-neg	3.64	174.0881	HMDB00904	[M-H]-	174.0881_3.64	HILIC-neg_Cluster_0296
cystine	HILIC-neg_Cluster_0677	HILIC-neg	6.29	239.0164	HMDB00192	[M-H]-	239.0164_6.29	HILIC-neg_Cluster_0677
deoxyinosine	HILIC-neg_Cluster_0740	HILIC-neg	2.79	251.078	HMDB29956	[M-H]-	251.078_2.79	HILIC-neg_Cluster_0740
dihydroxybenzoic Acid	HILIC-neg_Cluster_0199	HILIC-neg	4.82	153.019	HMDB00397	[M-H]-	153.019_4.82	HILIC-neg_Cluster_0199
docosapentaenoate	HILIC-neg_Cluster_1126	HILIC-neg	3.19	329.2483	HMDB01976	[M-H]-	329.2483_3.19	HILIC-neg_Cluster_1126
eicosapentaenoic acid	HILIC-neg_Cluster_1002	HILIC-neg	3.24	301.2169	HMDB01999	[M-H]-	301.2169_3.24	HILIC-neg_Cluster_1002
erythronic acid	HILIC-neg_Cluster_0122	HILIC-neg	4.43	135.0298	HMDB00613	[M-H]-	135.0298_4.43	HILIC-neg_Cluster_0122
ethyl glucuronide	HILIC-neg_Cluster_0562	HILIC-neg	4.03	221.0663	HMDB10325	[M-H]-	221.0663_4.03	HILIC-neg_Cluster_0562
fructose/glucose/galactose	HILIC-neg_Cluster_0321	HILIC-neg	2.16	179.0559	HMDB00122*	[M-H]-	179.0559_2.16	HILIC-neg_Cluster_0321
fucose	HILIC-neg_Cluster_0237	HILIC-neg	1.59	163.061	HMDB00174	[M-H]-	163.061_1.59	HILIC-neg_Cluster_0237
fumarate/maleate	HILIC-neg_Cluster_0061	HILIC-neg	7.33	115.0035	HMDB00134*	[M-H]-	115.0035_7.33	HILIC-neg_Cluster_0061
glucurote	HILIC-neg_Cluster_0401	HILIC-neg	5.45	193.0351	HMDB00127	[M-H]-	193.0351_5.45	HILIC-neg_Cluster_0401
glutamate	HILIC-neg_Cluster_0166	HILIC-neg	5.32	146.0457	HMDB03339	[M-H]-	146.0457_5.32	HILIC-neg_Cluster_0166
glutamine	HILIC-neg_Cluster_0162	HILIC-neg	3.7	145.0618	HMDB00641	[M-H]-	145.0618_3.7	HILIC-neg_Cluster_0162
glycerate	HILIC-neg_Cluster_0036	HILIC-neg	4.39	105.0192	HMDB00139	[M-H]-	105.0192_4.39	HILIC-neg_Cluster_0036
glycocholate	HILIC-neg_Cluster_1571	HILIC-neg	4.04	464.3012	HMDB00138	[M-H]-	464.3012_4.04	HILIC-neg_Cluster_1571
guanine	HILIC-neg_Cluster_0182	HILIC-neg	2.65	150.0418	HMDB00132	[M-H]-	150.0418_2.65	HILIC-neg_Cluster_0182
guanosine	HILIC-neg_Cluster_0909	HILIC-neg	3.06	282.0841	HMDB00133	[M-H]-	282.0841_3.06	HILIC-neg_Cluster_0909
heptadecanoate	HILIC-neg_Cluster_0841	HILIC-neg	3.28	269.2485	HMDB02259	[M-H]-	269.2485_3.28	HILIC-neg_Cluster_0841
histidine	HILIC-neg_Cluster_0201	HILIC-neg	4.04	154.0618	HMDB00177	[M-H]-	154.0618_4.04	HILIC-neg_Cluster_0201
homovanillate	HILIC-neg_Cluster_0328	HILIC-neg	4.57	181.0505	HMDB00118	[M-H]-	181.0505_4.57	HILIC-neg_Cluster_0328
hydrocinnamic acid	HILIC-neg_Cluster_0181	HILIC-neg	3.88	149.0607	HMDB00764	[M-H]-	149.0607_3.88	HILIC-neg_Cluster_0181
hydroxyisovaleric acid	HILIC-neg_Cluster_0070	HILIC-neg	3.71	117.0556	HMDB00754	[M-H]-	117.0556_3.71	HILIC-neg_Cluster_0070
hypoxanthine	HILIC-neg_Cluster_0123	HILIC-neg	3.25	135.0311	HMDB00157	[M-H]-	135.0311_3.25	HILIC-neg_Cluster_0123
imidazolelactate	HILIC-neg_Cluster_0204	HILIC-neg	4.57	155.0459	HMDB02320	[M-H]-	155.0459_4.57	HILIC-neg_Cluster_0204
inosine	HILIC-neg_Cluster_0824	HILIC-neg	3.4	267.0726	HMDB00195	[M-H]-	267.0726_3.4	HILIC-neg_Cluster_0824
lactate	HILIC-neg_Cluster_0020	HILIC-neg	4.03	89.0243	HMDB00190	[M-H]-	89.0243_4.03	HILIC-neg_Cluster_0020
lactose	HILIC-neg_Cluster_1170	HILIC-neg	2.61	341.1086	HMDB00186	[M-H]-	341.1086_2.61	HILIC-neg_Cluster_1170
leucine	HILIC-neg_Cluster_0105	HILIC-neg	2.62	130.0871	HMDB00687	[M-H]-	130.0871_2.62	HILIC-neg_Cluster_0105
levoglucosan	HILIC-neg_Cluster_0230	HILIC-neg	7.13	161.0454	HMDB00640	[M-H]-	161.0454_7.13	HILIC-neg_Cluster_0230
linoleoyl ethanolamide	HILIC-neg_Cluster_1088	HILIC-neg	1.07	322.2749	HMDB12252	[M-H]-	322.2749_1.07	HILIC-neg_Cluster_1088
lithocholate	HILIC-neg_Cluster_1303	HILIC-neg	3.95	375.2902	HMDB00761	[M-H]-	375.2902_3.95	HILIC-neg_Cluster_1303
L-phenyllactic Acid	HILIC-neg_Cluster_0247	HILIC-neg	3.82	165.0554	HMDB00748	[M-H]-	165.0554_3.82	HILIC-neg_Cluster_0247
malate	HILIC-neg_Cluster_0118	HILIC-neg	7.32	133.0141	HMDB00156	[M-H]-	133.0141_7.32	HILIC-neg_Cluster_0118
malonate	HILIC-neg_Cluster_0033	HILIC-neg	7.48	103.0036	HMDB00691	[M-H]-	103.0036_7.48	HILIC-neg_Cluster_0033
methionine	HILIC-neg_Cluster_0173	HILIC-neg	3.16	148.0437	HMDB00696	[M-H]-	148.0437_3.16	HILIC-neg_Cluster_0173
Methylbutyric aid / Valeric / Isovaleric	HILIC-neg_Cluster_0030	HILIC-neg	3.8	101.0607	HMDB02176*	[M-H]-	101.0607_3.8	HILIC-neg_Cluster_0030
N-acetylglutamate	HILIC-neg_Cluster_0372	HILIC-neg	7.02	188.0563	HMDB01138	[M-H]-	188.0563_7.02	HILIC-neg_Cluster_0372
nicotinate	HILIC-neg_Cluster_0082	HILIC-neg	4.2	122.0247	HMDB01488	[M-H]-	122.0247_4.2	HILIC-neg_Cluster_0082
orotate	HILIC-neg_Cluster_0203	HILIC-neg	4.71	155.0096	HMDB00226	[M-H]-	155.0096_4.71	HILIC-neg_Cluster_0203
oxalate	HILIC-neg_Cluster_0016	HILIC-neg	7.77	88.988	HMDB02329	[M-H]-	88.988_7.77	HILIC-neg_Cluster_0016
pantothete	HILIC-neg_Cluster_0552	HILIC-neg	4.07	218.103	HMDB00210	[M-H]-	218.103_4.07	HILIC-neg_Cluster_0552
pentadecanoate	HILIC-neg_Cluster_0697	HILIC-neg	3.34	241.2171	HMDB00826	[M-H]-	241.2171_3.34	HILIC-neg_Cluster_0697
phenylacetate	HILIC-neg_Cluster_0125	HILIC-neg	3.97	135.0451	HMDB00209	[M-H]-	135.0451_3.97	HILIC-neg_Cluster_0125
phenylalanine	HILIC-neg_Cluster_0242	HILIC-neg	3.24	164.0715	HMDB00779	[M-H]-	164.0715_3.24	HILIC-neg_Cluster_0242
proline	HILIC-neg_Cluster_0059	HILIC-neg	3.06	114.056	HMDB00162	[M-H]-	114.056_3.06	HILIC-neg_Cluster_0059
propionate	HILIC-neg_Cluster_0003	HILIC-neg	4.05	73.0293	HMDB00237	[M-H]-	73.0293_4.05	HILIC-neg_Cluster_0003
pseudouridine	HILIC-neg_Cluster_0707	HILIC-neg	2.34	243.0619	HMDB00767	[M-H]-	243.0619_2.34	HILIC-neg_Cluster_0707
pyrocatechol	HILIC-neg_Cluster_0040	HILIC-neg	1.46	109.0294	HMDB00957	[M-H]-	109.0294_1.46	HILIC-neg_Cluster_0040
quinic acid	HILIC-neg_Cluster_0395	HILIC-neg	4.43	191.0561	HMDB03072	[M-H]-	191.0561_4.43	HILIC-neg_Cluster_0395
ribitol	HILIC-neg_Cluster_0192	HILIC-neg	1.76	151.0609	HMDB00508	[M-H]-	151.0609_1.76	HILIC-neg_Cluster_0192
riboflavin	HILIC-neg_Cluster_1300	HILIC-neg	1.61	375.13	HMDB00244	[M-H]-	375.13_1.61	HILIC-neg_Cluster_1300
saccharin	HILIC-neg_Cluster_0332	HILIC-neg	3.81	181.9916	HMDB29723	[M-H]-	181.9916_3.81	HILIC-neg_Cluster_0332
salicylate	HILIC-neg_Cluster_0129	HILIC-neg	3.96	137.0242	HMDB01895	[M-H]-	137.0242_3.96	HILIC-neg_Cluster_0129
sebacate	HILIC-neg_Cluster_0441	HILIC-neg	7.09	201.1131	HMDB00792	[M-H]-	201.1131_7.09	HILIC-neg_Cluster_0441
serine	HILIC-neg_Cluster_0035	HILIC-neg	4.04	104.0353	HMDB00187	[M-H]-	104.0353_4.04	HILIC-neg_Cluster_0035
shikimate	HILIC-neg_Cluster_0283	HILIC-neg	4.74	173.0449	HMDB03070	[M-H]-	173.0449_4.74	HILIC-neg_Cluster_0283
sorbitol	HILIC-neg_Cluster_0331	HILIC-neg	2.01	181.0716	HMDB00247	[M-H]-	181.0716_2.01	HILIC-neg_Cluster_0331
suberate	HILIC-neg_Cluster_0288	HILIC-neg	7.14	173.0816	HMDB00893	[M-H]-	173.0816_7.14	HILIC-neg_Cluster_0288
succite	HILIC-neg_Cluster_0069	HILIC-neg	7.27	117.0192	HMDB00254	[M-H]-	117.0192_7.27	HILIC-neg_Cluster_0069
tartarate	HILIC-neg_Cluster_0174	HILIC-neg	7.41	149.0087	HMDB00956	[M-H]-	149.0087_7.41	HILIC-neg_Cluster_0174
taurine	HILIC-neg_Cluster_0085	HILIC-neg	3.72	124.0072	HMDB00251	[M-H]-	124.0072_3.72	HILIC-neg_Cluster_0085
taurodeoxycholate/taurochenodeoxycholate	HILIC-neg_Cluster_1675	HILIC-neg	3.56	498.2895	HMDB00896*	[M-H]-	498.2895_3.56	HILIC-neg_Cluster_1675
threonine	HILIC-neg_Cluster_0073	HILIC-neg	3.67	118.0508	HMDB00167	[M-H]-	118.0508_3.67	HILIC-neg_Cluster_0073
thymine	HILIC-neg_Cluster_0087	HILIC-neg	1.35	125.0355	HMDB00262	[M-H]-	125.0355_1.35	HILIC-neg_Cluster_0087
tryptophan	HILIC-neg_Cluster_0452	HILIC-neg	3.46	203.0825	HMDB00929	[M-H]-	203.0825_3.46	HILIC-neg_Cluster_0452
tyrosine	HILIC-neg_Cluster_0324	HILIC-neg	3.77	180.0665	HMDB00158	[M-H]-	180.0665_3.77	HILIC-neg_Cluster_0324
uracil	HILIC-neg_Cluster_0049	HILIC-neg	1.55	111.0199	HMDB00300	[M-H]-	111.0199_1.55	HILIC-neg_Cluster_0049
urate	HILIC-neg_Cluster_0254	HILIC-neg	5.35	167.0207	HMDB00289	[M-H]-	167.0207_5.35	HILIC-neg_Cluster_0254
uridine	HILIC-neg_Cluster_0706	HILIC-neg	1.8	243.0619	HMDB00296	[M-H]-	243.0619_1.8	HILIC-neg_Cluster_0706
valine	HILIC-neg_Cluster_0066	HILIC-neg	2.88	116.0716	HMDB00883	[M-H]-	116.0716_2.88	HILIC-neg_Cluster_0066
xanthine	HILIC-neg_Cluster_0187	HILIC-neg	5.12	151.0258	HMDB00292	[M-H]-	151.0258_5.12	HILIC-neg_Cluster_0187
xylose	HILIC-neg_Cluster_0176	HILIC-neg	1.63	149.0453	HMDB00098	[M-H]-	149.0453_1.63	HILIC-neg_Cluster_0176