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-methylguanine	17.1701	0.0277991	0.0204992	0	63.307	12.718	288.785	0	21.2633	49.9001	3.83676	17.8705	18.507	0	106.9	0	0	63.1329	4.34723	798.555	25.1331	137.9	247.218	33.0572	235.361	249.77	179.884	42.6932	292.881	0.0591182	54.2887	59.8704	91.3507	194.607	48.5104	0	206.053	124.956	0.0244175	328.266	90.1934	62.2186	5.70012	21.8919	31.6182	0	165.872	0	210.651	27.3856	7.35586	34.8549	4.38148	0	38.9298	80.0475	232.859	32.3375	14.4647	24.2697	611.811	0	11.9095	0.0206504	43.0955	82.0621	20.6345	16.4747	880.069	0.0290487	5.81981	107.5	11.4166	234.688	9.55761	95.0857	0	0	0	338.92	87.7309	0	173.466	0	83.8221	824.938	13.1904	0	67.3887	83.8733	33.0104	0	175.967	0	43.883	25.2037	78.9617	15.5321	2550.21	0	0.019287	78.1035	7.36032	0	8.80151	0	299.008	247.195	62.54	8.49914	16.8524	74.14	54.9012	12.1238	36.0236	78.0996	0.0927057	0	17.3685	0	25.7112	36.7409	0	0	0	34.9416	15.9556	23.9883	0	88.154	0	213.075	810.953	14.1688	43.2691	0	0	123.18	0	151.321	61.4895	87.9386	0	0	40.9631	8.24314	150.47	14.644	43.23	0	22.0395	18.9558	124.52	241.023	20.4829	631.174	94.9307	99.726	144.654	454.67	400.775	133.514	110.393	196.215	329.08	62.4261	462.795	337.809	404.343	467.266	97.7188	499.832	150.75	248.445	790.414	422.657	391.061	295.335	45.7494	21.4797	165.047	39.7306	208.292	190.975	220.543	34.818	122.879	28.7768	54.5553	56.0759	86.0214	214.744	44.7887	326.741	58.1437	9.2849	820.806	110.567	62.8397	13.5412	10.1457	107.615	192.01	0	0	147.538	64.9908	217.711	330.25	0	18.5965	92.0039	21.073	0	120.4	208.771	19.0111	119.421	246.494	71.9812
1-methylnicotinamide	454.239	103.944	0	0	6.17649	10.087	35.0669	152.784	241.846	149.571	0	0	103.248	16.5426	41.4705	0	10.7161	9.75797	87.833	46.5837	25.0367	9.65934	179.582	21.8451	16.1911	348.688	0	107.945	413.698	0	10.3102	0	0	0	0	89.6118	28.4542	121.537	0	316.327	260.016	108.155	79.3948	74.894	79.6285	104.36	0	328.743	78.5834	105.48	0	78.558	22.6672	28.4246	83.1012	37.1012	116.516	50.3257	8.38761	29.1217	12.0036	114.14	187.095	50.7761	100.86	0	8.8285	71.2631	111.497	395.521	282.815	146.463	295.172	0	146.816	47.4031	12.2295	0	5837.36	28.8935	0	238.045	0	5.90248	21.1918	141.029	239.025	237.192	64.2754	585.403	0	0	329.099	128.187	220.011	15.4164	434.423	158.021	140.749	122.152	0	40.7127	0	49.3714	20.2638	83.5035	29.8365	68.4352	55.15	6.07183	0	45.8164	49.7692	0	0	0	7.57735	0	0	379.731	0	14.2914	136.677	25.2956	0	6.91047	12.1299	24.3382	40.5641	74.2023	240.497	81.9742	132.723	16.3497	85.9642	13.2507	0	21.7709	0	308.575	261.05	0	17.7439	0	122.676	0	74.0578	11.0849	98.7811	112.774	0	103.878	217.104	116.796	253.169	0	22.6145	274.469	0	0	0	23.4275	0	106.805	27.7765	0	47.0922	0	128.774	175.986	0	0	0	25.4165	63.4322	0	0	42.2527	354.26	51.4888	171.083	0	56.8908	0	16.6797	211.861	12.6402	0	0	8.8014	12.1108	12.8836	102.54	22.0442	591.377	30.9486	0	14.055	0	37.1816	99.1779	0	82.684	100.193	0	27.1975	194.31	0	230.002	694.116	0	135.398	632.785	33.3766	20.5003	63.4658	0	0	88.2876	267.929
2-deoxyadenosine	20.7759	0	21.0533	0	38.4573	0	0	0	6.61484	18.5239	6.216	17.9945	0	0	20.6862	36.2914	0	6.5259	8.23837	13.6953	71.5155	27.9163	24.0345	20.768	30.3472	147.734	1663.96	92.4424	180.535	7.41463	25.5551	10.6363	379.11	18.8309	27.9395	47.7917	48.783	560.962	26.2944	107.722	104.632	30.4786	12.7149	35.1493	16.1724	3.56062	52.5439	15.0792	0	4.20907	57.9307	0	9.91526	16.2921	192.658	0	17.3156	80.6206	0	0	8.28024	39.5517	0	56.7146	0	21.6523	19.117	14.9	9.08497	8.85256	8.28672	15.2764	8.06212	72.152	93.8934	0	7.91868	0	15.2345	0	20.9813	302.062	43.7496	0	70.0558	0	2793.94	7.19866	7.81628	50.3586	88.2213	8.11249	48.1276	9.14265	20.2407	47.4941	33.5949	13.8502	6.2283	8238.91	11.7623	25.0066	0	0	0	0	0	0	0	0	29.2066	0	0	26.4743	0	0	46.6933	0	0	0	0	289.362	0	0	0	15.5027	0	21.4508	0	4.48559	0	13.651	18.2259	0	0	0	0	33.2265	0	15.182	10.1177	0	0	0	86.7702	0	5808.34	0	0	0	0	1344.8	3823.74	7272.25	7581.22	430.499	105.698	104.313	62.2569	43.6628	976.199	541.031	262.396	1251.33	14.2728	24.279	42.7983	51.2927	28.9174	24.8455	271.116	5.92582	11.3654	70.4276	27.6952	3238.93	8.29492	9.78899	65.9509	195.362	13.3318	67.8222	35.3877	150.704	20.4691	54.4662	725.696	117.673	398.722	111.345	11.3911	31.9733	42.4704	0	19.9766	28.4213	50.5016	60.1466	280.72	5.81749	51.4882	108.304	146.204	6.23161	37.0213	76.6462	47.1065	186.777	66.4581	39.5378	400.138	76.6041	111.625	42.4645	23.0172	50.5077	97.1666	86.9201	171.028	150.636
2-hydroxyphenethylamine	268.093	33.0793	120.791	393.516	254.946	7449.21	717.918	1618.88	48.8306	7398.91	15.4147	77.39	30.1896	290.376	9.65754	52.4612	162.989	19.4983	208.211	39.137	30.9104	5448.41	83.767	1033.19	97.386	44.7713	78.7013	143.588	102.154	180.104	75.5695	2003.24	62.7172	780.915	77.3734	63.3541	41.6152	23.7378	1046.94	575.301	113.368	130.451	1760.64	2868.24	3293.39	79.2514	641.212	13.3408	2230.67	5532.02	32.8492	43.6484	2025.34	945.766	225.824	184.727	1899.92	587.604	17.8207	64.3468	10630.7	99.3957	2029.27	1223.67	1215.76	30.3827	17.6405	41.0304	7046.93	22.116	220.777	2200.31	3064.32	27.658	99.2704	28.1519	610.331	189.421	328.654	224.318	188.346	141.643	33.4355	200.515	337.423	215.238	1451.03	5418	406.962	762.009	98.7492	364.6	78.0494	1001.46	37.0284	52.9094	94.0801	65.4248	5033.29	136.55	2696.92	4917.24	132.501	93.6819	30.5955	83.1734	121.994	22.7882	818.63	518.254	22.4867	9924.89	50.8917	89.4181	56.2551	30.9417	38.9499	96.1907	335.78	72.6019	29.9255	34.7574	59.9518	33.072	138.926	0	24.7141	81.7117	0	2590.93	3671.85	790.069	232.517	1812.28	61.1771	254.479	1502.74	867.488	83.8529	127.996	109.65	16.1399	11247.8	48.6249	2717.41	686.548	343.316	74.6439	22.0954	349.297	38.2921	2869.27	28.6206	57.4902	13.0648	227.271	282.976	109.537	114.653	23.4802	67.5883	52.7146	83.5505	873.648	101.994	29.3716	41.7954	455.86	153.092	114.623	18.4112	80.5017	62.7673	109.132	142.192	78.977	30.6645	3580.25	3387.47	7539.23	299.989	9.47506	370.177	40.1081	24.146	236.382	34.7032	43.4563	335.81	511.235	105.825	20.1536	120.973	132.843	571.996	32.6271	8.79239	24.5418	129.48	293.234	3122.82	203.999	32.1715	266.462	1423.36	697.353	28.7311	2435.65	128.286	120.81	22.4816	97.9159	229.346	48.1149	11746.1	95.7419	512.397	116.676	153.059	29.8343
3-methylhistidine	21.8923	201.838	65.509	367.558	336.853	180.322	63.4967	175.503	130.662	39.2692	1417.7	369.635	90.2835	57.1758	40.8723	86.839	61.9027	554.584	687.728	2795.15	57.8753	344.251	854.55	212.42	615.108	192.119	97.2309	71.3263	1230.07	408.249	34.9924	202.657	31.5934	788.018	246.505	1432.38	56.1879	384.838	98.0382	35.6234	195.867	509.136	106.714	28.0786	23.809	47.8987	61.0465	211.089	192.262	35.4379	371.995	1035.17	127.828	375.161	196.883	232.345	99.8745	359.72	52.4352	24.7593	381.485	1016.05	859.023	675.002	84.032	139.484	30.7064	454.338	568.326	51.2879	305.983	197.922	29.2983	381.699	44.4059	744.481	720.968	437.929	29.8829	415.961	88.1463	629.854	378.914	96.1085	151.983	27.4433	368.538	412.573	1036.44	846.752	708.752	43.7283	157.003	53.567	322.879	339.967	336.403	280.452	275.318	908.986	609.71	1190.76	126.74	255.17	170.238	181.474	180.481	51.4495	213.067	290.524	526.343	389.111	417.14	127.562	70.7411	74.1961	53.7524	47.5781	23.6943	60.9207	1571.86	33.015	360.681	44.9036	517.309	152.17	68.8612	532.626	277.509	325.559	379.63	167.811	352.573	96.5839	120.604	130.458	1219.29	181.502	208.303	43.1923	246.776	102.851	283.986	53.6347	193.728	58.2698	240.987	299.193	607.806	91.54	31.0879	2471.27	449.777	408.417	52.2922	19.5419	149.135	21.9813	27.2876	27.9829	128.012	27.2019	6.92142	185.71	124.392	118.73	117.481	152.713	30.4493	128.251	29.7041	347.087	70.9097	143.776	79.635	122.621	160.14	79.652	86.7402	217.496	207.717	15.3029	86.6318	1999.6	52.6031	151.647	16.9505	124.121	36.0529	40.6563	52.2912	91.71	50.6524	63.2263	549.246	427.601	66.2852	13.5712	68.5883	58.6615	98.9179	28.4342	22.5099	562.713	1363.47	411.876	16.3537	44.6475	11.9197	513.315	1573.67	22.5668	25.3922	78.2524	272.945	909.633	324.847	252.649	79.3247	45.5711
3-methylxanthine	5.70761	594.513	482.68	41.0858	315.692	222.309	128.149	268.881	580.382	256.891	236.351	266.992	0	449.051	193.617	289.715	265.096	141.437	73.5732	106.094	313.751	17.6152	84.0162	35.7882	0	264.726	112.262	134.316	76.2841	403.865	7.85295	59.5215	0	421.6	196.231	262.057	667.629	0	193.592	683.505	212.132	31.6525	244.876	69.0187	354.137	37.0429	153.991	163.41	39.6399	299.476	31.6085	186.21	238.593	31.5439	26.2133	11.4662	0	115.69	0	55.6486	4.57385	838.685	559.385	231.686	44.8418	50.1889	0	7.47995	14.0125	539.419	849.898	64.5877	691.854	242.38	259.232	0	359.515	601.397	255.387	32.2958	7.79444	517.419	7.4492	54.3128	70.1461	0	173.773	107.616	168.229	146.398	273.245	267.139	42.8545	114.628	456.192	30.2673	883.583	305.695	0	132.067	154.366	173.646	8.35367	21.9722	0	377.249	13.5257	23.0621	910.467	69.9293	0	0	0	0	50.9682	294.015	0	233.887	0	51.849	0	0	136.312	6.62677	198.967	0	0	34.971	98.5853	159.945	831.234	415.361	65.7455	13.6554	42.6071	21.6183	18.7952	0	279.001	86.3223	604.145	0	128.947	0	329.474	0	222.308	0	485.8	631.913	0	42.0823	200.342	249.949	58.4251	0	146.248	770.185	0	159.345	0	5.68205	0	8.98808	0	0	34.9354	5.60579	845.354	227.511	0	10.0584	0	85.5792	252.083	0	3.2034	170.417	676.004	84.1978	7.78131	0	409.267	4.55997	364.817	715.488	299.965	11.438	953.895	0	1228.29	35.4683	0	72.3899	223.474	4.15322	705.672	62.3233	386.668	55.2091	512.371	1370.3	622.529	471.032	527.647	81.8225	0	208.285	676.081	542.556	35.6028	311.608	550.949	179.027	81.3221	113.597	680.627	191.208	862.395	481.707
4-guanidinobutanoic acid	12.848	7.94633	11.7399	46.1612	20.3021	0	23.8968	46.3821	189.427	663.783	229.934	29.8549	0	74.9796	210.724	33.9272	26.5694	217.232	187.79	52.0711	11.2462	135.529	73.8201	122.315	67.8255	249.411	24.054	20.1356	127.78	22.3084	20.8635	46.659	30.9185	187.411	43.5254	6.5951	735.866	82.6734	18.2622	33.5591	24.7986	17.8372	74.3815	119.665	22.8194	525.296	26.5368	724.58	27.5999	171.511	65.3295	56.7077	239.782	74.1466	10.5882	22.0376	27.6865	439.751	9.76003	6.44486	16.4453	175.314	49.2077	8.49882	294.595	64.4682	22.8874	16.7646	75.1013	15.1097	201.085	81.9918	125.574	118.157	442.102	64.234	480.004	223.549	207.75	246.043	38.3646	420.238	133.476	350.199	82.4323	20.5498	48.8572	83.7454	304.912	100.313	146.427	28.0538	70.3582	168.065	301.478	60.4775	228.743	126.951	44.2281	184.555	284.956	87.4132	10.1447	57.1003	12.7298	0	44.3555	0	34.9129	27.9393	0	0	0	23.0341	6.07069	12.7634	20.7143	7.82482	0	18.9686	15.2298	23.6184	104.564	70.0597	55.3335	19.0548	37.3913	24.7874	13.2098	23.9034	28.7122	17.2349	28.6191	52.7867	20.4919	19.8681	0	107.928	51.1241	65.5514	189.904	88.7215	55.3762	0	66.6988	12.2274	81.9279	14.8547	22.6074	82.3129	0	66.2444	95.7604	39.1938	867.009	45.2966	222.459	30.5466	47.4491	34.5524	43.2021	61.8778	80.9902	461.158	65.0769	505.087	102.451	57.982	34.7498	303.397	57.3986	385.439	82.6887	139.676	78.7573	83.1983	30.8859	77.5474	7.42791	220.265	21.1543	67.689	241.281	28.8157	37.0559	123.325	18.5183	51.0247	22.1797	25.8298	70.0488	124.046	90.6892	39.8402	87.2338	323.556	130.486	348.746	22.0475	108.068	133.454	48.2977	724.44	13.6316	12.5892	74.3969	233.247	36.9237	16.853	31.0205	20.4621	236.252	18.3111	27.2234	27.484	61.5459	61.4335	155.554	23.3596	142.061
4-hydroxy-3-methylacetophenone	142.129	91.9306	142.669	164.544	35.4285	28.9933	64.6253	87.4351	43.3796	10.0346	31.8355	83.4285	160.358	138.3	52.3007	249.869	114.912	143.315	0	35.0767	91.3003	2.70173	147.961	92.5354	128.221	108.555	162.189	185.585	207.61	123.399	195.435	28.5853	111.382	99.839	228.194	92.1451	365.66	47.8221	324.974	228.752	150.554	139.634	10.1555	21.5624	20.8373	28.0311	142.735	11.3995	29.4307	9.4646	32.0072	190.918	24.2905	9.70046	27.5855	128.923	0	14.1282	247.197	156.299	0	109.285	41.9167	48.0456	63.7361	69.6523	59.7389	52.6183	4.66352	150.56	40.5607	137.329	87.975	45.0116	36.0876	0	27.0016	66.5796	46.0053	13.3397	82.819	148.734	115.233	214.059	18.2694	0	0	50.4044	35.2745	0	49.7036	117.868	116.765	26.3459	34.1835	41.0561	127.016	180.217	78.9091	34.411	63.1119	0	77.1084	85.0445	76.7505	73.329	81.0144	22.2004	23.2103	65.0392	208.256	130.756	256.806	40.6959	237.418	65.7828	141.175	134.819	169.519	96.1216	262.349	249.417	559.259	27.1262	61.5699	95.4712	97.1728	7.78375	0	44.9098	68.224	161.146	14.562	84.3068	20.4929	74.767	119.574	19.1605	141.508	35.7949	250.04	163.765	136.365	263.782	35.335	120.318	20.4029	345.901	186.45	53.637	72.2251	25.5496	26.4875	27.998	18.3351	60.9422	39.0482	22.6359	92.5292	106.214	144.635	82.3596	113.822	57.3247	94.8303	71.5379	116.667	160.977	109.525	50.9671	54.7372	70.8486	60.825	25.2	152.186	59.6558	39.5243	36.3516	162.684	9.8803	51.6041	73.1775	54.372	30.4603	28.7073	50.7975	54.1216	28.7359	71.38	75.0696	36.6516	41.2668	37.5008	0	68.9259	37.0956	32.2189	33.8393	89.5609	24.9223	71.7605	102.968	113.339	61.2403	77.3488	28.5103	53.5511	58.916	46.8082	153.429	108.559	18.4441	100.598	10.0767	4.49325	60.9702	64.8076	12.761	27.101	51.5786
5-acetylamino-6-amino-3-methyluracil	431.897	93.1153	128.008	49.7	9.91597	197.689	31.7262	55.8851	398.164	55.9868	75.9964	130.648	17.6778	72.7122	20.744	42.5448	143.094	39.2638	17.0911	0	121.96	0	63.4076	43.0405	39.6393	55.5934	84.1128	63.5829	469.725	634.706	353.69	0	329.992	489.157	490.135	93.8634	74.9586	4.64773	10.2459	291.7	201.425	201.443	19.2386	0	65.5556	75.1584	9.09774	166.711	0	74.9955	0	840.244	20.736	0	0	147.151	14.8255	7.09597	707.7	9.03773	0	351.35	151.227	26.2645	15.1006	184.77	12.9346	266.274	0	131.739	110.529	38.5665	82.5784	18.7484	323.905	0	67.1246	160.169	53.8633	18.2976	796.817	85.1741	429.374	0	17.4852	127.098	50.0877	8.5692	43.4075	144.816	47.9587	459.839	224.648	0	416.045	10.3999	182.554	189.989	0	214.993	0	0	145.792	0	72.6417	209.733	0	0	326.804	14.7463	364.419	0	139.98	601.73	23.336	70.604	314.248	508.578	46.092	0	62.9612	461.391	30.783	40.6626	10.4015	105.602	26.2523	0	64.9616	18.0411	238.308	117.963	0	0	0	0	0	0	25.2163	42.8364	68.3424	153.459	0	47.4222	53.7858	8.76934	57.997	87.316	31.5924	165.561	0	0	169.243	70.0507	0	569.389	3.4603	461.955	588.176	88.7072	142.19	610.999	636.992	14.8497	1034.99	207.746	120.762	246.557	705.866	201.953	563.681	604.672	657.848	56.5265	613.953	566.585	419.659	0	1017.13	44.463	83.9596	1528.76	207.822	163.857	66.3668	692.763	200.986	4.97394	759.549	0	499.311	36.0375	321.114	14.3116	449.434	14.6702	158.526	98.8625	731.009	68.8383	370.054	578.973	289.322	253.642	675.629	10.0768	435.497	75.7249	777.092	1744.49	221.745	93.7771	248.85	109.035	72.4035	4.31115	701.864	13.4589	1063.76	998.88
5alpha-Cholestanol	41.9683	24.1424	230.782	515.423	0	0	0	246.045	0	0	0	21.6998	180.709	21.6181	0	393.938	125.301	0	0	71.0517	90.5187	0	0	105.554	200.715	106.552	13.3809	131.091	25.6572	74.602	116.641	0	180.734	0	95.2448	140.717	52.9809	21.225	374.171	106.859	10.6043	88.5456	0	0	33.6875	0	237.847	0	0	0	0	266.805	0	0	0	84.6974	0	8.33743	112.786	303.045	0	0	15.1416	55.7637	0	177.159	83.8463	139.736	0	149.986	0	0	140.312	0	0	135.22	0	4.54806	0	0	287.273	38.0431	72.0459	206.715	32.8706	0	0	0	0	4.46508	15.6706	135.235	104.272	0	11.4297	0	48.2935	257.396	16.6141	0	0	0	102.39	0	174.134	149.003	0	0	0	0	239.426	0	147.997	129.035	76.8088	0	165.838	0	151.527	122.958	537.728	248.818	0	0	0	207.6	21.2791	0	0	0	0	0	0	0	0	0	7.77866	0	0	0	0	465.425	0	262.915	101.767	162.964	0	483.977	0	0	103.856	69.6693	142.88	112.797	0	86.8472	195.211	139.799	241.23	137.628	265.823	192.364	511.321	149.753	149.211	299.819	44.4966	298.573	137.175	111.349	188.093	237.264	110.382	0	162.593	39.4358	90.8039	0	159.98	0	90.2875	237.561	0	285.328	0	2.20286	168.314	0	0	170.852	0	178.097	132.634	0	260.28	81.8258	0	40.3957	342.574	1.94612	1.36069	4.80249	147.255	182.835	53.5329	52.1432	30.3841	69.1892	133.272	145.485	246.725	6.44748	300.858	18.3097	0	341.32	14.9977	36.8295	0	0
7-methylguanine	18.1549	975.084	1339.96	1026.95	2814.09	1097.78	1412.11	2922.87	2110.13	2080.03	1128.91	2400.26	8.70935	1691.62	1592.36	1333.2	2855.4	2093.69	1525.93	2023.98	1879.99	706.266	522.476	506.236	1070.59	4310.73	4972.48	5119.53	4347.78	1132.73	545.265	1094.78	474.339	4058.19	4052.8	1452.24	3836.59	1437.82	2917.33	1772.6	3802.67	775.427	834.074	1515.15	1132.38	486.123	1268.87	1892.39	489.814	1676.25	742.884	95.8094	1157.94	1668.09	694.223	48.0106	569.487	1805.05	9.74168	3290.42	441.588	3666.68	1893.43	1202.97	2288.81	498.669	91.2696	438.503	1761.45	890.79	1394.71	2295.61	2057.46	2327.53	2547.32	69.6265	1692.3	497.267	2002.12	488.663	413.558	2176.51	1153.01	3302.65	988.276	1570.45	361.874	794.722	846.9	1501.79	2132.39	2717.85	520.781	1488.78	2024.29	586.812	1836.57	391.604	2422.92	1694.04	1732.67	2429.15	21.6303	1131.77	22.445	2325.45	1188.38	2263.64	1119.82	1264.79	0	28.1153	75.0887	12.8018	3177.47	4558.39	14.4592	1939.22	31.0613	3535.14	15.2414	18.4242	2672.94	420.359	1923.57	11.4786	2511.08	726.35	727.685	1403.23	2421.61	1437.33	1569.44	371.01	1606.03	968.747	1310.9	1180.15	2541.69	1564.08	2365.67	105.794	766.128	13.1874	2065.24	8.46775	1280.81	20.4331	1779.88	2477.71	0	636.38	2148.4	1042.32	1533.91	889.185	94.5015	3047.81	265.771	1601.84	904.623	487.639	311.704	782.238	1136.34	120.585	743.043	440.53	3820.16	703.458	76.2182	895.546	483.412	1561.33	754.031	805.803	693.507	1560.19	1056.91	1863.01	205.938	49.7773	2941.92	510.701	2451.86	1347.32	2506	1467.79	2032.46	25.9144	1711.47	759.611	166.3	891.033	3479.04	62.0526	2212.44	3830.75	597.231	1395.12	1209.97	2902.08	3496.91	2058.33	1406.67	2187.71	351.791	2472.15	4528.02	3644.8	48.0615	2882.04	2051.84	1793.32	354.74	1767.54	692.566	1623.78	3256.92	2214.57
8-hydroxy-deoxyguanosine	9.62358	220.524	42.5412	100.872	88.6512	0	0	28.6084	63.7001	501.297	25.9757	13.5278	59.5484	728.852	81.1845	41.4088	10.5736	38.8431	9.71634	293.9	103.38	2.54301	155.212	229.133	806.901	334.176	77.5147	1045.41	91.4917	17.9348	60.7599	80.5103	36.0752	32.5961	684.949	65.1416	93.2509	494.479	13.2307	79.462	1058.44	68.169	8.97586	27.5702	38.6877	0	46.0081	0	502.862	13.2274	224.465	129.365	24.2294	33.6286	107.608	946.802	440.386	388.548	8.35983	232.318	0	22.716	60.1272	146.27	452.389	45.6255	4.75548	36.7494	0	43.3102	51.6329	485.846	74.2702	722.364	56.5197	116.451	220.145	7.76297	75.7493	37.5417	28.9408	34.005	94.1006	64.3841	712.79	25.038	84.2717	15.8996	353.789	614.453	9.7901	11.5982	906.621	59.7153	73.5849	607.797	1890.78	237.85	39.9093	347.576	5.48723	24.6111	263.04	334.427	10.3337	15.3538	174.375	0	29.3569	266.584	96.4913	0	2289.86	56.4299	253.967	124.226	76.2701	969.441	207.96	87.5079	485.046	15.2078	482.582	111.529	32.9399	50.0882	528.43	188.328	0	67.8429	195.503	82.4179	930.431	151.663	71.028	131.694	751.602	0	160.993	812.681	12.4533	95.1627	14.9211	0	25.2037	113.28	165.818	70.8343	90.8579	215.629	20.401	17.4812	133.094	327.862	482.915	87.8044	124.824	84.1824	174.486	91.8985	72.5133	47.5311	164.935	125.542	153.943	2283.8	609.475	96.5086	78.8449	938.353	132.828	399.245	47.2903	1083.45	192.937	1073.62	70.0919	51.2117	1569.01	316.306	32.3613	882.126	3020.24	477.428	387.536	1273.99	12.9698	1512.99	67.3555	31.8173	47.1733	171.158	1475.59	345.103	114.738	41.77	80.9703	577.904	24.4229	942.409	36.8733	297.095	147.158	41.4823	55.5934	888.232	6019.51	37.9273	104.725	33.2643	1588.56	554.807	2732.42	43.176	2.75853	31.147	27.5153	110.367	330.52	2638.9
acetylcholine	1478.75	512.132	1636.81	1313.56	29447.4	1893.5	89.1813	582.085	645.423	386.402	804.051	1349.93	735.809	1044.44	574.164	11005.2	2890.98	740.536	971.556	79.5558	2242.38	31.0375	1748.78	2359.2	26408.4	16473.2	2686.22	1166.48	1366.82	3568.25	5620.78	77.8995	7203.81	998.744	13685.2	1394.94	1880.99	303.008	25536.9	422.412	662.424	1131.66	496.977	4195.8	1915.38	2449.46	2531.87	73.7648	116.335	0	164.353	8046.3	1399.16	961.18	0	10096	7.58964	198.77	589.942	530.486	72.2223	1644.28	2126.55	152.247	1511.25	31879.9	229.943	2968	18.2112	3285.25	168.293	828.671	3616.52	481.658	1025.61	997.892	1595.31	1856.33	2428.66	8.33014	302.833	2674.56	241.986	1394.83	699.887	91.7078	422.982	3148.45	671.649	26.9738	1402.33	7832.55	1159.18	429.559	1095.14	73.1411	4078.04	8603.51	108.048	16943.7	1058.06	22.7705	1612.75	215.699	14671.9	1430.49	32.1083	26.0019	24.8835	317.792	2428.46	159.111	1726.17	53.7534	3117.96	487.554	4310.57	653.529	15.3314	2258.92	683.272	2598.3	456.312	317.065	154.294	708.993	25668.6	23.6194	34.7037	1406.58	73.6805	680.159	23.0327	157.432	58.8864	155.903	2403.18	402.799	993.841	432.241	94.8698	14632.4	39.0934	9635.83	11.3185	42.8542	25.5778	1306.45	618.195	621.662	18.1375	1454.21	377.328	173.391	3470.11	289.222	735.671	5692.56	4287.57	2187.26	6902.19	20.2598	82707.6	2961.41	3670.08	495.354	4333.48	3822.54	1682.48	471.936	129.091	3656.37	0	1388.49	479.557	213.565	2401.74	75.9112	391.142	9.34171	1713.39	284.25	254.557	21370	1072	30.2859	574.406	52.6598	290.958	1003.93	2078.55	1073.33	1809.7	15.517	630.181	957.645	126.901	2030.21	533.082	572.271	328.537	125.131	2062.35	1308.99	694.312	26.3178	1055.54	1632.93	3411.15	3363.9	3280.97	2598.62	682.422	149.249	73.3541	659.672	214.132	48.7053	3071.8	921.716
ADMA	57.9815	24.2795	214.326	254.629	622.014	2777.64	295.103	196.258	307.907	1072.23	824.669	211.31	65.2997	64.754	484.476	183.35	402.397	660.968	744.077	600.697	30.7485	1321.84	599.154	661.417	293.396	634.44	267.009	86.7608	814.988	121.335	103.244	1178.5	87.4546	347.37	227.531	186.601	236.747	576.241	84.8388	418.704	266.23	492.103	1452.62	521.851	4338.75	237.359	382.306	2356.2	3062.32	4137.28	1487.19	189.266	3609.32	1671.91	2451.4	110.902	840.363	488.609	32.027	80.7266	1622.15	1602.7	316.24	288.106	386.021	135.792	54.5456	209.904	4105.97	105.131	317.253	455.861	532.117	464.513	456.918	6699.31	2139.98	640.618	1058.21	4796.88	30.7441	1080.14	96.6149	89.43	5131.11	968.049	894.086	1704.52	190.632	3079.17	668.557	273.524	359.805	259.837	593.453	3738.55	773.128	370.028	2722	757.985	368.342	260.694	66.5514	70.816	46.6699	43.9094	233.318	441.676	994.946	723.273	105.495	839.286	121.225	61.4681	198.801	62.0278	83.136	73.8002	19.7737	112.749	117.131	177.215	154.804	43.5989	252.334	56.818	44.757	1267.8	1222.74	1881.77	2041.29	1985.29	2233.09	472.475	304.141	63.9421	23.5551	1824.05	237.097	2623.72	2018.27	64.672	849.676	27.2142	2249.9	22.5026	1045.4	30.5671	995.498	193.079	24.4141	1787.46	330.569	378.538	240.416	69.2087	414.803	152.117	148.423	245.1	264.604	133.387	49.1779	386.343	231.046	232.251	517.972	300.458	222.039	530.422	88.154	285.377	113.416	236.644	425.304	339.469	283.147	226.345	306.406	464.631	402.824	112.77	805.962	152.49	116.974	398.751	312.887	544.928	64.5237	93.2109	951.073	200.117	483.785	1914.83	165.408	204.339	1319.35	462.54	215.666	592.645	741.883	242.808	446.864	171.36	253.524	454.061	400.586	349.748	85.6322	598.142	162.026	229.046	222.373	83.6988	1510.93	172.661	264.214	1868.66	325.269	232.778
ADMA/SDMA	17.5049	13.3169	108.207	928.125	2464.11	1295.21	161.65	950.378	873.779	255.016	1183.1	135.986	31.8602	43.5552	383.58	50.4014	953.119	1042.88	1150.63	556.969	28.1178	430.338	1059.78	977.173	327.687	2018.96	392.631	212.659	664.02	71.8348	99.8942	392.861	56.1818	177.072	138.561	215.02	142.265	820.576	82.4607	225.242	306.784	473.733	641.984	1154.06	1189.44	732.378	169.492	1020.42	731.052	1238.98	538.423	167.474	954.04	1039.53	732.284	49.0859	301	859.912	22.4127	39.6425	395.503	1601.32	208.143	101.053	1075.32	108.714	27.2642	111.415	1305.19	139.366	905.097	1372.13	1635.35	464.58	1018.54	1231.36	907.55	1492.42	2021.85	1448.91	10.2298	342.325	80.3867	22.8304	1136.29	626.474	566.878	828.806	347.915	2649.78	1130.52	107.043	209.942	62.5086	1129.05	894.933	1346.58	753.9	821.52	2003.85	865.641	451.911	27.0564	257.595	39.0994	25.0459	362.387	220.314	245.068	478.572	47.9026	447.795	87.991	35.6214	954.767	187.911	48.5577	52.6435	13.5179	48.5212	441.281	59.7436	507.545	193.194	290.808	24.8922	16.1582	880.72	293.98	973.642	683.13	1197.36	1397.18	214.975	182.064	179.667	41.146	568.592	466.634	1172.52	1568.88	41.1991	401.414	16.4441	1040.27	14.2899	911.719	26.2369	945.647	717.954	14.3831	845.574	311.785	453.352	167.665	25.6646	1952.89	150.09	171.587	160.203	163.214	107.287	57.1318	342.04	284.34	113.264	680.771	363.176	129.911	3008.56	43.3589	325.289	82.1727	263.504	1010.86	87.2746	654.088	589.342	380.491	731.871	248.285	61.5713	929.433	134.388	44.9969	1021.71	1520.84	717.832	18.2489	43.5169	1299.86	402.184	1714.38	563.426	152.983	201.19	967.84	1517.1	277.274	964.981	740.089	138.572	161.808	238.428	200.543	1416.28	152.436	225.788	54.1431	528.053	93.8009	704.699	223.389	43.965	241.03	124.613	154.271	1293.29	303.066	162.792
alanine	2869.15	328.574	2995.69	346.473	1646.81	1235.53	416.896	899.552	1792.71	1297.85	1834.34	2823.18	310	545.988	1720.59	2586.55	2190.72	2349.11	2777.5	2694.4	3604.28	4461.61	3049.92	3193.39	4455.64	2223.1	3239.43	3156.08	2095.88	1521.69	3162.05	4368.42	3671.66	3284.63	2236.94	2980.45	1850.54	2204.66	2726.57	3623.63	2722.75	2561.38	3523.32	1269.35	595.59	1269.93	2122.2	946.77	3147.98	599.961	5221.22	953.803	4631.94	3094.5	4048.39	1311.8	2948.28	3639.54	383.063	1087.26	3955.43	4049.08	3466.17	2654.23	2511.17	6874.69	1568.96	2015.22	5466.67	4170.7	1210.03	877.244	1318.52	3306.08	2046.16	5303.93	1841.07	2298.05	1962.8	5669.1	2037.64	4835.13	4757.07	2780.33	6288.49	2015.84	1410.71	987.899	1521.52	2965.48	1726.35	2013.16	3287.57	2653.8	1555.77	7620.67	3299.53	2333.64	2320.61	833.259	887.717	1937.17	345.067	362.492	620.204	351.609	726.882	1215.84	810.578	680.009	144.612	6217.16	388.945	328.257	1840.98	522.458	517.026	1812.63	1382.07	768.89	198.961	519.927	336.058	156.199	339.298	1024.31	1901.17	3021.28	1637.14	2503.66	1916.99	1346.26	3863.51	2667.9	815.287	1711.42	487.294	3433.44	422.421	4667.8	3350.41	2711.2	246.612	1227.46	2268.13	537.743	1146.29	1100.19	1176.9	238.634	64.0294	1125.8	1425.61	1620.53	1309.98	3882.81	4804.27	2421.3	3941.15	3210.43	4157.03	4087.26	2503.69	4502.8	5064.56	4843.05	2919.28	3185.75	2190.26	3879.46	2015.85	4185.05	2748.2	3593.82	4013.12	3739.58	2028.06	2149.43	1284.38	2606.49	2536.02	2194.07	4432.07	2405.97	3620.42	2651.7	1803.14	1880.46	1760.62	4005.59	2278.24	3953.57	1670.12	1963.29	1894.23	1248.24	3220.94	4235.84	3084.3	1500.54	1704.54	2026.03	4088.38	758.026	3452.76	2133.68	6156.11	3061.61	2281.96	2639.53	1727.71	1550.58	2379.12	2180.73	4195.39	1553.24	3521.13	2866.81	3061.79	1669.27
anserine	5.47245	82.8438	13.1862	32.2108	14.4243	144.778	22.8318	10.3103	34.1582	0	176.404	38.0488	64.3708	80.623	4.80805	8.63724	16.2649	214.588	39.5819	2771.14	3.45548	2027.06	21.1659	72.4015	17.3733	30.2171	0	22.8598	66.2564	14.5163	17.2826	85.4702	8.97551	547.876	69.4669	67.3316	4.74239	17.0642	27.3429	0	48.2459	15.4749	14.489	20.5072	70.9354	6.80961	5.55206	32.1712	6.70575	28.2127	144.487	130.578	29.7572	26.9502	0	45.3623	6.06135	81.9666	172.028	14.4561	46.4077	126.703	51.1071	4.79549	27.5263	19.8517	28.6688	20.6243	46.9165	11.4953	276.549	92.1554	4.52721	186.365	15.6634	5.88561	39.3377	6.49133	0	19.5109	7.96904	6.90665	12.8686	149.481	19.8748	7.44841	47.1228	14.624	107.173	6.08117	13.2824	21.2403	24.5814	15.6639	6.91516	23.5951	11.8701	18.124	51.2297	14.088	206.502	1146.96	74.8991	36.0329	41.1977	153.57	54.3551	14.5287	47.3746	44.1805	157.017	249.471	61.5626	16.034	21.3393	0	28.7617	37.3472	39.9751	28.1872	87.6933	9.94387	20.1621	4.58494	95.7728	55.7279	15.8933	112.782	52.2028	488.336	113.713	41.9007	424.513	5.44071	44.3679	87.9943	152.405	26.2658	44.9857	13.5751	35.584	42.6666	15.3002	29.2522	20.8962	18.0518	14.1226	20.8272	181.331	38.51	12.11	1484.36	27.5803	109.575	21.0505	10.309	16.5747	4.70998	4.16359	4.61604	21.873	0	0	23.5002	28.3809	0	33.7787	58.6151	5.02676	7.6195	7.66357	20.7948	43.3641	46.9378	22.2094	19.9919	16.4918	30.8268	0	13.1089	0	6.69358	36.0286	107.1	0	52.4503	0	16.3678	5.65125	0	0	6.02466	3.76011	24.1889	22.129	0	20.92	0	0	34.1256	68.4688	0	0	14.3855	21.6434	37.982	0	12.3088	0	6.25855	19.0292	3.0661	0	0	1068.59	27.959	25.0626	128.707	6.27088	17.507
arginine	230.258	1185.44	404.612	952.293	395.688	307.9	1114.4	135.021	3169.02	849.462	923.657	938.847	4366.66	2840	1525.61	953.052	71.6026	8106.66	3190.99	700.27	89.3657	60.0454	6460.33	2210.12	12454.8	6318.06	1537.37	1486.81	7721.03	360.377	854.341	8209.86	2438.41	672.731	3527.02	1078.54	4024.01	3848.59	342.993	1119.55	2046.76	1305.5	4552.17	333.758	115.387	605.662	570.663	3738	3135.84	17.8901	9708.3	1425.32	11741.9	2764.86	2902.74	2763.25	26679.5	300.56	415.442	739.274	3545.05	3957.71	188.777	222.246	511.66	1744.96	318.682	623.766	9158.74	534.315	190.798	2835.21	27.894	9868.59	119.266	6126.25	291.059	84.9213	874.847	25965.4	630.573	9824.18	3443.27	112.205	16602.8	4409.71	11957.9	1115.11	2215.34	22068.2	1019.78	33.7766	5481.93	461.145	242.305	5952.02	441.543	301.352	1973.48	11889.1	438.607	2387.4	817.951	2934.06	413.989	353.109	3127.71	1512.55	3798.39	418.866	874.312	489.02	1407.27	763.908	2454.69	2667.91	356.582	1560.74	783.479	1682.49	1271.46	1155.5	2302.81	133.519	2119.38	2082.13	3092.69	8316.47	1813.88	15554.3	4232.32	10490.5	56.0478	279.536	500.593	2280.72	254.248	21520.8	2389.04	18843.1	3898.23	5104	1680.51	962.572	9665.07	223.107	16139.2	2218.96	1820.41	1389.39	841.339	2012.71	18511.8	1429.44	16087.1	2655.67	3830.24	5314.15	3981.26	1004.68	2890.59	2084.64	1092.93	3864.88	1248.96	11112.7	1774.48	256.311	2212.41	9826.5	2457.66	5067.95	2289.05	2088.67	3218.6	5196.95	743.843	179.814	2184.48	1549.32	407.842	1541.36	4830.27	1005.83	10745	16850.9	1294.75	558.776	2576.22	1477.82	1032.57	1379.83	3424.14	10459.1	407.878	1039.67	3291.54	8622.45	1590.64	4923.28	2286.87	992.4	838.497	377.533	839.043	980.404	23269.1	1231.43	317.517	389.134	2216.46	1879.04	988.319	590.129	79.716	2107.68	4914.64	5553.03	5188.17	3313.91
asparagine	602.649	5.49749	6.97489	0	13.9079	157.54	0	0	281.077	17.0753	112.206	23.2802	0	24.2126	119.025	11.7183	0	82.8675	56.0937	275.881	441.467	6.1014	106.729	132.714	15.3422	48.0464	328.08	155.741	23.8954	0	5.95066	2492.3	42.4564	51.1725	0	275.973	5.3625	489.78	0	11.2689	0	32.5906	9.77553	12.0102	11.7429	0	0	0	0	0	395.767	30.9394	435.646	273.343	62.4261	445.46	2008.76	604.114	0	101.471	4756.76	188.517	9.46663	173.547	1703.08	18.1783	13.8667	4.28274	4621.15	7.35077	62.7369	55.6523	35.8909	1191.02	5.9043	974.64	17.4171	0	859.949	181.676	0	137.414	13.5299	59.3015	160.774	425.728	9.00253	72.2325	23.9909	1292.12	183.241	0	1347.54	6.40828	4.28873	4405.06	974.666	254.251	2559.06	5.92708	38.5423	42.5163	0	0	75.6137	9.81386	0	31.2803	0	54.4956	0	0	0	0	18.0409	0	0	66.2077	91.516	0	0	0	40.5074	0	9.89565	328.492	299.775	186.78	0	418.534	0	8.9811	216.836	27.3745	0	726.686	6.77665	2620.75	0	3341.16	31.417	278.565	0	29.4637	14.8069	0	23.4584	346.13	33.779	15.5147	0	100.219	69.7235	69.4812	26.2571	42.3772	71.1153	140.645	7.67515	0	27.5538	0	13.4349	21.402	7.60024	1229.63	344.077	0	6.51853	929.263	10.6337	31.8985	15.9064	37.8654	17.03	15.3538	3.96444	126.757	137.757	29.9849	8.52402	14.3203	1918.32	17.0282	681.64	29.8104	0	418.267	86.3102	151.468	329.467	574.015	241.068	1151.68	68.4549	21.2874	56.231	278.297	7.01241	207.686	62.6681	20.9045	230.48	0	76.0221	516.278	2885.86	88.901	5.25062	5.14311	53.2589	207.678	200.753	4.48703	70.0624	7.10172	642.556	16.6495	127.113	250.677
atenolol	0	0	0	1035.21	0	13.3374	0	73627.3	100.361	44.7147	26.0326	0	0	0	631.811	0	0	1470.59	28.8916	46.624	0	488.51	23.1308	19205.4	10.2401	88.2341	0	9.96307	0	0	0	126.865	0	494.224	0	10.061	0	538.941	6.58177	0	11.887	0	0	15.8926	43360.1	0	61.3842	0	0	0	1329.24	0	8.65408	1952.36	13.2716	0	0	807.525	0	8.19787	0	0	11.2719	0	2377.41	8.19435	0	4.24944	20.531	0	20488.2	630.651	5.45059	148.783	319.593	0	28.8771	5.73699	57158.9	30.2101	0	0	6.00179	0	11.718	8.27806	117.568	17.0249	5.84186	0	108.335	4.0424	106.87	0	12.1251	69.2808	316.549	155.522	6.62027	203.783	45.3452	77.8191	0	61.0093	7.49729	10.1149	200.197	0	15.4866	5526.5	0	0	0	0	0	0	0	0	0	0	0	15.549	0	0	275.451	0	34.3623	761.957	0	0	0	0	0	0	0	461.843	0	15.894	362.609	12.257	371.45	0	445.057	16.771	7.87871	0	179.841	0	0	758.44	0	15.2214	0	174.197	0	0	0	0	0	20.915	0	0	0	0	19.3141	0	1062.7	10.5963	0	47914.7	14.6445	0	0	37.3789	16.6072	6.08726	75223.6	931.214	5.57314	275.174	8.4772	0	231.671	0	0	3.79068	0	827.338	0	0	1923.46	951.33	0	0	31.1306	0	810.016	35.8355	0	594.887	251.932	43.4848	9.58815	0	0	27.8385	0	4.30288	4.50279	0	0	121.441	3.84264	0	0	0	0	773.149	0	38.5782
beta-alanine	52.3486	0	46.2317	17.3103	76.673	41.8666	0	70.9954	326.429	1660.27	232.986	50.9207	0	23.059	293.527	54.0302	73.6073	653.261	579.216	597.381	67.1765	593.036	67.3784	208.647	127.283	48.3105	53.011	59.5425	67.5645	71.6968	70.8181	340.791	64.5836	136.36	41.647	60.9334	38.762	53.0167	40.7761	70.9548	168.014	45.1136	537.02	1379.13	2425.28	433.35	43.3947	0	0	2239.28	537.935	28.9986	658.724	457.106	51.3282	33.7684	26.046	649.478	28.5274	20.9113	48.3041	129.61	774.471	57.6577	212.945	134.242	23.6129	41.2961	0	76.5968	1121.87	161.348	27.4577	193.738	533.732	1121.54	307.382	66.2816	109.144	203.705	30.4966	77.2419	93.9573	38.433	1137.62	9.61782	441.547	0	668.158	70.785	110.582	27.4813	61.5037	17.4799	28.3571	517.319	66.8446	43.3679	15.1652	10.4585	889.55	160.846	15.1176	0	0	8.72952	0	0	152.561	190.158	23.9783	63.5294	12.9343	14.851	59.531	48.8177	16.9679	29.4892	12.2894	31.4463	34.6026	27.1371	40.2049	0	103.736	6.17035	17.5169	347.583	0	444.589	0	21.9583	14.2501	36.3096	0	194.332	0	25.3092	0.0692786	161.52	478.968	46.0114	15.6158	6.73932	462.639	5.65318	105.108	17.6875	78.9138	176.272	0	111.808	41.5074	161.716	13.6261	64.3719	1077.3	17.5679	59.1223	115.131	76.8747	65.0699	34.2758	95.0525	97.8264	112.598	89.2219	102.936	42.02	62.6317	33.403	65.7245	44.5451	1059.45	58.2713	81.4134	41.921	356.443	28.9616	460.825	28.8794	22.2432	694.03	84.1816	53.4342	0.13828	24.6031	667.526	24.4243	49.8935	55.8589	90.8177	24.782	14.4537	24.572	15.3659	322.377	78.8368	40.5617	125.21	646.159	184.675	86.0378	14.2314	66.6286	63.9743	117.62	71.5629	28.2454	34.7163	10.8678	84.5568	24.1494	98.8577	63.2968	29.9596	48.4954	522.89	72.1431	93.1131
betaine	30.9868	63.0215	1174.6	144.991	0	49.6849	9190.69	2622.26	308.799	36.1896	113.456	142.462	543.567	132.431	663.447	48.0514	0	74.8592	1147.01	2086.57	0	15521.7	297.895	854.344	1808.63	451.432	299.828	0	691.053	52.5926	246.653	3663.47	552.827	2206.14	224.399	173.588	1879.65	612.941	160.992	1398.22	139.409	521.57	40.3799	94.0943	200.077	108.573	484.83	16454.7	8452.76	654.536	5421.55	1479.86	2394.02	260.613	4664.95	167.769	5898.69	1608.29	0	345.11	10721.1	4875.42	235.653	83.7733	923.166	228.554	4289.56	1504.16	14560.3	105.675	206.837	204.162	0	71130.3	251.054	18273.6	238.237	192.735	216.953	10992.6	147.366	793.783	0	234.657	4589.93	10676.3	91.5035	269.566	229.403	6930.81	298.759	1771.25	272.596	143.776	83.8828	3570.8	119.107	128.053	12076.9	235.447	70.5197	438.417	117.185	802.735	165.263	422.434	1935.8	8232.12	285.061	775.097	576.894	3733.25	893.816	346.566	137.247	217.466	332.438	1267.26	271.281	335.944	233.169	593.366	269.279	45.7601	1137.31	403.638	218.604	2427.2	4675.65	78.1306	4167.05	336.027	3554.54	319.049	1602.64	836.465	184.065	27387.4	388.771	11767.5	902.061	9299.11	582.703	368.656	13356.7	635.329	1954.46	235.923	392.545	350.85	247.19	208.206	106.04	939.198	212.82	450.508	0	145.593	302.545	524.875	496.572	269.741	285.887	208.694	1568.1	220.468	571.734	1301.15	169.494	122.837	84.2933	260.961	0	89.1532	434.76	968.552	162.368	478.509	273.157	164.388	2317.31	258.203	72.1531	317.071	131.102	516.536	133.882	569.869	35.589	530.683	1833.41	999.571	227.274	12843.5	46.6802	348.743	2422.6	0	469.27	116.233	127.687	208.394	543.373	251.475	147.433	412.284	203.118	1158.22	67.7003	363.684	345.991	54.4296	346.447	316.176	1178.2	76.5085	700.391	1216.44	50.8117	545.222
bilirubin	354.803	1055.21	248.617	6957.91	49.6406	2457.8	839.922	102.941	859.125	3792.64	1041.03	618.699	3010.72	788.494	539.332	343.461	326.634	707.444	18.3714	5036.26	117.292	30.1545	788.187	2076.21	230.225	38.1526	1130.6	587.64	1209.85	2814.09	1106.37	2899.98	103.718	1684.14	248.206	277.432	97.0144	844.845	83.174	667.866	1178.68	261.7	1865.6	194.076	1002.96	852.858	691.635	1120.15	4676.28	70.6744	1559.53	1806.83	2352.43	558.291	253.251	5037.87	584.152	4465.53	1760.43	815.599	2313.32	1275.74	847.851	250.02	1537.4	793.58	93.4122	134.169	1927.52	2185.14	3706.85	1291.68	1478.58	150.881	0	15.9328	6005.8	791.7	1246.63	1810.59	76.226	888.437	393.719	1736.08	210.811	2520.1	995.872	2295.5	5573.72	73.0085	454.269	304.708	531.198	1149.65	2460.01	313.332	1603.14	528.173	4890.38	5886.87	397.732	459.466	1272.37	6841.34	172.945	6824.31	3671.92	12311.8	10488.3	3786.6	654.802	13797.3	253.501	941.581	1184.98	174.224	174.049	19096	7883.24	2232.78	306.287	442.782	1993.87	130.126	1657.79	3097.18	1102.4	153.786	2059.92	540.374	64.3515	900.902	8381.23	7309.73	8573.05	5646.17	1613.03	2037.84	5958.33	1435.17	3946.15	2245.3	984.77	2985.39	353.393	1286.73	767.356	565.9	423.506	2281.67	304.036	5733.14	178.743	1069.98	918.677	402.272	57.0202	160.09	632.915	568.598	650.655	140.253	99.4436	104.172	244.99	540.553	1242.91	358.664	410.063	234.18	509.728	1532.62	122.314	507.213	822.823	291.986	42.8879	2398.92	561.185	1036.7	168.345	120.929	216.745	315.135	654.102	2264.3	323.313	210.143	837.33	660.821	1560.63	915.373	990.926	1027.47	955.334	476.08	6642.82	28.4952	531.388	645.831	1404.59	3287.83	675.814	146.62	1066.1	408.754	201.76	772.337	634.911	326.098	662.264	3111.17	1723.54	23.7378	74.7007	1705.3	23.4485	777.465	251.939	1899.48
butyrobetaine	106057	45430.3	8982.42	14178.6	31180.4	264.241	987.222	100325	131517	15774	26015.5	20637.6	17575.8	56475.8	27838.4	14134.1	2123.87	67751.7	27540.9	52255.5	137180	27062.6	6903.05	52892.2	24382.5	64008.7	14642.3	2957.19	20512.6	35541.4	23454.1	65353.9	5716.17	24857.9	9199.05	141645	43951	52065.7	5626.07	84684.2	70562.4	40574.4	10299.5	53944.4	46068.6	60404.2	42563.5	25890.8	6674.14	30430.2	13482.5	35517.3	90174.1	20559.3	97817.8	27689.8	2558.36	28688.8	14682.3	3405.06	823.082	19671.1	58474.5	39981.6	35461.6	14276.1	12665.4	54124.4	13682.2	21947.9	85204.8	153562	45097.6	14336.5	28648.6	8475.63	49147.4	49154	59309.3	23393.1	18328.2	63985.9	19576.5	1359.92	35887.4	1501.72	43170.4	14341.6	15301.6	14839.7	10139.1	10071.4	6788.89	30654.5	18420.4	7376.83	18842.1	14983	1790.97	50423.6	42258.7	14691.1	22508.3	22210	10835.4	12186.2	3251.98	1449.52	13868.1	15462.3	2932.86	828.227	1685.81	8123.01	1746.23	5554.02	2862.29	15316	5761.39	34920.8	1666.22	16389.2	32280.9	36649.2	22578.6	7772.92	16842	6830.84	13823.5	1189.58	12061.8	19890.3	4000.08	12163.4	5911.61	11410.6	15578.8	549.197	2280.65	27201.8	15678.5	12791.6	12456.9	22307.5	23827.7	25928.8	138564	20482.3	31079.7	132317	9757.58	79259.5	7803.6	84496.7	46894.5	23663.4	66645	7902.66	18827.7	12708.2	11728.8	9962.6	19724.5	7009.31	2125.13	37917.4	34436.3	30536.7	30165	6205.25	15100.1	6200.99	30389	46287.7	28347	8268.56	4205.66	21584.2	36109.3	8875.93	22864.9	18200.7	8719.88	31667.4	10655.2	26062.6	19015.7	77445.8	17089.2	8073.27	32762.6	60492.4	5446.36	16195.2	23986.9	7486.84	43159.1	10792.9	63063.3	70130.5	97411.5	62005	30131.8	24763.4	14012	66146.1	33988.6	35353.5	65453.6	8242.57	23863.3	6917.14	37505.4	47819.5	11136.5	31093.5	18959.7	37016.8	38123.8	76950.8
C14 carnitine	0	0	0	0	0	2455.71	143.176	28.5218	0	57.8542	22.483	5.04273	0	0	0	0	0	0	27.5446	7.37403	0	20.0575	0	17.6623	0	7.78234	0	0	0	0	0	7.03276	0	10.0552	0	0	11.7169	13.9819	0	0	23.5825	0	64.2301	0	771.682	2.22953	0	14.1376	61.7255	60.2763	15.1074	0	38.0803	14.1604	694.904	0	21.8235	39.9074	0	0	142.358	4.29274	23.2122	0	0	0	0	0	34.9323	0	110.964	6.66515	15.3155	0	3.06646	42.7519	39.5546	0	65.4404	76.5197	0	0	0	0	35.6764	596.442	12.6091	50.2793	16.6121	112.214	0	0	0	43.5105	0	0	10.7282	0	108.639	0	4.7378	304.721	0	8.84263	0	0	19.505	66.6699	453.961	196.893	0	351.071	0	0	0	0	0	78.5683	0	0	0	0	0	0	14.6114	0	0	24.288	67.7818	110.84	71.1267	140.173	29.3312	24.4125	141.024	8.07153	0	34.6747	128.502	19.0135	47.843	0	46.4902	9.96758	8.70644	0	0	0	25.1964	24.0288	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.61583	0	0	0	22.0041	0	41.5327	7.56761	0	6.23558	0	9.09	362.053	0	0	8.26361	0	21.7789	0	0	593.93	0	0	115.622	4.62861	27.621	236.65	10.3159	4.3507	0	4.75521	0	64.1684	0	0	0	0	0	187.184	0	51.9771	78.0958	0	0	80.0456	0	35.6503
C16 carnitine	90.8575	10.3781	19.0917	419.867	51.5269	5574.94	595.4	703.119	63.4764	195.315	255.336	14.7228	32.6181	38.0747	71.2558	0	0	13.4722	25.1636	28.3615	12.6578	45.2643	8.5643	114.504	5.98184	75.7434	3.09822	4.41577	14.498	53.8708	0	273.018	0	63.966	0	0	72.6857	110.176	1.84308	0	177.738	0	141.938	103.12	1000.33	264.042	14.6406	12.8626	88.6161	186.516	125.845	11.0366	165.874	111.856	508.548	28.111	53.9326	197.594	0	0	284.206	62.8197	53.5225	110.59	24.066	1.35303	1.17854	0	211.684	4.69654	1046.21	75.877	173.706	71.3544	44.7726	221.934	331.561	66.0471	614.284	565.778	0	57.3356	11.649	4.65858	331.778	1218.79	50.0915	237.739	165.13	168.326	18.1855	3.55513	44.5471	65.1143	126.316	59.621	327.452	164.262	41.9385	35.3495	113.176	312.986	0	145.837	0	36.3523	90.1642	322.94	886.015	573.766	0	400.618	11.823	0	220.818	16.9675	14.4733	482.471	0	64.9549	0	0	15.0711	0	216.996	0	40.0579	127.879	356.608	318.182	198.233	362.102	58.6986	719.369	580.197	33.418	65.4628	113.645	794.971	177.822	251.57	0	309.607	0	43.3709	0	78.659	3.37426	71.3948	309.582	40.4693	38.1683	0	114.095	0	6.29728	3.12692	23.8883	6.77162	0	0	8.13149	5.77426	10.1139	1.10347	31.7324	89.0454	0	14.7219	7.09093	0	5.60236	0	210.984	23.5686	7.66773	21.5165	326.614	25.7077	111.796	105.177	7.53315	77.1127	9.42944	40.9146	901.073	4.20155	44.0291	99.7257	9.97156	141.037	9.67478	9.71841	1242.3	65.3698	6.35541	435.241	102.288	213.159	372.533	286.772	230.118	11.758	75.1099	18.5196	224.417	9.12338	47.967	6.41174	9.6093	26.3163	684.618	21.041	79.761	100.562	116.509	65.8131	438.419	1.95839	188.695
C16:0 LPE	166.554	230.447	65.1043	321.457	334.148	158.345	360.299	56.059	195.671	100.147	301.25	220.084	634.57	453.966	240.533	131.99	69.7357	78.404	477.121	256.031	0	200.818	317.005	173.765	245.682	882.161	1012.88	277.073	532.962	89.9045	149.973	282.529	71.2364	93.8481	391.631	57.9394	470.185	1182.11	10.4677	189.955	559.272	139.989	248.386	118.644	206.024	154.228	195.372	201.399	75.0824	170.948	216.497	334.019	179.823	324.207	1009.96	525.343	560.163	552.684	223.653	471.733	74.567	164.535	60.3796	212.922	545.964	15.7587	39.9776	120.458	76.3855	85.4823	321.723	14.9969	158.915	255.486	614.429	45.6628	198.099	64.362	278.13	678.58	32.8391	78.6603	98.9867	68.1689	527.14	283.884	112.627	109.488	543.641	187.523	258.334	106.508	23.4004	216.947	196.254	173.262	67.9446	146.465	11.7946	342.414	202.359	1756.61	767.078	943.212	88.236	634.942	1314.55	1597.23	476.288	1939.18	1111.85	149.915	180.588	341.59	791.514	809.08	110.821	1520.68	394.807	1171.6	440.71	490.857	769.248	385.711	1158.92	82.3867	227.866	132.957	1476.32	67.0842	1393.44	851.592	265.317	455.297	1540.07	325.497	780.143	20.5087	1920.24	377.149	132.627	30.1395	1428.26	74.2209	195.183	113.79	320.33	288.197	895.098	1498.83	444.114	0	803.326	144.255	490.087	46.0357	216.785	237.966	195.626	80.8225	32.7188	125.024	123.115	86.2016	38.1241	345.967	130.535	55.5763	63.3289	239.313	70.6177	69.2502	44.7468	67.1827	1123.66	137.951	60.2051	196.905	373.654	1625.46	405.57	31.3072	120.512	159.406	503.164	308.48	28.1833	858.435	663.96	125.229	356.354	145.786	142.79	85.8828	554.856	65.1743	1971.4	94.2518	262.45	1035.6	368.956	596.76	63.957	291.642	333.324	499.397	171.972	365.685	127.271	59.9706	132.361	1113.35	75.7885	298.918	728.011	1453.99	156.961	684.643	111.806	739.589
C16:0 SM	8.77323	18.9657	77.5212	9.93107	14.2525	0	85.9135	0	0	3.43905	202.791	0	10.529	21.4934	7.27027	0	0	16.0857	10.6172	18.8632	4.36705	45.0104	27.3261	30.872	15.1044	23.5416	0	0	46.4503	4.50878	0	572.596	0	12.5455	0	0	12.6658	0	0	7.07531	0	0	241.231	236.031	0	0	0	7.73672	8.23516	0	509.887	0	552.205	154.34	476.5	0	80.6343	187.808	0	0	37.6262	6.95791	0	82.0561	9.66339	8.06888	0	4.82486	216.017	0	12.868	41.9924	3.39325	42.2663	35.2933	4818.73	0	0	0	1178.39	0	87.1234	0	4.47526	1327.45	21.3765	0	201.948	0	144.801	20.6934	5.99369	16.3481	22.4889	0	954.791	14.0818	15.8263	20.3313	13.6744	26.8522	80.1802	0	43.7234	0	57.0598	68.8532	149.759	29.4307	21.6949	46.4667	124.46	0	13.5922	181.337	0	71.3828	17.0591	0	78.6843	0	9.83349	62.8432	6.74641	48.9356	0	0	151.131	407.207	204.895	38.7951	284.239	27.8171	304.015	0	34.3489	54.8242	128.835	427.137	256.759	23.4586	0	869.337	0	343.586	0	108.611	0	128.793	29.2725	77.0617	0	0	8.15094	8.22318	0	0	0	11.3606	0	0	11.1408	6.93669	21.8492	0	0	14.8376	0	0	39.0581	0	5.42054	0	0	5.05598	0	0	10.5975	3.74412	11.9018	0	9.39363	11.277	0	6.34333	8.07491	4.29679	308.762	9.59787	4.11433	133.285	6.15541	5.28721	34.3573	15.2107	114.566	22.1978	0	39.9387	25.3267	19.8232	4.5702	0	37.6812	51.7725	11.3463	5.88006	10.0058	0	15.5107	65.9195	0	6.67699	0	101.404	52.2571	31.3933	247.883	4.46018	19.2193
C16:1 LPC plasmalogen	0	0	11.3302	9.34377	0	5.35262	0	0	0	0	5.56076	0	24.7696	7.70786	0	0	0	0	0	59.451	0	92.687	0	0	0	0	0	0	0	0	0	338.151	0	0	0	0	0	0	0	0	0	0	18.392	4.93847	0	0	0	0	0	0	227.133	7.47104	248.956	40.7131	242.465	0	41.1784	111.914	0	0	293.745	5.01034	0	0	0	0	0	0	120.806	0	17.1277	0	3.32257	0	0	23.5043	0	0	0	552.121	0	23.1614	0	0	245.964	487.937	6.90335	15.7105	0	98.2241	0	0	0	7.27739	0	646.81	0	0	6.85761	0	0	106.662	0	60.8039	0	83.1482	94.6807	69.8235	0	71.4848	21.5579	39.2846	0	32.3986	116.699	0	39.4029	78.3831	0	64.3679	0	0	0	15.4494	9.87174	0	0	32.8887	907.162	5.30226	100.653	45.7121	175.251	110.837	35.8278	54.299	20.441	12.893	590.041	58.0561	0	0	694.755	0	60.0937	0	46.3464	0	21.3031	46.3052	30.6689	0	0	9.3655	8.10545	0	0	0	0	0	0	0	0	8.08326	0	0	0	0	0	0	0	0	0	0	0	0	0	9.41682	0	10.8493	0	0	0	0	0	11.1459	0	81.4312	0	0	34.54	0	0	438.665	4.54211	6.59482	66.2291	0	23.487	12.5274	5.40847	4.42583	0	6.02677	0	6.63155	0	7.22134	0	5.17651	8.615	4.25787	5.66447	16.3018	332.499	0	0	96.2768	0	12.1584
C18 carnitine	120.952	45.5003	45.5734	523.857	126.233	726.881	80.0155	379.676	58.8056	52.8165	62.838	26.1067	364.191	92.1214	34.499	0	20.565	11.889	19.9184	26.2413	52.7771	31.6415	13.9868	130.426	27.936	69.4133	0	11.2163	51.4128	60.8723	7.71309	94.5941	0	54.1015	21.0719	9.48681	69.9521	94.2314	0	0	197.433	12.4016	41.5209	51.9724	135.128	179.768	59.2058	12.3543	43.2721	52.869	54.786	28.2259	137.446	67.9466	108.964	88.4315	10.1805	109.083	93.6461	0	85.5709	40.231	100.84	143.515	21.176	10.6969	6.02053	6.32102	118.479	20.1916	329.954	36.0603	89.9452	88.4591	30.795	287.971	104.196	121.827	269.429	337.763	17.6684	54.1176	27.8681	11.1125	203.196	287.976	17.2796	124.346	73.5755	41.637	20.5429	27.9346	49.7335	38.9813	87.659	57.3325	138.57	87.8617	45.781	38.2909	23.3499	70.9356	17.7519	47.489	0	79.8448	21.3356	159.598	256.995	185.636	14.1809	113.744	118.302	54.4021	361.934	39.6354	21.0776	120.71	109.637	33.4887	38.2194	17.1899	0	15.7473	89.0674	25.8447	186.036	49.5793	129.776	115.244	51.4956	56.162	22.8604	785.121	171.09	25.001	148.214	27.7685	327.5	76.0832	44.1857	22.1302	165.733	0	36.0143	13.9957	52.0703	16.3335	43.6313	274.343	113.813	15.221	35.4973	222.021	12.6644	32.9755	13.3616	34.7921	7.53148	20.0348	9.57672	86.2128	22.5899	61.7797	8.96255	73.44	113.34	21.0054	52.442	36.6097	18.9521	16.2169	30.1429	137.952	61.6615	19.7254	131.027	162.284	46.8144	25.2219	140.615	0	57.7756	23.1232	24.0814	142.581	14.7737	97.486	104.562	28.5202	110.801	24.9623	41.1387	377.634	127.296	17.4024	112.6	62.3253	171.419	105.373	75.0586	73.9507	14.7174	202.65	26.8818	84.5058	34.6515	65.2788	37.8365	0	50.5334	364.374	26.6525	50.5838	43.05	278.637	57.5056	193.841	9.24785	65.0566
C18:0 LPC	12.5611	116.231	145.165	58.4543	8.42351	28.5169	1924.68	11.8799	7.24916	14.1632	336.265	13.4134	301.762	136.433	33.1125	5.97695	6.80006	12.3958	197.923	224.419	0	431.682	32.4937	87.2928	17.139	57.5075	8.82256	0	130.879	12.2818	0	3219.08	12.8004	21.1224	127.522	0	194.193	45.7614	0	20.3683	19.6433	0	423.923	97.2312	7.65277	64.3514	5.21341	83.9257	18.0506	0	1177.18	51.7026	1299.11	395.181	2281.67	50.7673	720.719	721.945	30.2018	47.303	815.185	25.2075	44.1205	63.8705	42.5813	16.9554	0	45.9896	844.766	0	158.542	30.3513	17.6122	54.2738	15.1281	301.793	20.927	3.97962	7.4356	3950.18	0	233.531	0	23.3597	2228	910.122	24.6673	925.918	26.8573	1219.75	41.8464	0	34.2196	137.562	9.02393	2668.83	18.3648	11.2143	141.115	15.488	38.467	2961.96	333.945	563.59	17.4478	378.973	1579.36	4074.38	89.2494	295.302	243.941	730.723	27.8062	290.69	534.932	110.897	323.336	282.589	33.3543	427.293	120.655	250.44	85.6662	57.8441	142.317	26.3841	47.1483	487.971	4522.13	149.175	533.207	3169.71	159.268	1511.37	132.284	892.881	174.918	290.196	4530.58	1257.7	49.9163	0	2881.79	22.0549	269.883	14.4698	361.81	88.5131	472.371	558.205	488.476	18.0679	21.6035	65.011	41.3139	16.3868	31.81	13.7116	23.5354	7.77772	33.1411	30.9299	35.5004	68.9671	0	71.5669	54.0964	10.2927	11.414	34.0684	19.9594	0	0	7.39631	15.3988	90.5553	0	47.5788	22.7575	381.888	25.3765	34.7723	47.4422	20.2672	36.8853	89.1474	14.6353	515.189	33.1321	12.4188	438.706	22.7481	24.2394	357.768	58.1881	60.3643	394.21	0	65.2605	187.876	976.579	25.1937	7.27442	129.067	132.273	54.377	51.668	66.0315	21.8569	26.533	118.084	44.2058	27.1385	79.1257	3310.57	21.7425	37.8352	1099.27	9.5021	79.5496
C18:1 carnitine	80.2597	48.0801	11.3401	240.575	78.251	3842.25	1492.18	426.228	40.1928	364.919	132.701	9.93316	32.7124	126.858	32.3067	0	0	6.59213	103.922	17.0227	18.8768	112.235	10.7272	81.1339	13.2636	100.566	0	0	34.7461	22.4801	0	122.894	0	27.4711	4.1671	0	95.4426	150.126	0	0	192.81	9.27982	197.242	105.411	776.095	375.886	25.061	7.67137	119.097	408.543	97.9107	0	71.5553	109.318	787.205	33.5969	107.162	119.055	13.3748	16.2027	368.513	21.897	97.2576	44.8574	0	0	0	0	77.5841	0	707.921	23.2293	102.422	67.9859	50.4316	59.3754	191.828	15.96	595.778	221.433	0	22.6332	9.6497	6.7918	144.576	696.679	47.2158	103.232	118.404	107.488	12.788	7.2153	39.9191	60.327	64.8371	30.6096	102.475	49.9741	24.8786	24.8414	67.6164	500.737	6.89756	52.8415	0	16.6744	46.7974	171.863	650.913	372.255	10.839	183.359	15.0497	16.7701	173.158	80.1665	18.2107	123.877	0	40.3259	22.0568	0	0	13.8934	66.0427	9.49465	56.0523	120.186	239.763	245.126	99.2881	165.414	90.9113	271.453	334.352	10.3479	38.8736	198.324	472.141	83.1257	171.943	0	155.466	0	13.0241	4.49727	111.977	0	89.4156	119.065	139.962	21.0956	23.9538	38.0361	0	14.7743	0	19.479	0	0	7.08913	13.1311	0	8.25104	0	34.2153	75.816	0	7.61662	9.34618	0	7.81917	7.3642	132.797	18.5465	11.1361	30.2026	266.722	16.9163	161.559	166.093	0	100.631	14.9214	16.8025	658.071	0	21.588	58.0117	9.48854	61.1355	6.63361	6.8898	920.408	38.7122	12.5762	142.759	111.932	119.103	236.078	210.088	78.053	13.2395	88.449	22.3941	117.627	8.69966	39.5847	8.69126	7.70441	16.2807	546.148	11.1176	268.78	159.094	65.7887	30.2959	278.977	0	160.53
C18:1 LPC	0	111.152	9.01723	71.9619	6.27084	49.5174	2719.34	0	0	31.6813	98.7636	7.69458	4133.44	319.611	52.6805	0	0	14.429	754.613	116.121	0	116.608	29.6309	8.77381	0	28.1542	0	0	148.121	0	12.3563	1637.73	27.8445	37.1957	133.764	0	1043.73	161.961	0	45.4304	19.9374	0	31.8558	141.829	0	27.8977	6.82477	233.065	0	0	370.792	17.3276	408.108	57.1244	1567.98	0	4511.42	727.144	0	47.6625	461.941	5.24683	23.9616	18.8251	219.311	7.36356	0	107.093	525.679	0	32.3141	20.1485	0	250.1	0	114.654	19.0851	0	15.7857	2473.64	0	38.2453	0	202.685	1602.29	262.858	25.0439	44.3695	388.665	245.457	36.6147	8.5927	16.6781	52.3711	9.20337	785.495	9.45986	0	17.9808	25.3382	272.205	892.492	1254.33	763.077	22.4756	140.05	4591.9	1638.44	312.25	151.665	254.059	172.758	84.3993	131.964	135.703	291.796	48.8855	50.8904	30.3644	151.53	308.812	81.0226	102.938	16.0788	20.149	8.66137	0	488.277	1638.91	37.2993	197.069	185.431	29.7348	89.8949	137.654	195.891	48.8095	43.0657	2039.97	711.02	81.5181	0	1231.03	43.7449	29.7436	7.95821	1347.34	64.4702	268.767	137.12	347.902	13.5806	30.0562	12.4532	27.5216	7.70696	6.75592	6.04406	63.6915	6.10626	11.1066	6.75447	9.65975	23.5713	9.60727	511.241	18.5491	0	148.046	11.8929	40.9733	0	19.7619	7.85756	13.5224	260.756	0	47.945	12.7055	2469.88	12.262	24.3567	3.82214	8.624	15.9754	10.9287	9.8941	70.7449	33.5958	8.4645	95.5914	9.75715	0	96.4943	17.9284	0	254.521	0	28.3478	27.545	34.188	60.6984	0	86.2749	743.855	0	20.3246	21.3113	15.1194	5.43404	20.0622	22.7171	13.1942	48.8737	648.578	7.92908	16.0362	495.663	5.25811	81.023
C18:1 LPC plasmalogen	0	0	42.5129	9.02063	0	0	79.3563	0	0	0	5.88501	0	10.7968	0	0	0	2.75543	0	0	16.3799	0	77.8588	0	0	0	0	0	0	0	0	0	1668.91	0	0	0	0	0	0	0	0	0	0	23.1024	17.7841	0	0	0	0	0	0	918.925	0	871.141	127.333	1183.83	0	63.5901	348.164	0	0	81.7032	0	0	0	0	0	0	0	352.665	0	19.7449	0	0	0	0	107.378	0	0	0	1660.29	0	79.4486	0	0	1052.55	22.8504	6.7806	121.46	0	55.7586	0	0	0	10.5971	0	1974.79	0	0	0	0	0	126.785	0	13.0042	0	126.709	254.477	224.846	28.7019	40.467	0	114.957	0	11.0846	244.281	0	82.402	8.40521	0	205.287	0	0	0	29.2826	11.4635	0	0	207.909	1455.12	10.2963	51.0318	21.5788	58.5141	157.648	0	20.2306	9.40854	8.09203	1189.51	193.57	0	0	1277.45	0	102.583	0	161.562	0	77.8324	26.0189	86.5249	0	0	0	0	0	9.18635	0	6.72328	0	0	0	0	32.7385	0	0	0	0	0	0	0	0	0	0	0	0	0	23.4946	0	80.1104	4.9635	0	0	0	0	0	0	459.356	0	0	197.766	0	0	10.5133	17.3813	130.508	32.9567	0	21.8564	8.38243	15.718	0	0	25.272	5.06524	0	0	11.1487	0	7.05153	39.5452	0	0	20.3939	455.482	16.0638	0	454.373	0	24.0887
C18:2 carnitine	11.9279	23.2939	0	32.2997	11.3627	2639.3	819.45	88.6954	22.9467	350.839	40.9395	2.085	9.57361	39.0601	7.91147	0	0	1.96482	83.7188	6.70085	8.06121	80.7915	0	17.6043	0	27.6427	4.96184	0	0	11.9937	0	38.0216	0	14.3145	0	0	24.9452	77.9956	2.49373	0	48.3856	0	80.945	59.7199	410.491	60.6473	5.98113	12.5472	66.2543	306.979	43.2673	0	18.5643	24.5399	847.989	0	52.6079	54.6311	9.59311	0	218.029	4.73592	13.0008	13.3204	0	0	0	0	51.3017	4.88493	298.74	13.8828	52.9141	8.37311	6.77322	17.1812	127.699	1.57386	283.152	139.509	0	11.3896	0	5.11321	53.1536	221.196	14.9285	56.3306	42.651	95.4058	3.4025	0	0	17.7591	10.823	7.97631	36.8015	13.8032	14.9166	8.46816	56.7488	258.103	0	21.4438	0	13.9791	41.2117	116.918	222.866	227.292	0	133.661	6.34627	0	16.9066	16.1748	3.31839	60.4176	0	12.9245	0	0	0	0	47.6194	0	33.0323	46.3611	108.136	148.773	49.3974	110.105	64.2248	44.6601	231.348	0	23.4173	77.7642	194.569	37.6824	182.391	0	54.9965	0	0	0	37.915	0	48.8608	42.7167	40.5194	0	0	0	0	2.90526	1.09869	5.19302	0	0	0	0	3.81734	4.28941	0	9.03761	9.21025	0	0	3.71506	0	0	0	18.8762	4.40779	4.98488	0	94.1056	1.61894	189.079	30.7039	0	34.226	0	10.8732	328.811	4.61564	0	24.1777	8.13348	22.063	0	5.6406	274.016	9.83325	5.2073	109.618	13.8139	44.5297	125.817	78.8218	19.2891	6.7349	14.7024	6.36408	22.8276	0	8.97601	0	2.34622	3.40896	197.823	4.6096	114.871	135.722	12.2574	7.21985	80.0775	0	94.587
C2 carnitine	0	0	0	0	0	59141.6	740.035	0	15.2102	6.78147	14.8356	10.3933	61.2982	0	17.7731	0	0	32.5485	9.37488	141.674	5.37395	0	12.4101	64.0001	0	9.21986	0	0	31.432	0	0	1474.6	22.9727	6.81205	0	15.7236	0	6.29244	0	22.9972	17.5025	8.13744	30.2477	6.83489	279.043	0	19.4252	43.4617	466.987	21.125	409.077	0	7393.91	192.181	1282.61	0	11375.8	819.452	0	3733.05	54899	950.764	0	8.00086	126.726	0	14.0682	47.0707	2531.2	24.6881	20.5758	43.0356	5.02525	16.2499	6.66602	16333.4	8.40427	0	0	4232.78	7.40167	12.4587	0	11.2602	941.424	99841.7	35.8811	685.622	19.0534	5845.3	70.1543	13.238	23.3823	25.7189	0	1754.39	0	84.9951	33840.1	16.109	8.84487	11.2687	0	11.3154	217.429	97.1415	370.457	4680.29	66.9549	31.587	0	4847.31	0	0	0	0	75.2086	13.5249	21.9781	12.4563	0	0	0	0	19.1799	7.10243	0	289.199	62.4252	33615	57.8098	123.915	23576.9	7.59623	0	15.3493	0	1050.15	206.166	628.778	103.57	0	50.8733	70.9749	791.789	0	452.854	17.1672	613.882	112.47	0	34.77	45.2667	15706.3	36.3955	0	12.5116	5.66884	0	5.94543	0	0	0	0	0	0	0	0	9.96577	0	0	0	8.58979	0	10.6837	10.6356	7.73544	0	0	29.4683	5.45564	0	0	0	6.74609	16.6036	0	6.62998	0	8.11554	221.576	0	38.4239	6805.42	9.66711	9.86359	19399.4	3.25808	219.458	9.06609	14.2	0	0	15.4462	7.77227	16.0704	0	7.3936	0	0	7.88457	11.1129	125.466	0	663.19	0	11.1324	556.183	0	121.074
C20 carnitine	33.6062	26.7825	16.4467	56.7279	37.5538	31.4449	0	30.7946	10.6732	0	5.70933	11.4718	129.716	0	6.05609	9.9788	31.37	0	0	8.93189	36.8484	3.14942	0	24.2979	15.127	15.9152	0	0	0	24.9741	23.4148	14.6576	0	27.231	11.6986	21.9487	0	22.5147	16.2582	0	37.6881	12.7056	6.55423	5.58373	5.15724	23.6926	15.903	0	0	7.62335	11.1734	0	56.0681	8.33411	16.551	22.5571	0	23.532	16.9706	23.3229	23.5156	8.72663	11.9082	47.5927	0	19.8763	0	27.453	25.1142	37.8934	32.1715	25.7258	11.7801	11.8531	4.01192	102.877	9.09883	22.7984	0	72.1094	59.128	25.0415	22.8684	47.0766	25.5954	51.9901	0	7.04701	8.36483	0	0	55.7919	7.92743	0	16.3721	19.4518	21.9652	22.8785	22.9639	0	0	7.5789	53.7861	0	0	22.8594	0	0	23.9854	15.9538	0	0	44.2065	37.2962	54.9654	0	12.2468	25.5072	85.0452	0	11.9792	0	0	0	25.7435	12.258	93.993	9.38067	26.607	21.2265	0	0	0	251.852	28.2036	23.3343	29.2707	0	71.3107	11.1288	0	63.3407	25.9533	0	14.7897	8.44831	22.6835	18.7484	0	161.317	21.2386	0	0	50.9288	0	23.1082	34.4322	16.1704	27.461	55.4035	6.9984	28.6157	98.6062	50.5573	6.528	12.043	24.5944	11.421	35.6555	9.81928	23.2373	0	14.9988	24.9256	24.2477	16.126	160.928	18.1717	6.55667	12.3715	34.5017	14.81	19.9723	13.4346	0	15.4138	6.07342	35.4584	30.5843	7.38135	26.3616	6.02543	8.76107	49.4704	70.225	8.46914	4.59366	13.0705	30.2114	20.1614	13.0276	10.6043	0	63.3557	5.25488	19.8971	4.02285	35.5788	13.867	22.0879	19.052	70.4711	11.3819	7.23401	25.6798	41.1746	14.2515	28.6702	0	11.802
C20:4 carnitine	223.411	720.401	1825.62	1016.67	1306.05	0	0	2075.96	0	286.419	0	1335.83	480.637	333.161	1562.9	2531.86	1290.28	771.155	195.61	0	1764.9	466.193	3411.16	395.823	1094.04	2850.49	6246.05	976.063	2200.08	252.949	900.537	16.6137	4196.98	90.2305	2808.49	2032.76	93.7922	2407.82	2418.53	66.4504	1581.7	1952.21	22.5377	20.5883	13.6324	800.539	876.639	0	0	4.19019	247.045	1065.42	223.072	69.6317	16.6888	177.868	0	19.4829	599.775	1557.51	0	304.896	253.938	346.631	600.428	1962	1374	232.261	0	2712.06	7.66479	1062.23	217.638	344.611	1033.89	0	139.715	161.43	0	0	370.931	1443.33	0	0	80.0691	0	54.8258	0	38.7002	0	277.758	334.61	864.161	200.664	874.344	12.3827	348.389	940.782	0	2413.77	0	26.249	1119.59	633.703	1155.38	1202.57	2313	0	13.5533	831.025	303.843	1222.71	755.8	359.556	1188.02	17.525	1939.66	4488.04	2474.8	360.2	1065.68	383.939	37.2754	81.6879	887.648	2093.42	1294.44	0	0	0	0	0	0	1211.79	12.9638	25.9901	23.6696	0	980.45	0	1719.11	1671.93	927.259	6146.5	0	1494.08	124.16	5721.36	0	438.385	431.763	91.4882	238.4	934.428	1222.06	987.394	806.279	839.004	647.367	23.9578	344.517	840.381	1173.76	677.473	12.6546	29.259	596.191	4.39125	66.1704	219.249	85.1117	46.7988	979.738	211.019	19.1847	356.312	406.116	30.578	9.12678	0	17.8957	2627.64	23.4932	575.611	2277.29	0	517.484	326.048	150.439	172.542	0	525.086	210.841	0	1088.47	224.83	0	431.87	679.267	156.977	9.23586	179.714	1445.23	18.0424	44.6687	65.9767	266.114	338.62	80.6872	394.407	244.012	293.313	414.432	24.4787	0	321.587	60.2696	270.641	263.63	956.033
C36:2 PC	10.4174	27.6128	0	9.98243	21.7531	5.94332	2736.96	0	0	0	0	0	214.61	29.6705	18.0998	24.7504	17.4057	0	24.9341	30.8262	0	0	12.6287	9.73267	8.46313	20.0133	14.7232	0	51.2605	0	20.7042	7.19922	97.42	15.2095	66.9801	9.0953	162.489	9.87577	0	13.5862	10.7154	28.2699	0	24.6279	0	11.59	4.946	11.2211	0	0	17.2958	22.2297	51.2368	13.4421	0	0	175.594	11.0483	28.0413	14.7321	0	18.048	12.2176	14.2421	0	41.6308	48.506	44.2737	7.49177	35.4162	0	0	0	63.9983	0	5455.12	4.74654	7.34213	0	1198.23	84.6989	20.0551	16.9955	153.129	1731.96	10.4325	0	16.6528	32.3666	28.5505	15.1129	0	23.2436	48.9613	15.9083	37.089	0	10.2967	0	0	5.52882	2114.94	161.22	32.2354	21.7942	65.6423	273.369	81.7358	24.7164	12.3482	58.3183	0	29.0609	161.041	38.0075	134.88	88.8534	0	0	60.3161	186.209	36.4592	0	0	0	6.03244	0	0	60.2007	7.88576	0	0	16.6477	0	24.9695	0	0	0	62.2146	12.6478	0	13.7942	93.6656	30.2491	20.5287	9.36578	0	20.7609	59.6755	9.68778	199.912	0	0	0	0	33.5039	0	19.9417	173.857	24.2587	24.9923	23.959	28.2867	19.6877	0	28.6969	0	0	173.256	8.6743	34.5989	0	16.3391	0	0	123.928	0	6.3509	0	342.657	13.762	78.1059	0	16.9444	0	10.6579	16.568	6.96648	0	0	0	11.8133	9.10985	9.4085	0	3.14104	4.38915	0	65.2395	7.77094	0	12.5641	0	35.64	14.5901	0	25.9255	25.1624	7.59701	16.6316	9.63738	5.43953	20.1455	8.64676	66.3852	11.3143	0	0	0	0
C3-DC-CH3 carnitine	16.0522	0	0	111.433	0	1420.52	25.1084	2459.65	7.24955	15.7241	4.19219	30.8751	2192.53	9.33148	44.507	0	0	34.1878	21.3001	68.9612	47.1622	2.65331	0	43.9771	0	9.33429	0	0	0	0	0	37.894	0	34.3426	0	23.1151	0	0	0	0	274.013	0	30.4646	13.2555	53.2662	0	33.2287	40.2747	71.0783	77.9069	7.10345	0	529.275	37.3072	20.182	48.4165	6.50228	56.3827	0	0	614.572	57.4073	22.414	147.298	170.365	0	0	0	144.127	0	280.319	684.278	63.149	0	0	15.4674	7.86543	11.5025	0	65.0102	0	0	0	0	0	1092.23	363.558	89.4871	93.9112	24.6974	17.675	0	0	239.186	0	6.45917	0	0	1290.71	154.203	73.9065	0	0	32.4025	0	101.427	30.8787	92.8871	974.583	432.987	0	169.404	0	0	58.3257	0	0	56.2068	0	16.3975	0	0	0	192.602	842.252	0	1035.33	18.6344	105.755	126.266	327.395	77.9072	91.8127	26.1148	244.36	45.2545	111.094	0	30.8824	17.2007	90.769	0	26.9368	0	258.647	0	1281.76	16.6272	1037.09	2268.29	22.1257	11.464	375.339	372.697	16.9603	0	0	0	0	0	0	0	0	0	0	0	11.8713	0	0	0	0	0	0	6.57884	0	0	0	14.3601	0	88.7722	6.22164	0	193.34	26.4674	13.4828	445.935	0	3.20505	30.3716	0	9.38545	0	22.2059	837.45	0	5.86039	265.559	0	7.6859	504.884	947.653	0	0	37.8644	8.26471	80.3239	0	0	0	0	0	558.381	5.30357	0	33.4203	0	0	31.4611	0	87.8177
C4 carnitine	0	0	0	0	0	11302	48.9947	0	0	0	0	0	0	5.78295	0	0	0	6.48231	0	29.6336	0	4.92588	0	5.48071	0	0	0	0	10.6748	0	0	0	0	0	0	4.66035	0	0	0	0	4.65903	0	31.5603	46.6884	403.568	3.26708	11.048	488.5	156.489	26.9707	53.1114	0	5374.31	16.5472	141.381	0	214.268	78.2187	0	0	10307.2	99.4573	0	6.37075	8.12478	0	0	0	287.419	5.54643	5.45552	0	7.77537	6.1667	18.9427	4766.44	5.06619	8.89249	0	384.155	0	4.69021	0	0	17.6265	13199.8	0	359.36	0	2231.98	32.3169	0	0	108.454	0	357.473	0	0	9259.74	0	0	0	0	0	0	0	54.3108	1095.24	293.075	36.7293	0	1328.09	0	0	5.80386	0	0	0	0	7.2388	0	0	0	0	0	0	0	91.6671	158.466	2164.08	39.5696	262.352	2344.89	0	38.0074	0	0	163.313	26.8479	8.95845	49.5776	0	0	0	293.279	0	26.9123	0	0	0	0	0	0	878.359	0	0	6.31119	4.92034	0	3.01226	0	0	0	3.72239	0	3.14097	2.62471	4.29483	0	3.93165	0	8.09738	0	5.93011	0	0	1.82237	0	0	0	0	0	0	0	0	66.7341	0	1.12309	0	4.07096	20.9662	0	0	1412.94	0	5.30156	1438.81	3.40509	54.8163	49.016	2.45467	4.41033	4.42459	0	0	5.55926	4.10203	0	0	0	0	9.03854	18.1496	4.20213	294.804	0	8.86542	35.8264	3.69016	11.1023
caffeine	343.804	253.395	15.3413	95.146	232.225	192.13	690.303	340.911	265.06	234.541	178.554	165.057	218.848	2746.58	17.0086	19.0363	45.1832	34.0671	129.996	47.8833	18.909	2.6707	14.84	209.98	323.942	77.2594	330.26	57.1408	268.869	97.8367	534.423	0	11.7413	106.508	632.874	35.1165	147.032	22.0428	0	250.994	192.7	192.726	155.831	24.774	114.327	24.9276	0	390.314	5.76133	32.3864	0	37.745	11.632	0	69.7604	269.173	361.149	12.7975	430.473	20.9019	218.295	72.1894	40.1037	20.1541	0	326.002	4.3046	56.1535	52.7619	160.503	318.963	79.0294	25.0411	173.753	86.1767	0	60.9325	112.36	232.47	74.9429	171.204	121.938	67.3702	0	21.6244	369.2	38.3972	46.9374	222.877	607.688	74.8536	68.401	112.339	3.30523	237.407	0	72.8776	117.94	7.60742	130.484	0	19.6853	284.078	78.652	171.349	39.3952	0	1274.62	65.5297	19.2807	264.895	0	41.7908	275.964	86.4859	1485.3	25.5016	51.5646	48.0609	27.1587	86.3824	411.367	48.4657	62.9106	0	49.4123	27.3617	7.57811	250.742	55.7037	66.7594	449.691	31.0998	59.2626	249.566	0	57.9751	0	140.588	378.854	71.2587	419.711	7.45654	53.3803	158.433	20.1453	32.1261	144.943	1094.57	555.273	26.5776	0	237.252	34.066	0	89.8465	0	245.269	142.1	26.2882	60.8491	197.567	122.709	4.36366	370.103	72.4883	132.41	395.784	503.871	2191.73	17.5086	330.133	16.3489	81.9703	1176.41	217.247	328.597	54.1342	50.8976	55.434	216.674	336.322	130.317	956.061	39.4829	416.784	140.905	9.73843	172.136	0	241.581	274.807	344.072	652.788	314.178	22.0036	36.8722	23.5117	328.824	9.34088	193.817	186.673	425.464	150.487	299.783	20.8565	172.604	147.776	217.581	68.9671	519.266	25.7572	56.806	225.085	447.243	51.7049	157.405	48.8627	222.763	94.8285
carnitine	1216.43	502.266	1919.81	323.669	1383.4	81691.6	2276.82	3406.4	1083.01	690.281	859.651	639.961	2720.03	1881.6	744.179	277.362	546.086	2466.55	808.7	4605.7	1627.05	214.967	1522.9	6156.41	1208.58	1452.26	272.515	642.046	1564.68	1391.03	1164.58	5904	1302.18	4114.02	835.05	1047.81	748.035	578.477	1815.09	3119.4	2187.69	2849.21	1507.43	1848.13	9161.15	415.811	4375.36	3949.96	2969.36	976.817	1351.05	1533.97	7997.91	1664.22	12898.1	1605.75	191894	3724.55	837.879	467.886	69689.8	15166.1	894.703	1732.33	5837.02	1501.19	2292.23	6388.31	13648.2	1500.85	2042.51	4482.36	1274.41	571.869	703.721	25110.4	4756	7120.41	1786.47	12776.8	1758.31	2469.82	4868.29	934.312	10205.4	76023.1	4386.97	8426.99	4062.87	14045.8	977.672	3149.65	834.34	2563.29	570.362	5394.02	1709.96	1229.1	127528	690.498	480.143	1345.93	883.765	1855.01	1366.51	2049.47	1868.72	6181.14	3530.63	5192.67	296.188	15105	413.742	1785.24	704.642	0	1559.47	4294.25	897.152	1212.34	837.982	578.932	1250.66	734.634	1039.8	873.845	7085.87	2180.28	2459.39	60975.8	2563.95	10762.4	33754.6	2296.8	1598.86	1597	3086.95	2405.71	2410.67	11362.1	2499.13	1004.87	1204.35	3140.1	8479.21	1654.87	1291.06	1088.47	15234.2	2202.86	487.688	4331.33	1484.91	79946.8	1956.24	1118.65	454.149	1063.19	1540.44	1322.01	683.057	948.114	3727.64	1428.18	594.556	1955.76	3605.61	347.024	736.65	364.193	1326	1074.13	2272.83	1600.28	2251.55	854.592	1177.87	482.639	1327.2	519.578	1150.09	3934.06	2763.16	2612.4	1166.68	17471	453.654	1136.34	573.395	432.013	7634.95	11312.8	795.769	31493.2	587.915	2732.15	71999.8	706.563	7650.15	2568.64	2163.59	781.833	477.96	978.237	697.199	929.047	1032.7	1426.18	1017.54	3623.6	2112.82	3200.57	2014.4	786.252	2964.2	646.318	678.864	5382.94	533.731	2403.35
carnosine	0	152.46	0	142.935	0	0	0	23.735	0	0	7.94991	0	114.546	47.2886	4.84936	0	0	0	0	0	0	0	19.6761	5.187	0	0	0	0	0	0	5.81728	91.1864	0	0	7.74619	0	0	0	0	10.644	3.82116	0	12.2353	0	0	2.94226	0	0	0	0	584.374	230.22	79.3887	0	83.4625	240.565	108.09	4.10769	82.3192	155.855	20.4745	10.7877	0	0	7.54272	19.9122	5.88623	0	33.9543	0	0	7.09926	0	3.8422	0	160.401	0	4.04569	0	225.824	0	4.03328	0	18.8016	66.8217	13.3986	21.5573	0	0	12.9364	0	0	0	0	0	210.187	0	0	0	8.61627	9.72947	0	213.716	22.4946	151.569	47.1039	154.057	47.8581	0	184.319	45.2722	30.3975	195.329	56.0032	266.715	48.8748	198.703	497.645	94.0547	129.903	16.2493	174.022	49.9052	44.7053	30.8113	74.7055	101.638	33.6375	36.4563	0	0	13.6119	47.4835	588.206	0	11.915	144.474	41.275	276.284	286.042	0	27.4303	118.536	70.7995	7.58831	94.2874	14.7945	204.535	68.208	17.9679	37.4737	9.18383	0	13.7395	87.3867	0	11.8462	0	0	0	0	0	0	0	6.85697	15.6407	0	0	0	14.0963	0	14.7582	0	9.76373	0	0	0	7.20894	0	0	0	0	7.65731	8.17691	6.51086	12.4184	0	140.22	3.74995	12.4724	0	0	0	9.65454	0	0	0	3.99586	7.5536	7.02674	0	0	12.3445	3.69856	7.79266	0	7.92915	6.76049	0	0	4.84962	0	9.88836	0	0	17.4365	15.8552	8.27856	0	0
choline	6458.45	9817.1	24272.5	3455.29	6105.21	66029.1	18504.7	5632.41	4991.57	3681.75	17010.9	6918.63	30146.7	6442.36	17101	5261.92	5219.38	12114.1	13029.9	25859.3	2783.58	18166.4	12133.8	17079.6	11736.8	12967.1	3655.14	4627.32	31617.5	4359.23	3346.07	45599	12852.7	18843.9	18933.1	2124.57	49082.1	8302.7	2048.26	13899.2	20242.2	7883.35	15246.5	13644	4703.87	4767.6	6507.58	23251.7	70770.9	2673.21	30148.3	5109.97	44684.3	24163.9	53208	5954.09	34922.7	28704.4	1253.72	4781.83	62556	7284.78	4630.93	14593.6	10853.2	9027.08	6883.43	18370.7	40612.6	6441.65	12923.9	12534.9	6188.53	26339.9	3938.3	54438.3	10596.3	1051.8	7756	63422.3	3773.25	29076	3113.82	7931.1	58534.4	50971.7	2999.11	21678.8	8496.04	94243.4	22609.7	2223.33	17974.3	20110.9	6243.21	57306.3	9282.96	7375.21	18349.1	2954.28	9837.6	57800.4	35133.1	15630.1	5993.98	4086.94	7287.52	20921.5	18449.2	10986.6	4237	1402.95	6289.86	23801	15448.1	8314.73	7502.38	11575.2	3627.29	16760.3	2446.43	9576.55	4440.82	2142.61	2378.87	2318.54	7344.37	11899.8	6964.98	21730.5	14225.2	67689.6	32122.7	8940.24	1974.34	19285.1	7089.87	65478	32124.1	55518.4	28053.6	5109.52	10989.7	3664.95	34209.8	1618.65	19913.2	10864.3	2774.37	11510.3	8955.79	2674.87	5146.28	15578.9	9508.66	19463.1	24550.9	26859.3	9987.22	15441.3	51850	20962.9	15913.1	20535.1	12899.9	35704.1	21859.4	10659.9	27961.6	24618	7889.77	8585.09	20270.1	14341	12708	54651.9	6630.38	13514.5	8436.07	13763.4	10859.1	31248.3	17447.2	15779.3	14992.5	27340.8	9748.03	15638.8	6984.51	2507	31405.3	12394.4	29950.2	57360.8	6623.96	24774.8	25593.3	5134.08	11363.5	9336.77	25328.5	11256.4	8467.72	10564.8	18353.9	22354.3	7659.35	21248	21335.4	8761.88	28078.2	5852.19	9202.85	14892.3	44484.2	4498.24	15910.5	45424.3	15655.6	9099.24
citrulline	3481.69	4066.71	2017.49	5627.01	3318.5	638.354	359.603	2130.17	1989.32	1155.82	2274.84	5222.44	6526.19	4138.82	3464.29	3013.99	853.872	1878.87	4636.57	3013.34	2350.51	740.299	5573.08	679.821	5134.85	2028.81	5743.94	4295.74	2406.08	836.498	3518.01	14364.8	3471.41	5097.54	831.612	1508.74	4197.78	3788.19	2241.73	4769.51	5266.86	7301.69	2299.08	2335.24	979.648	2197.87	1738.14	1940.79	6532.85	495.668	7174.73	3836.42	7575.67	2367.71	2021.56	3637.89	466.232	5322.52	1782.45	4295.4	3397.33	5557.64	2903.4	4363.21	7947.12	4068.18	1083.36	3409.29	7918.92	6219.35	2028.57	1725.11	1967.09	5086.98	3101.96	14615.5	2631.41	865.321	948.042	9376.87	1342.48	3217.92	4359.52	3211.17	7814.54	1832.3	821.797	4527	1667.61	1620.76	2552.33	1918.26	1474.87	3450.56	2429.2	22793.7	5118.23	3326.53	877.868	314.621	2605.46	707.853	3114.88	1283.63	1732.38	2381.43	5177.94	1300.6	220.256	6116.65	1288.42	2191.86	1781.24	1577.46	5505.93	3286.39	1702.11	7689.73	3970.71	2229.09	2252.24	2669.36	2362.58	1053.73	3349.82	2191.01	8099.74	2839.7	1502.8	143.192	709.496	1006.47	480.583	13748.9	571.882	5007.83	1678.24	420.569	5143.08	5184.92	1278.84	4224.77	1863.57	4268.47	3518.71	2862.56	2936.73	3605.44	1055.2	2187.01	819.155	1806.57	1750.19	9242.21	2965.07	4097.88	5502.33	2461.35	3384.25	3861.37	6209.01	4908.03	2469.34	4182.81	8546.63	6534.76	6448.2	3701.1	2882.1	7155.58	1995.64	7587.95	3106.9	5878.94	8512.44	3625.72	2560.94	4692.6	2904.9	2080.74	5493.56	2341.62	6531.29	5757.89	5229.37	19.7119	2803.55	4615.48	2704.71	7965.62	5589.24	7875.95	4223.32	1646.62	4653.45	5554.5	2990.45	7358.08	5074.24	3234.41	2609.41	3955.97	8604.11	1711.62	5900.54	4629.88	562.419	6090.14	2708.89	2220.52	3239.19	2460.1	3458.61	2462.1	1916.12	3369.41	7030.39	7662.72	3664.12	3098.62
creatine	188.662	60.7007	166.309	234.892	58.8871	7375.2	20255.4	131.215	473.687	2923.5	3907.54	31.5119	389.021	90.8144	100.846	12.5048	43.4019	212.883	143.051	6828.02	8.08356	10593.2	242.768	1261.4	393.523	1638.38	46.7431	181.45	746.038	21.7745	46.9806	13857.7	17.3017	162.721	26.0406	340.654	107.366	39.3204	24.8729	65.7327	52.1414	1137.51	11427.9	151.121	20147.4	32.5638	567.121	34846.3	30651.3	33098.1	5286.15	1256.64	12932	2799.98	8424.16	227.334	18560.5	3853.18	150.479	54.5245	11236.3	4618.26	13.7346	25.4933	159.575	225.953	56.0073	96.768	27795	888.273	63.1191	4829.99	45.2627	1142.99	73.515	9320.55	3055.05	44.8113	262.575	10833.4	24.9473	3228.73	269.595	52.83	6154.91	5919.14	128.687	14959.4	20.1542	14594.3	908.683	29.6445	330.101	18202.3	83.976	1420.68	603.29	340.738	19076.2	149.654	140.977	2213.29	81.0614	1812.89	563.724	507.132	21738.1	32701.3	13754.9	3575.2	93.455	17890.4	124.416	339.606	186.601	98.4149	554.677	180.824	52.7192	474.945	214.744	54.3468	140.21	47.5009	4171.09	165.669	180.449	9640.16	14874.9	10585.3	25680.2	13453.5	15536.7	756.208	14911.6	510.678	559.266	16886.7	1514.77	21508.6	25022.3	121.572	1534.25	199.186	18838.9	76.1065	4724.44	215.362	30236.5	199.517	546.388	19711.5	213.242	6690.02	106.987	34.943	30.2633	0	273.295	29.1572	109.324	140.011	41.3701	47.8456	29.6838	44.3511	2815.28	28.6775	0	53.2514	33.1818	27.1899	48.9671	80.7777	41.6857	63.0376	23.57	103.981	112.435	317.975	364.458	1027.98	130.261	38.5518	59.5041	21432.7	14.8987	9621.44	19.4031	41.2939	192.475	109.705	79.872	12261.1	345.032	1101.06	2730.3	41.3378	252.072	532.534	2055.27	37.6541	9.99837	170.231	96.4359	173.128	31.2939	63.9716	327.888	2630.49	505.448	221.731	428.279	109.225	8614.39	95.6073	111.04	6587.55	29.4834	724.002
creatinine	235.861	109.167	227.94	77.5904	94.4461	6334.61	5901.52	319.347	3759.68	12973.6	20589.1	40.8616	187.114	122.14	264.038	11.7908	10.9881	356.962	1913.59	14053.8	10.9155	2147.99	1762.05	13866.8	11661.1	11556	9.5955	1236	21479	23.2896	204.555	9875.69	16.1214	844.091	13.1866	5900.83	48.5016	110.047	0	7.38985	82.9987	15864.9	9246.21	166.107	23370.9	664.838	10723.8	32124.6	14966.5	5625.76	7116.11	6307.47	12118.4	6257.07	9868.56	418.149	11335.7	6508.98	192.543	0	17097.9	44929	28.86	13.4141	45.6832	335.408	17.9648	160.674	24956.7	2222.75	171.407	43471.5	27.1122	499.325	168.293	5863.85	20616.2	357.11	8506.98	8324.75	16.7844	8846.56	1046.32	332.934	2354.68	23764.3	12746.3	18914	59.565	70097.3	5543.85	9.02349	1279.61	25263.9	43.061	1916.68	13093.3	6318.42	25463.1	286.943	92.1244	8464.02	34.1664	3270.58	538.456	135.721	20756.1	9913.31	13345.7	8436.22	15.0353	19849.7	56.3893	0	52.0072	36.4138	94.718	25.6633	20.3822	54.3419	21.7952	35.627	0	0	1154.75	192.39	101.265	16140.2	13814.7	22253	9916.1	24167.3	27516.3	292.407	16013.2	2128.55	147.25	10582.3	102.125	7795.94	28206.8	62.3649	1621.28	32.69	38052.3	26.4205	5785.79	489.073	14555.3	979.489	37.9068	13650.7	65.5967	51843.7	39.2559	12.6692	13.2954	27.4923	1294.55	13.0986	25.8786	349.395	25.529	99.0559	33.0323	37.5983	5184.43	30.3166	14.9926	55.8089	0	15.0687	61.2162	1274.28	34.829	23.7516	15.8274	7267.6	74.6713	9175.57	4629.22	198.04	344.992	289.72	24.3664	34927.3	46.9813	22267.5	11.385	76.5946	493.613	462.154	155.632	16408.4	2987.15	8.2581	18021.6	178.633	2653.31	19186	24309.8	31.7367	0	179.94	1485.57	38.3717	66.5045	56.3067	2899.08	7531.53	330.063	2783.87	5708.51	227.238	9029.83	1527.51	40.8609	3432.77	17.5781	1892.56
cytosine	8.3909	89.195	0	32.0782	600.787	689.201	0	99.4457	573.709	57.8777	292.914	295.283	40.2071	125.691	186.97	47.2494	15.832	657.107	2166.2	204.687	55.4292	371.999	90.4245	140.123	0	927.525	236.616	67.3908	210.137	19.0232	63.4425	45.8479	37.2242	2225.54	48.1452	11.9582	1105.85	45.5563	38.4501	599.712	33.4073	691.141	692.885	10.1772	264.61	36.6095	163.736	768.91	10.623	68.197	9.17162	140.934	5.8934	52.8207	196.92	75.9233	0	15.3304	53.8083	61.2102	323.39	63.2766	72.6467	17.71	142.453	51.3382	21.1008	47.8906	142.563	194.691	285.047	122.537	135.534	1164.75	104.23	70.0681	50.8289	0	0	13.1029	61.6859	0	77.4495	19.8043	0	105.048	155.322	0	0	55.2709	859.249	457.203	0	242.487	82.4432	29.6367	7.84227	3.7734	683.261	0	155.92	1419.69	36.0144	51.5139	24.7232	30.1023	40.997	658.118	144.555	79.8619	130.332	309.702	297.941	33.5603	53.6178	1235.72	34.5771	20.8246	22.1962	97.6209	170.166	109.695	118.891	0	499.857	8.53248	26.2822	81.4029	46.1929	1142.42	56.45	15.9846	0	15.6976	92.1542	42.9049	23.413	0	30.1607	0	834.531	113.045	38.3169	10.1886	30.5119	0	0	54.9093	59.0818	74.0092	105.385	75.2144	0	26.8493	20.0215	1283.96	47.7307	99.0039	273.392	1000.19	647.156	62.4286	92.6543	797.085	3832.6	476.251	119.593	209.903	719.858	134.405	57.2237	235.752	97.8757	78.1587	1305.5	1850.93	132.67	214.043	90.8426	60.7479	114.621	0	199.306	86.0853	171.407	17.4663	420.092	14.1497	563.664	188.139	19.9453	149.286	188.783	0	193.076	250.18	69.6878	4536.19	1463.94	418.573	183.874	56.0719	50.8988	12.1947	544.942	254.091	0	910.503	208.481	93.6037	30.4237	173.567	22.9992	99.2098	732.37	642.357	45.428	185.939	179.873	54.9037
deoxyinosine	4.86366	0	43.981	8.24222	253.105	10.1369	0	24.6267	57.5938	256.549	7.75927	296.922	14.7278	0	84.383	226.785	61.4335	149.588	15.3721	61.0598	95.0912	22.9455	269.298	317.164	612.468	367.671	249.761	726.47	61.6113	84.8616	406.086	71.0066	235.081	101.63	262.381	106.058	126.904	586.363	119.521	221.07	426.196	199.769	38.0074	14.5311	94.9657	9.02437	229.5	265.155	130.904	0	114.118	46.391	21.4189	204.672	217.167	100.932	247.371	343.421	0	17.1433	30.7667	402.246	23.6085	97.9107	14.8796	560.957	39.9936	219.953	95.2849	79.8141	50.1171	159.01	36.063	476.229	102.606	21.6076	98.4778	0	92.8404	10.6199	26.8933	460.901	712.809	60.5655	361.772	0	63.1765	19.4843	160.942	454.538	81.5372	384.074	368.376	14.665	96.0696	350.386	418.173	136.378	0	23.8227	35.4079	50.7466	6.10464	0	0	0	0	20.5492	0	9.97368	0	0	0	0	0	17.755	12.8448	16.5973	0	62.4301	0	23.9955	13.2695	11.2679	0	60.4698	0	87.2224	0	6.17032	0	26.2784	94.0819	42.9967	0	14.0007	11.0377	185.451	15.6967	121.488	48.4557	141.132	36.4488	0	162.281	0	25.2622	6.98752	0	0	0	8.48979	29.8379	111.797	75.9779	59.2094	82.977	99.5537	487.61	308.321	632.585	339.21	70.4961	627.178	545.349	570.861	482.106	1076.94	108.615	596.142	91.3313	986.305	464.244	239.703	512.911	1224.93	98.3602	179.416	134.183	381.752	512.869	13.6524	501.943	829.883	19.5642	329.626	28.5543	559.092	79.8558	369.047	75.9048	679.383	228.1	60.2201	356.701	86.3142	334.747	911.717	226.697	282.836	104.428	322.347	492.616	21.2817	211.505	247.839	749.618	1139.16	855.441	136.493	518.342	376.257	601.242	336.464	93.7088	190.631	469.457	192.655	170.637	214.046
diacetylspermine	32.8053	1698.54	0	296.16	192.66	208.706	38.0127	118.906	1469.06	124.719	2562.6	139.747	80.2256	128.832	313.606	27.941	38.4	669.192	470.709	5884.13	0	473.368	196.887	269.395	26.6027	1381.15	72.8733	10.5248	52.7468	85.1659	46.1967	1475.04	10.0843	341.396	378.678	41.4361	369.681	4133.31	56.2002	525.69	1054.22	136.698	1844.69	8365.87	550.97	853.957	262.005	620.404	181.519	515.852	1173.01	309.989	1754.15	3172.09	209.958	37.4601	113.988	2407.33	0	32.9581	278.139	15.3925	392.452	36.9248	1132.66	27.5197	6.36413	18.8125	806.925	21.05	4616.58	1981.33	2360.46	965.226	1448.18	2302.26	2135.51	1053.45	108.682	1808.69	16.0793	36.314	13.944	135.018	2316.96	344.325	176.429	861.18	1230.06	59.4013	317.96	113.265	500.513	532.727	401.881	1105.71	0	132.263	511.409	82.3139	4127.19	1391.74	40.8131	206.799	15.0339	157.757	367.391	46.6635	107.132	1617.89	58.9034	288.932	22.3664	0	26.3662	412.216	16.2263	20.3044	0	145.718	297.391	109.823	450.113	90.8808	2208.3	0	65.0158	181.472	438.2	468.453	121.384	341.088	1245.69	61.0293	18.7384	408.306	9.44475	129.864	741.06	594.31	2135.12	13.3789	178.614	0	2325.3	0	453.972	17.7418	232.787	189.021	8.74832	1233	347.025	248.055	101.016	7.44094	1238.9	5.97835	38.4379	119.751	63.9351	28.1104	0	171.153	90.3825	44.4454	210.509	166.602	22.0729	246.836	35.713	41.4131	9.53224	176.695	421.592	142.876	253.088	2473.25	126.5	1416.39	73.197	9.19992	142.81	161.856	491.354	632.724	892.35	188.106	2406.64	9.24421	578.647	316.489	39.2855	357.486	163.318	65.9483	2163.24	243.052	255.112	63.963	3141.6	1011.71	64.6385	48.3925	94.2171	289.361	31.972	1192.55	28.4003	18.1791	71.5351	797.976	130.239	397.562	793.29	37.1737	16.8248	4158.05	41.5952	6308.6
didanosine	86.8014	230.383	84.1565	0	4.8904	0	0	190.289	0	2.96707	33.4585	271.167	94.0308	0	35.4228	113.981	28.9429	0	0	0	26.1174	0	36.9483	97.5688	71.4358	75.6531	0	52.8524	142.073	144.058	66.8694	0	176.002	35.6366	52.0775	68.5468	39.563	39.671	123.948	117.643	0	110.418	0	5.44319	0	0	46.2924	0	0	0	0	6.56289	6.44159	0	0	67.9003	0	0	100.112	90.929	0	0	0	18.2634	0	80.0704	50.4145	85.8216	0	114.891	5.35273	0	22.2417	0	0	0	0	0	0	0	57.6383	0	55.2927	112.527	0	0	0	0	0	0	0	42.6096	43.8977	9.83696	0	0	0	28.7343	0	0	0	0	70.3166	0	44.0918	233.374	21.6968	0	0	0	46.5696	0	64.4579	30.4393	58.5294	97.8983	74.8666	0	61.7615	77.2519	57.4199	77.1954	0	0	0	26.613	226.334	0	0	0	0	0	0	0	0	0	24.4744	0	34.5426	0	0	51.2157	12.3423	49.8316	0	156.531	0	172.38	0	0	247.972	0	43.4945	0	54.2451	34.5705	63.7756	23.7792	98.8154	86.865	115.117	96.9413	83.33	96.0711	39.8006	74.7828	56.145	103.69	130.446	70.9354	80.8431	62.9674	98.7541	0	49.0073	82.5434	32.0327	0	43.6055	0	114.962	72.9291	0	51.9664	0	0	108.653	20.6016	104.453	129.833	23.8879	30.7979	154.404	0	174.18	87.632	0	0	117.352	0	0	6.69627	17.7762	135.154	47.0308	0	26.2047	131.904	124.737	94.9998	92.6335	0	55.801	131.454	0	125.987	39.5031	0	67.3912	7.12162
dimethyllysine	75.6033	83.6951	941.07	534.451	1079.24	310.248	66.4476	415.876	473.288	894.063	706.355	290.421	179.526	21.9766	693.264	108.686	1449.66	871.579	767.404	298.512	1109.56	978.729	1218.66	898.85	342.6	447.218	181.14	75.9385	1802.01	56.3555	132.497	3002.05	127.148	1471.94	221.282	240.474	149.584	610.848	141.391	1233.03	1247.48	366.604	489.864	381.379	488.105	218.821	231.182	548.075	1562.11	1428.88	3592.7	165.59	3873.8	2477.02	3214.13	75.4993	1684.74	2525.18	21.6066	64.1992	1591.85	1954.01	1677.07	1597.28	444.159	264.626	64.7552	582.372	3072.28	500.656	945.407	816.335	725.801	483.034	292.56	7914.08	1730.21	579.391	2023.43	6706.78	31.6313	2623.58	77.9575	251.113	6526.3	189.567	1319.08	782.206	601.267	2922.11	433.959	580.968	1544.75	332.827	577.797	6902.59	709.959	470.632	652.878	31.2128	756.92	1355.4	38.8675	58.3971	20.491	151.994	131.32	88.4638	145.751	493.926	44.5024	702.308	57.019	20.2258	491.489	228.88	201.338	204.945	22.462	239.372	109.637	75.4156	160.807	73.8199	243.637	14.9759	69.8782	2272.96	1887.16	439.493	261.826	366.907	877.885	614.047	64.2952	126.041	53.8258	1479.07	489.06	2984.45	810.407	53.5483	1695.2	16.172	3301.08	28.8458	3292.58	137.554	254.484	133.891	30.5725	755.823	1039.33	729.201	43.523	59.1448	716.068	158.581	134.489	455.991	249.077	209.112	29.5055	1222.94	1695.87	1574.49	674.112	158.166	944.157	1143.43	49.2207	395.786	85.4793	909.476	884.795	152.252	727.848	237.833	730.848	1074.18	268.858	103.559	896.817	222.386	902.696	282.579	79.1099	3054.75	20.9715	1452.53	2591.98	421.154	243.442	798.857	154.118	1337.31	878.701	198.411	530.466	293.635	688.056	1148.11	1439.91	1467.59	2413.82	1160.08	690.358	284.443	517.032	399.621	546.23	783.888	163.1	64.9373	1071.16	157.486	906.278	2626.9	787.218	834.255
geranyl acetoacetate	34.3694	30.4021	25.2759	103.213	22.9368	0	46.9156	29.1124	38.1275	11.389	11.8108	20.1296	61.151	69.931	77.2614	112.449	77.8329	25.7411	11.6172	31.1959	66.4246	9.31032	67.3483	26.6383	65.4338	52.9995	83.0742	101.703	63.4941	157.462	100.106	19.0588	122.309	34.3334	110.415	70.2566	29.4096	86.7311	59.0622	51.7251	43.2956	54.6822	33.7534	31.7966	24.4039	15.0968	81.4871	14.1039	19.5959	12.2921	18.0641	62.9407	29.5008	13.3194	9.98691	120.633	35.1738	10.6219	49.6095	178.608	6.98874	113.865	49.3636	70.0717	65.9336	103.636	21.7612	36.2454	16.9526	85.6792	44.6993	29.2016	40.8165	38.3922	15.1863	0	26.9512	14.1108	50.099	20.7598	151.118	17.2266	42.3892	44.0975	9.41038	11.5827	27.3413	21.3896	55.4935	17.4357	10.07	52.8536	39.2755	19.7858	44.4256	6.99057	43.1066	39.1443	21.4543	29.8587	9.91967	12.7352	129.987	51.8531	97.1697	216.022	75.7262	44.5443	27.2612	47.8218	110.419	23.5669	117.832	60.5865	97.6753	17.3886	52.1019	241.149	168.019	91.0988	204.443	117.101	29.6108	39.0478	210.386	72.8199	22.3273	17.2906	36.2154	15.6167	22.3178	80.5182	25.7085	101.373	30.0092	104.706	89.7862	24.9202	29.6018	12.369	20.9812	170.136	66.7198	76.6242	41.3442	16.5655	38.802	53.2001	98.1894	26.67	26.2607	16.1365	56.872	22.236	79.83	69.291	109.05	37.1611	81.825	105.513	91.8644	62.7407	171.524	108.704	55.0815	17.1794	135.127	34.0053	45.8167	45.8759	111.873	13.5532	99.1807	88.679	37.1452	80.1818	24.4615	17.3473	13.4024	33.1479	20.2938	68.8464	51.2453	13.0682	89.7534	55.5219	19.753	12.5412	58.6465	26.1432	10.1091	12.6306	6.51271	23.2405	49.8675	16.7614	17.3287	62.836	111.452	13.8862	15.0941	68.0115	59.1718	13.0828	8.18286	30.5978	6.23775	89.5828	118.255	186.35	16.5456	17.5351	37.8978	9.9397	0	87.4472	25.1503	9.68025	12.7459	37.6957
glutamate	2471.18	1839.94	1855.71	2783.95	2764.35	344.211	813.205	4797.11	2272	886.454	1634.65	4726.01	2253.29	2406.2	3345.36	2604.82	2216.28	3753.01	1283.5	2698.95	3426.55	1901.11	5059.43	3593.78	3510.01	3849.28	4789.74	2994.17	3942.4	452.315	2896.58	5090.78	2997.71	3004.32	5503.91	5631.43	3449.14	4698.3	2428.6	6234.06	3745.61	5156.15	3829.05	2950.05	908.676	779.999	2225.37	1937.08	9900.36	1357.46	1532.25	6883.9	4744.8	1224.07	1696.76	10198.3	6881.18	3532.37	2685.35	8750.54	8835.43	4435.45	2943.52	1738.62	9435.94	3259.08	750.014	3387.83	13247.1	4545.04	1315.71	2846.92	2564.96	5771.59	2707.39	8674.28	2217.02	709.5	2750.58	6222.07	1880.46	2549.21	4676.19	901.859	8040.9	1440.02	2081	2045.76	2274.27	4700.87	1532.78	3232.4	2076.35	3162.63	1421.22	11862.5	3974.23	2550.71	10169.2	1214.82	2316.66	1350.83	3017.44	1234.8	3078.2	2474.12	638.921	2441.19	103.91	3018.87	5917.03	11740.7	5724.2	5328.96	10245.8	2638.5	4455.2	5325.36	4995.12	5412.36	3392.42	8615.73	7207.08	689.68	3615.21	3648.02	4635.11	808.951	156.658	2807.59	6207.9	5508.64	657.433	7202.27	51.1225	2824.9	2157.93	8726.27	2411.93	5827.11	2536.24	11056.6	1060.94	4004.98	5420.69	3461.33	2460.24	9046.97	1452.4	2752.25	2018.77	817.762	5855.92	3278.25	2604.15	3359.34	4335.74	2734.97	2844.02	5522.91	4531.99	2633.3	1220.3	3971.92	4088.14	4780.9	5591.32	4768.14	4307.08	3462.76	1024.09	5294.38	2848.12	2910.88	5006.54	3617.73	2254.37	3021.2	1083.59	1076.81	5013.48	541.928	4368.14	2937.58	1762.87	4497.63	860.603	1277.39	1312.39	1632.13	1507.52	4744.04	1422.84	6142.67	1801.33	1095.83	2515.32	5430.27	2309.73	1036.21	2041.81	1613.03	4635.56	1330.31	1917.11	1859.19	5396.74	4863.27	5446.74	1439.42	1503.39	1336.97	826.621	1556.16	2490.75	4181.2	3831.92	2010.27	3174.88	1542.47
glutamine	1648.25	803.868	1001.19	592.827	893.18	617.663	632.489	916.801	1371.92	827.587	1127.44	2173.74	1152.39	567.109	1488.98	1241.1	401.08	1556.59	2003.88	2500.46	1815.15	503.004	2754.3	1522.69	2364.95	1304.56	2462.35	1206.25	1348.42	634.197	1162.47	7335.34	1618.3	1673.39	1334.21	1222.61	1586.81	1711.92	528.017	1882.07	2697.64	1613.19	3034.42	2249.78	757.689	698.993	457.028	767.809	3247.9	182.229	2741.58	1112.65	6578.05	1425.4	1375.63	1767.11	19373.2	2410.64	274.134	579.719	10887.7	2027.47	2448.67	2676.73	3897.08	1916.2	396.951	1068.54	9433.19	1301.2	879.217	634.824	1446.3	4036.85	1989.62	3325.3	1377.4	645.262	2521.59	10881.9	636.192	2727.48	1613.32	2191.01	8078.32	3231.89	374.819	1634.52	1804.48	10476.8	1655.26	868.958	2556.65	2836.59	1372.74	10770.5	1941.02	1203.61	2159.52	529.5	1536.72	615.39	571.311	239.262	975.761	251.608	1219.09	2195.58	96.1159	1157.27	153.12	3853.86	697.093	483.872	3520.69	673.982	801.32	3233.29	1966.8	578.033	68.83	488.38	609.295	227.193	139.51	1671.15	3377.18	1339.46	87.3356	2691.97	568.525	1748.72	708.48	1210.92	22.0585	3681.69	610.856	10624	1008.14	11108.8	1891.66	4750.54	175.879	2143.15	2215.08	951.549	1734.71	2012.91	487.611	232.147	106.022	424.445	1623.65	1912.06	973.765	1417.66	3452.97	1956.76	1482.31	1285.93	1903.32	887.432	1223.14	1148.46	1046.14	4439.77	2310.95	1792.52	1254.26	2656.92	1459.86	2487.44	930.585	2388.69	1938.24	826.979	920.969	3448.66	995.682	985.32	1314.05	1359.62	4373.27	1998.59	3411.73	3089.21	1060.91	2850.45	1426.02	3902.92	2359.44	3597.34	1592.15	3341.04	1677.4	1019.62	1598.58	5824.88	2286.17	2112.98	1315.28	2082.9	3813.38	583.139	2520.06	2209.78	7693.42	3065.68	1977.77	557.797	1378.96	1501.94	1516.18	561.363	8617.2	1191.9	3668.66	3473.58	2778.78	1419.7
Harman	74.5234	6.57431	80.8848	157.374	14.5628	0	0	6.30349	23.1852	10.5088	27.022	83.3589	129.466	19.5436	37.3862	262.194	20.1387	12.3825	5.02523	30.9492	79.9786	7.28314	29.9671	51.8964	13.0599	291.273	83.934	81.4654	22.739	66.8709	136.076	0	77.8369	33.953	52.1322	152.948	208.728	108.535	141.571	15.1564	38.8211	29.992	4.46158	8.04876	14.0953	17.3275	31.2932	17.8017	0	6.74434	5.10041	24.2671	5.063	17.4418	0	193.338	0	60.337	31.9537	41.1609	0	90.3192	45.2977	2.22318	33.2073	25.2804	74.0407	22.2292	7.23252	39.2602	29.5496	32.8729	13.5871	8.64156	59.4594	0	5.91365	11.5313	50.0307	0	25.7098	57.7985	55.3494	12.0521	0	6.64017	5.33938	27.7011	29.1042	0	8.47402	63.9055	54.6833	31.9677	13.054	0	51.3832	35.1577	34.9552	9.33119	10.8709	2.07245	81.9371	281.362	63.7629	26.4108	0	0	33.8326	29.5627	108.754	0	42.324	228.586	154.201	0	21.587	29.5653	80.5866	21.4918	36.1822	125.894	41.255	8.46271	10.7191	5.30014	96.8125	0	7.50608	0	0	0	0	0	13.8159	37.49	24.9149	16.2567	0	0	37.729	49.7821	0	95.6871	11.5335	12.3434	11.4004	122.69	134.365	57.797	0	0	70.0786	14.821	21.4464	20.6574	36.6368	37.6162	43.4273	22.1604	29.3688	80.7041	51.0751	84.3916	87.2435	6.61291	27.8438	81.4	27.3718	57.7374	78.8974	36.9875	20.6743	8.39302	0	119.529	87.1123	14.2366	10.9216	32.6496	48.5999	39.2861	26.3661	170.148	26.3354	6.22461	20.8184	5.3039	36.0774	15.6442	22.6207	65.4028	96.6112	0	22.2022	25.4351	12.2612	20.8606	37.8394	11.3445	0	9.06445	150.869	11.4571	4.27591	10.698	25.6547	42.6597	41.5995	8.28913	7.44049	11.7367	88.7395	14.4019	0	16.6126	6.87233	70.1503	65.0076	16.9109
histamine	334.513	6.9663	812.257	77.0129	448.646	329.12	17.3163	5.7301	89.7926	171.417	1785.71	309.747	13.4697	7.48576	177.783	28.273	7990.97	1208.7	317.405	115.478	2513.57	2594.41	29.6733	182.98	41.3492	352.194	788.501	25.4696	201.455	281.811	49.1672	393.406	132.258	141.667	18.4598	133.809	382.545	1681.04	240.283	23.5482	3164.23	12.2685	1708.93	214.927	2217.33	597.655	5797.26	242.726	77.9564	4951.04	553.154	33.0399	96.0696	226.866	26386.8	17.0227	36.1857	1039.94	23.7364	10.8871	424.03	57.1485	251.449	916.474	79.9681	73.9855	42.3108	18.1639	2340.72	598.322	138.281	989.271	16259.1	3201.4	5474.75	128.612	540.345	51.3099	417.687	80.3156	19.7417	130.214	10.6248	70.9206	110.926	519.095	96.0022	762.299	180.862	13.6632	369.359	13856.4	102.022	422.597	899.238	346.253	56.1802	117.681	136.008	190.383	57.8923	1776.84	0	0	0	12.2486	45.2138	0	49.6276	26.2649	0	48.0258	0	11.4799	0	16.428	5.55427	16.4385	8.4226	12.6634	0	37.6734	27.7528	5.5467	24.5025	0	39.6948	267.541	124.752	52.437	287.893	211.623	21371.6	81.4515	1686.14	43.2755	97.7233	110.853	0	107.836	544.101	11.1549	215.615	0	152.439	117.32	486.651	62.5284	42.0183	49.1619	23.7075	146.882	232.85	197.936	140.268	50.5099	1221.49	37.8093	44.7707	230.522	245.243	197.774	62.9998	788.05	1072.09	66.5277	105.544	241.015	504.265	33.1915	44.0003	131.321	42.9443	98.1209	448.16	84.8769	34.3336	18068.3	364.033	3518.99	5393.56	31.925	206.542	1133.29	245.813	120.923	428.266	223.696	1927.32	364.636	50.5234	363.558	14.1982	307.041	2071.16	615.128	582.792	97.1783	688.786	436.217	400.598	218.674	2500.64	85.247	1059.69	119.695	462.979	1307.06	1300.06	75.7496	22.2336	49.6297	167.435	577.717	37139.9	27.4901	606.052	505.022	450.98	832.28
hydroxyproline	12.6369	50.1514	8.65496	72.6086	29.4991	128.382	614.922	111.808	47.581	243.422	37.3632	40.3798	162.536	122.331	58.1469	26.652	11.4058	52.7559	42.125	70.2469	9.31554	95.2446	56.1586	168.69	36.9487	39.1138	17.444	11.8843	31.7512	12.2991	13.5868	30.2821	24.8326	68.7116	55.3742	22.7347	14.2992	22.3453	24.4393	38.812	26.1524	30.1395	35.3391	56.4541	11.6026	9.57236	57.035	231.2	113.291	32.6553	15.3806	195.48	30.565	12.0061	16.0897	93.8099	34.0908	224.72	98.2703	98.1046	610.02	95.3341	19.2415	26.7313	112.634	50.8556	7.70349	24.9737	770.663	24.5938	22.8386	135.354	6.89844	45.0532	19.6117	210.049	51.3593	3.37608	15.0705	124.118	16.9849	23.2549	28.1123	11.3534	124.584	236.619	107.038	12.999	485.606	93.3904	11.7142	29.4184	38.8377	47.3906	14.3445	121.731	13.5825	13.2118	455.659	10.6349	54.2351	43.6066	128.91	108.706	108.491	68.1662	278.355	1450.61	984.814	116.389	149.429	2553.37	272.245	68.5438	138.862	97.9353	108.001	40.9594	116.242	82.7192	235.813	140.802	251.43	43.3276	135.206	52.0597	150.075	21.6696	183.291	221.226	3430.09	55.3949	236.744	86.254	1737.92	425.205	127.495	24.1276	95.9989	407.41	2366.66	73.8928	142.61	33.5721	110.223	38.6775	197.64	154.309	449.474	463.857	110.108	25.016	11.6879	25.9168	14.4088	18.2523	16.2407	11.4213	18.1274	30.38	29.5757	28.9639	13.4145	22.7497	34.9173	24.787	180.435	35.8656	73.1758	22.394	22.1506	25.2291	24.7935	58.4274	104.874	58.8142	32.188	143.814	14.3206	20.9758	29.6572	17.3414	323.894	19.7947	8.70023	47.3681	9.38321	39.925	27.7136	5.79342	27.0744	33.3036	14.2348	793.748	14.1494	5.78597	76.0967	32.1434	14.5183	113.861	377.701	17.2503	16.5386	20.1454	19.9877	15.3165	57.7515	86.3629	38.7755	23.0778	14.0907	6.88073	14.1072	7.24198	296.195	91.8587	24.3681	17.0344	31.9745	76.4675
hypoxanthine	10825	6602.61	16797.6	2250.32	30399.7	3881.77	915.947	41943.1	27231.6	44789.1	15831.4	14966.8	13687.5	4951.79	34220.9	12767.4	17986.7	43615.5	6052.45	29767	59912.1	10402.6	38139.6	45207.4	30123.8	61559.6	37072.7	51223.2	24693.3	42107.3	20392.9	31666.1	17995.6	43516.3	22424.9	32287.4	59503.3	52292.2	15742.1	30974.4	17790.9	34250.7	12559.5	19396.3	11511.3	6967.87	50578.9	5990.05	15661	8488.02	22904	16874.3	30389.5	23152.5	13040.6	13807.6	13240.7	25258.6	2149.16	13266	19338.9	25971.8	25962.8	27417.6	10256	34330.9	9744.17	37775.5	17465.5	27492.3	26421.5	22023.9	15002.8	105880	27043.3	77733.5	30326.2	9151.48	25419.4	33497.2	26509.4	12222.7	52164.9	14865.9	23566.5	209.834	1481	12796.1	27483.8	17172	17024.3	16247.8	53442.3	16243.8	32042.2	23726.7	21267.6	19880.8	8404.81	912.356	15548.7	66292.5	8337.87	13537.1	3584.44	14779.9	19463.4	4686.37	2082.71	18804.9	9096.97	2300.15	13621.5	8751.8	13897.8	17402.9	6058.11	19590.9	4933.67	28307.4	18514.8	6374.86	30331.8	8217.92	35246.3	8744.29	6846.35	11941.2	1592.87	20580.4	4581.21	9413.42	32345.1	26046.3	957.043	8806.64	9409.45	23085.5	16976.9	72994.7	39439.6	8069.89	21722.8	408.118	21607.2	2655.07	3814.74	11852.4	6409.79	11579.6	5285.89	1998.57	8505.05	7424.8	5826.89	55140.7	28771.8	26557.3	23576.6	49932.9	58674.5	40625	17464.3	47711.6	43488.6	31168.6	61431	32478.5	34070.5	71884.1	10972.6	40876.2	33626.8	59053.6	94082.5	51751.4	45798	52585.1	17037.6	28055	34064	8411.91	52554.3	31206.5	41865.1	7084.32	19887.8	14806.6	24066.9	29234.5	23951.6	68958.5	17178.2	19524.8	18192.2	9526.07	18330.1	60359.1	28105.8	23826.3	21848.3	41001.1	26712.3	10915.1	18691.4	27301.9	20763	60920.6	68678.8	24720.2	14754.1	39182.2	18041.9	14658.9	8381.27	35810	32078.9	34231.7	31429.4	36549
imidazole propionate	14123	496.276	1653.85	971.049	2928.65	0	0	1035.5	3061.96	13572.9	7879.84	10670.2	134.597	2628.53	3325.55	361.345	1711.12	3041.12	10112.1	3742.71	675.323	7537.26	1011.91	1668.3	1207.13	736.651	10061.2	319.04	2077.3	995.105	871.514	1523.51	821.449	290.598	27.7197	556.808	283.403	6252.88	240.219	88.9338	105.574	302.213	5614.01	13756.4	14461.8	960.589	367.827	74.9411	0	423.329	5220.84	334.005	56.0031	4982.19	9832.78	1027.82	174.932	6979.13	192.376	121.271	8.23459	10593.4	145.203	239.748	4563.62	205.422	25.9646	182.987	20.1561	10230.3	2641.51	11262.2	9188.72	226.351	636.371	2427.49	9224.28	558.803	408.91	2033.11	99.3485	9793.65	1315.75	531.89	3610.48	26.5052	1938.2	132.011	20803.5	22.1206	1557.4	302.388	442.174	66.0595	578.228	1541.53	90.1946	175.174	435.926	499.222	20615.9	20085.8	117.298	3070.08	408.904	188.892	3751.19	28.7403	13356.2	11717.6	271.05	18.2179	183.155	131.02	345.593	3289.29	782.787	1191.57	134.788	2462.93	168.232	391.757	266.097	1219.12	7422.17	444.741	740.731	1642.69	7.54775	6.43046	1767.72	0	3417.97	416.337	154.003	4650.21	188.992	0	676.48	673.934	12379.1	994.512	2999.53	52.2011	7281.87	49.2528	3806.93	107.376	2589.26	7931.61	32.7698	15784.8	233.979	231.171	496.676	33.0857	878.621	13548.4	155.106	1461.77	352.413	51.9785	11.8505	26.006	40.8664	11.5304	606.114	95.0244	712.204	27.4427	23.3265	21.5298	27.3041	6962.99	42.3356	344.615	158.682	1995.61	144.348	8352.94	34.827	140.421	3400.26	20.3528	8630.11	1613.18	22.9308	20.4467	6681.55	16.3338	964.117	59.046	53.9509	175.536	56.0312	113.744	774.392	71.3567	542.822	11621	6925.3	16618.2	6.25714	129.587	9064.68	14286.6	17.8871	168.445	187.608	111.549	130.997	9003.85	71.491	3133.92	85.5391	317.526	55.3449	355.739	51.2239	11435.6
inosine	43.3693	367.361	37.21	225.272	957.763	12.229	116.531	197.579	236.221	3807.89	124.737	16.6382	111.57	754.631	213.671	86.9132	29.3838	122.753	32.8683	637.572	939.846	8.47237	240.117	1000.86	1747.42	1997.24	84.3761	3920.31	191.895	698.749	17.4722	254.69	40.023	65.6051	1064.65	250.675	1407.86	3755.8	0	124.159	738.267	169.684	59.3854	219.25	280.671	9.70662	117.478	96.5903	811.228	28.7197	659.759	160.627	133.886	123.987	18.8466	381.686	1700.9	884.016	0	237.957	0	67.4373	145.026	812.084	203.19	234.419	17.171	989.522	459.804	168.419	222.528	1026.82	71.8107	3547.16	296.47	1763.32	770.771	36.8968	270.788	212.679	31.4592	40.5376	922.079	141.918	1405.12	23.9947	205.557	55.9133	766.477	1684.6	9.58555	0	2270.13	128.495	411.564	806.952	1985.88	421.843	56.6489	94.8261	13.7904	135.796	256.46	2285.33	7.8225	50.3646	2298.35	18.2061	56.9608	672.158	102.298	0	1124.59	40.6474	307.254	288.5	31.207	2593.66	196.865	175.562	2819.74	9.49667	3691.16	327.916	196.384	42.792	548.426	458.492	0	186.024	1029.64	85.3642	1941.8	779.153	183.748	423.165	1004.37	169.693	347.769	4118.63	43.3753	32.5723	54.6049	0	57.8048	103.216	99.2774	71.6966	481.82	1677.46	40.2576	9.79938	24.5427	69.3473	932.217	307.292	238.344	152.705	179.791	314.293	436.659	65.8219	308.324	445.731	756.231	3085.07	2731.85	62.4009	140.078	5191.53	69.3573	507.67	36.9702	4263.76	1657.05	1740.69	623.111	269.859	1412.55	3206.43	228.554	408.451	4802.26	1133.86	1223.38	675.175	0	2076.27	200.766	55.3375	110.417	1211.01	2346.87	900.322	394.715	283.891	102.522	2730.26	9.29185	1613.07	242.61	725.839	97.9813	43.7331	421.118	1268.74	3010.48	235.541	558.627	56.3212	2318.75	3335.96	2927.97	160.555	6.22797	97.0379	105.961	472.105	694.729	4206.83
isoleucine	11835.6	470.687	6589.15	674.133	6520.31	11066.6	506.603	1732.88	7210.46	7495.78	6635.44	12471.2	341.285	1018.66	6664.16	8013.02	4682.33	9326.11	8116.38	6977.76	14090.2	7407.26	12626.4	8102.73	17219.3	6360.26	12295.8	14636.2	7413.65	6088.17	12416.8	13242.4	10576.9	10690.9	7992.16	9810.49	6272.53	7709.48	7733.16	9845.85	11180.1	9966.59	3772.53	4378.32	2706.36	5311.57	5245.51	2727.38	8857.89	3022.57	8033.68	1280.75	11870.1	9983.89	5775.34	3043.63	6459.91	6371.83	744.171	2546.89	11869.9	13703.6	13806.2	10143.3	8688.68	18999.4	7154.8	7802.01	18023.7	15938.1	6085.54	2079.9	6884.83	12708.2	9464.2	9888.08	7760.78	2729.41	13147.9	13099.7	8358.07	13472.7	15884.3	9761.94	10682.5	3769.33	3548.11	3705.39	6446.68	7491.41	6681.15	6636.64	12030.7	9325.58	7392.22	18324.9	12221.5	9175.05	5288.03	1666.98	2785.68	2964.89	506.37	301.742	983.315	383.358	464.64	1640.53	337.448	1207.74	242.09	8808.45	481.916	666.853	5055.74	544.14	959.116	6163.58	3392.88	1371.12	350.053	1185.86	324.911	306.756	361.055	1748.14	3621.54	5983.97	3091.43	6141.59	808.262	2884.23	4771.85	7919.78	964.056	4486.73	706.396	10325.9	1180.16	6890.05	7153.79	5948.34	789.86	2379.7	7114.73	1162.48	1572.15	1838.09	484.868	201.293	115.472	3924.05	2523.55	4328.28	3539.96	16436.7	17545.5	10659.7	15243	12942.7	15736.4	14707.1	9136.14	16818.9	19933	18536.8	10627.6	11210.2	8218.67	13245.7	8997.63	15630	9301.91	14079.6	14329.9	13706.8	8300.59	9813.24	4927.84	2842.09	8629.97	8184.77	13224.7	8005.4	15148.2	9707.16	6971.3	7262.76	8316.06	17963	9443.14	14864.5	6834.16	5552.66	7677.04	4270.49	8602.57	17662	12047.4	6705.03	8911.74	9831.81	17494.3	2580.54	7814.56	7938.44	22534.4	13456.3	8042.89	9496.21	5189.46	8209.99	8918.37	8538.1	14745.5	4650.37	13299.1	10591.1	12136.8	6215.41
kynurenic acid	118.376	318.987	32.1472	20.8686	326.273	134.013	85.7157	247.176	32.3804	11.5241	36.0772	283.469	503.404	59.2127	139.937	13.4871	4.13749	161.479	261.103	39.732	12.7027	30.5383	301.239	172.004	219.441	260.198	0	17.6764	177.939	0	151.851	86.3072	135.784	458.267	26.3118	105.684	79.0653	261.182	6.91039	88.568	21.2398	202.393	30.5093	181.143	101.621	3.72041	284.092	171.754	35.3564	154.722	30.7327	164.159	21.1413	53.2875	35.8672	16.837	93.7564	29.6167	88.2614	116.586	65.0214	57.2168	148.706	18.3382	459.197	468.787	73.778	230.257	107.218	7.5751	3.93852	299.2	4.40338	67.7587	19.4745	114.428	27.3228	0	167.765	10.131	51.824	38.0083	11.784	17.4068	113.711	95.8407	0	236.008	235.365	192.793	102.044	0	178.155	216.858	26.6448	62.0911	19.8372	36.3698	269.565	0	239.625	26.9576	63.4616	410.783	51.3676	220.862	306.417	173.156	357.69	369.408	389.026	206.973	21.0971	0	26.6279	576.019	39.042	204.905	6.39001	135.391	297.426	532.898	143.414	9.94515	104.974	174.297	307.208	68.7567	177.581	103.082	185.722	95.0232	85.3221	75.6852	356.402	329.551	22.3406	27.1417	1336.15	169.322	275.22	12.2542	134.163	59.7788	519.676	11.1732	48.2496	515.279	556.122	193.507	585.747	0	117.312	19.8727	140.495	13.0524	189.3	23.0597	139.822	17.8518	99.1609	31.7873	13.0693	31.8657	198.013	305.178	366.178	41.4366	95.1313	121.331	85.806	253.091	119.358	14.0657	196.561	149.405	102.241	15.7489	53.5452	139.787	139.106	0	138.334	294.748	34.6113	96.2736	278.579	68.2593	67.8233	240.786	179.713	235.454	95.7927	105.504	126.352	213.648	185.488	228.994	318.557	36.8575	302.091	14.353	103.801	23.11	168.835	7.1866	80.9493	87.4095	111.126	27.0096	212.075	4.59953	348.932	0	13.4619	347.225	254.08	19.7126	43.3569	10.1276
leucine	16341.2	795.669	11202.6	959.12	8342.9	18339.8	537.714	2806.42	9695.73	11402.7	14945	15845.2	628.168	1703.58	9228.81	11719.4	7552.29	13068	13927.7	10397.3	17051.6	8439.78	15658.8	10779	23013.5	9465.1	17094.4	18905.7	10333.8	8932.73	17527.1	29435.1	13939.7	14555.6	11594.4	13851.4	9882.23	11689.1	10473	14851.7	15921.1	14057.6	12905.2	10465.4	4221.03	5284.79	7710.79	5314.85	16777	4355.08	28559	2642.59	21343.1	16916.5	13344.3	4881.03	17069.1	16503.2	1218.19	5279.32	22408.8	19591.4	17822.8	15109.4	12386.9	27988.1	7194.01	10134.4	36570.4	20889.5	8651.91	3616.86	9108.24	16447	12112.9	24964.3	10308.8	15863.5	21532.4	33865.2	11302.4	22185.8	21183.8	15416.3	22315.4	14570.1	5324.28	6067.85	9532.06	18870.5	10146.4	9651.54	17506.8	12309.1	10240.1	37273.6	18989.1	13935.6	9161.76	5255.76	4454.36	6757	1135.43	310.902	1579.56	854.603	1061.54	4163.67	690.774	2262.96	190.106	17227.7	1135.64	1179.55	7550.89	1381.2	2153.08	7493.61	5679.34	2278.94	110.049	1936.12	497.189	445.134	536.23	2743.62	6769.09	13686.4	4453.11	14152.7	2319.97	4918.9	8967.19	13109.1	1556.66	7593.9	1141.42	15328.3	2965	30570.9	10956.5	8915.67	2182.31	3870.25	11103.7	1773.94	7019.63	3601.87	2147.75	380.97	70.4655	10318	7723.6	12008.1	11616.5	21386.7	24610.6	15311.3	22301.7	17292.8	20458.5	20654.2	14072.2	22592.5	27701.6	26357.5	14263.8	15612.2	11704.2	17871.2	13638.9	21895.8	12789	19502.5	21188.1	19871.1	10885.8	13660.9	7862.27	6169.15	12991.1	12548.1	18194.2	12378.9	21133.1	14765	9963.25	12105.1	12771	25126.2	18807.4	21570.6	10130.1	9937.67	10787	7221.44	16292.5	23826.2	16110	10326.8	16048.9	12937.3	22438.6	4641.72	26315	12476	35556.9	19494.1	12860.8	14503	9489.18	11100.4	14566.3	13516.4	18924.5	6833.71	19849.9	19961.3	18170.9	10058.7
linoleoyl ethanolamide	236.305	44.5468	18.5805	348.772	583.968	1365.51	812.755	103.194	378.905	6227.58	3007.09	966.351	120.775	620.241	352.137	48.2937	80.9931	865.096	376.965	1079.41	406.752	2334.9	109.494	701.884	123.244	702.879	901.204	44.4485	608.664	73.9829	31.6836	900.363	53.1693	1693.3	87.0359	48.1324	380.818	895.124	21.9891	201.154	896.884	147.688	2138.71	3726.88	2847.04	5438.17	200.368	429.572	454.764	3059.53	1531.57	427.318	1493.05	466.571	3052.44	302.394	521.763	2146.13	39.3849	42.5895	617.111	956.059	7530.61	562.026	627.597	235.063	13.8397	39.001	4215.6	4470.79	12172.9	912.395	144.588	181.208	115.103	36.9474	2676.69	1355.28	8892.43	730.181	26.6077	51.9582	43.2656	97.2933	82.3077	6313.22	4165.03	634.447	5622.55	1916.31	2073.95	37.951	463.781	1748.42	801.567	102.001	5218.23	2427.7	4804.23	2896.85	2402.49	1566.41	450.506	147.957	769.039	99.3994	376.201	1905.44	4703.98	7940.69	62.553	2598.03	102.536	150.729	110.68	0	57.6443	5166.62	96.2025	110.458	66.538	74.3665	78.9285	136.988	390.982	654.338	95.5212	119.728	441.823	838.43	2455.16	6955.81	1425.66	7372.3	3680.68	1404.81	2080.14	4601.39	1664.9	275.77	5162.86	73.8039	2549.61	95.1031	792.864	0	163.634	55.681	86.6367	6879.63	0	260.704	275.937	286.86	82.0423	321.332	96.2005	231.526	90.3595	239.011	201.197	153.449	91.4887	182.002	147.245	1598.96	680.044	61.9157	304.517	449.714	290.584	150.299	81.1979	4500.85	258.166	450.083	96.8194	945.277	52.0988	339.221	101.046	121.376	779.003	93.4757	353.805	925.519	315.378	70.7225	414.756	107.58	204.856	189.83	50.097	604.17	436.775	20.4385	2981.23	376.561	244.353	820.948	2534.51	391.945	53.9324	253.191	257.414	1556.27	115.857	534.392	70.4211	0	134.308	10434.4	127.578	0	2963.41	987.334	583.237	1338.17	402.883	983.415
lysine	4469.27	455.466	4553.68	474.641	3747.49	1041.89	739.637	123.909	4116.37	648.192	16849	13471.5	584.4	594.138	6050.56	5526.08	4162.56	7793.38	2441.6	6446.05	5502.82	4034.38	15397.9	11008.4	15372.4	5576.45	11663.7	5313.15	5300.02	2220.61	9458.42	26650.1	8595.95	7344.3	9577.46	7692.19	2894.28	7379.21	5668.09	14209	10462.7	4656.87	9161.62	3325.4	476.074	8134.66	4536.46	1370.49	776.681	266.717	23209.7	345.826	21700.1	10349.9	9875.06	1000.75	11761.5	3358.83	468.879	766.467	22982.2	9957.12	14582.4	8655.06	1211.77	14643.3	3176.19	7245.21	20932.7	10432.3	4282.57	2418.96	768.823	12692.7	5243.61	46244.2	5737.62	5219.33	10038.7	46527.7	2879.28	19354.8	10500.3	7476.7	45566.2	6347.6	4758.38	3184.35	6298.68	18278.1	4651.29	3965.52	11473.2	7522.3	3534.89	61048.8	14551.8	5632.71	17499.7	1205.79	3137.58	1408.02	1098.13	275.671	288.316	338.23	250.661	468.944	226.511	266.909	553.889	191.125	523.444	562.705	1567.87	351.046	248.573	570.222	1008.19	434.302	752.695	535.896	520.093	87.6415	320.881	579.44	1177.5	18170.3	43.2611	1914.93	643.752	4399.53	767.791	924.336	152.343	972.262	333.764	12895.7	754.598	23812.2	11339.5	1378.58	183.284	508.671	18296.4	334.767	2390.29	493.616	395.97	259.269	209.796	1689.35	5167.46	11392.2	10569.7	7411.52	10184.9	4115.56	7429.95	8808.08	10281.6	10748	3134.31	8090.84	18727.3	21875	13910.1	6432.37	6022.23	20359.2	6479.78	22831.8	5900.86	13002.6	17544.3	7385.6	7883.88	5356.18	6419.91	2871.6	3597.94	4020.6	13183.3	12912.1	12251.2	11259.7	5942.47	9051.68	4743.62	13988.1	10712.2	16480.9	8266.23	8644.67	7136.61	1309.38	929.286	18379.9	9630.72	6673.47	5318.41	6863.45	21615	3525.41	11359.7	9994.39	29603.7	10338.1	7224.39	7402.91	7458.59	4231.11	6974.62	2783.71	1043.83	6037.19	18146.5	12319.7	6080.23	4762.75
methionine	4623.54	772.847	2189.46	663.396	2348.35	5451.02	0	964.786	2865.68	2444.95	2424.27	5064.66	347.237	762.894	2401.26	3348.77	1880.11	4217.77	1387.88	2870.94	4707.59	3111.95	5075.9	3332.67	7647.39	3339.2	5780.6	5881.35	3400.32	1932.22	5589.85	1792.57	4291.98	4427.59	3965.27	4989.24	3180.34	4028.01	3077.03	5017.03	4683.5	4844.35	1814.12	1908.87	1369.06	1749.46	2251.22	1142.97	2674.41	1094.72	4710.26	1405.03	5341.89	2329.01	889.052	2071.45	1361.35	3419.85	606.416	2785.57	4722.77	5980.21	5683.53	3957.13	3371.8	7836.9	1769.04	2748.89	6276.53	6339.45	2182.83	1404.63	2435.99	5657.09	3232.27	4140.34	3112.06	1706.32	3505.64	6600.4	2823.33	4859.51	5272.05	3821.79	6175.49	1694.17	1775.19	1676.43	2340.25	1868.8	2302.6	2833.18	4315.43	3619.51	2843.95	8607.02	4810.8	3641.93	1212.19	1416.06	1633.87	626.047	743.133	136.477	662.592	314.172	124.306	0	67.9114	1191.8	112.083	1702.08	804.46	498.541	3109.96	437.909	804.012	3952.83	2360.5	590.901	38.8407	1076.05	248.956	206.491	471.368	1274.83	2285.2	2805.91	94.2896	1958.74	253.111	1249.64	1922.38	4598.32	17.7623	2491.07	546.743	2956.22	796.64	3354.36	2873.56	3301.74	208.121	1582.5	1873.68	651.685	1302.37	1814.71	50.6853	250.689	26.1469	673.197	2150.9	2832.46	2561.48	5772.28	7915.5	3257.32	4976.26	4140.06	5428.75	3609.78	3140.76	6738.74	7494.39	6450.49	3693.39	4891.05	2734.66	5216.55	2287.58	4872.69	2358.6	5654.25	5597.06	4899.26	2978.57	4228.65	2294.94	1446.92	3418.78	2627.5	6251.69	4151.53	6018.97	4041.16	3083.45	3829.4	4177.51	7404.87	3055.97	6132.3	3252.29	1034.69	2911.41	1935.64	3348.18	7811.36	4888.11	3113.54	1825.73	3879.65	7753.83	1126.11	2813.6	3468.02	9742.72	6437.82	4135.1	3512.98	2308.63	3088.87	4276.38	2720.31	4485.73	2427.98	5765.61	2924.65	6004.88	3030.78
methionine sulfoxide	191.942	107.359	429.054	403.676	296.719	246.805	94.8504	317.51	326.4	81.9173	157.831	401.855	207.451	215.305	323.832	147.171	264.063	318.066	160.49	281.689	374.575	471.448	323.84	234.091	380.801	324.11	382.497	495.078	269.975	81.1819	181.604	2874.61	351.954	345.736	170.058	254.988	314.851	186.944	142.966	185.742	203.216	320.503	165.987	298.169	54.8218	46.8117	101.623	122.038	309.832	116.692	308.295	213.28	541.336	81.9003	899.133	352.94	785.623	540.855	142.803	516.003	415.451	488.147	136.774	300.369	1501.89	592.287	331.115	302.142	789.134	639.138	121.639	105.296	230.031	723.349	491.41	1785.07	207.025	92.1062	173.664	1439.01	400.697	401.543	469.147	211.134	470.963	86.2259	67.5323	200.38	197.492	962.219	194.66	188.485	410.443	267.606	158.657	771.145	294.874	385.427	184.16	65.2624	53.9464	311.778	268.231	166.493	359.809	106.643	926.438	2596.92	123.933	314.506	99.207	2990.77	185.428	113.467	825.311	218.108	402.796	663.233	252.056	762.468	126.166	228.251	199.672	223.068	315.281	275.129	896.131	257.473	152.693	906.048	411.776	203.367	266.309	759.563	28.1911	302.106	240.601	607.952	675.786	1275.39	238.692	941.311	809.509	336.919	839.382	133.574	270.593	606.085	302.887	189.451	59.719	26.5407	235.314	223.608	83.192	1339.1	1593.86	1462.16	1486.55	1170.65	2290.92	1661.06	929.303	1956.59	1787.43	1000.6	1243.97	849.913	757.607	620.852	530.321	2021.82	1398.95	1170.85	1847.97	1557.2	526.215	743.192	124.788	255.834	734.043	307.885	1055.23	317.287	1020.86	342.63	174.84	160.291	178.191	656.647	290.882	669.6	291.583	366.297	363.421	287.276	749.167	1096.32	470.207	352.029	190.939	165.397	560.553	140.052	450.197	551.176	602.849	890.215	417.734	366.598	320.841	229.506	167.597	306.654	1411.95	287.5	665.367	1558.02	689.106	316.12
methylpyridonecarboxamide	849.069	663.666	271.314	69.103	678.937	66.3069	148.997	129.54	157.822	138.831	86.2832	44.008	195.379	275.064	565.682	8.43993	205.732	510.631	94.2158	313.818	121.923	23.1057	70.242	799.761	103.79	164.906	823.527	360.952	840.452	12.2788	88.8917	209.388	9.9636	324.042	35.8656	553.557	0	252.476	105.731	299.183	350.759	55.1163	138.973	1204.84	39.8065	42.6683	6.33175	1328.28	107.69	2488.8	124.956	419.791	144.457	1090.9	425.389	420.018	599.208	50.7925	146.75	147.017	196.006	742.193	110.672	226.383	189.8	26.1942	9.44597	21.7711	424.409	187.119	336.637	1535.98	94.7328	152.508	53.3891	197.983	385.853	79.1103	8287.79	45.5247	13.297	167.746	43.9908	235.002	58.7318	549.448	322.24	788.82	472.131	2129	332.722	51.609	106.168	47.7778	323.777	83.0578	354.37	265.036	454.539	166.813	1479.88	204.853	0	168.877	156.287	64.1208	218.228	323.543	94.7372	58.577	6.84299	129.861	79.2391	11.4956	6.57668	38.6376	0	364.586	0	410.183	24.9285	190.762	220.472	23.6675	158.518	4.11576	794.354	60.7184	55.6434	768.928	1042.83	215.391	537.839	54.6616	74.4176	184.077	14.4602	179.268	269.537	396.888	232.131	606.434	128.147	245.885	1667.41	0	444.357	373.967	174.86	205.947	83.7722	449.244	305.89	412.568	223.301	8.28435	35.1521	135.805	77.1451	98.303	9.54163	27.3825	0	13.9716	119.719	224.837	171.858	7.16067	166.139	185.314	11.1261	333.378	12.8358	88.2455	209.593	12.6347	31.0219	83.1732	310.317	45.413	90.3875	20.5912	61.0281	147.987	322.557	148.424	40.984	171.214	142.629	1589.19	488.276	483.196	220.237	213.875	252.285	179.146	175.97	78.2497	118.699	475.259	108.16	179.297	159.519	144.556	1621.78	97.9744	442.933	210.252	160.764	175.83	33.2292	118.084	154.403	50.3896	73.741	171.571	299.417	80.9308	213.307	69.9723
N-Acetylglutamic acid	153.035	185.746	46.6987	138.059	136.593	108.394	111.523	186.232	340.781	19.6692	36.7604	311.884	176.876	122.253	245.622	764.687	416.864	154.972	43.6065	119.638	242.942	304.345	702.435	116.251	1184.32	411.813	539.405	880.278	1083	102.757	593.542	36.2272	875.232	246.013	882.286	499.456	478.721	173.725	651.863	602.001	356.08	1060.67	88.0017	167.019	112.276	76.4463	663.432	111.636	174.458	127.313	10.0002	663.064	291.148	25.6683	96.4381	687.307	97.4271	31.9501	344.278	587.34	300.747	212.769	139.566	98.8577	221.778	359.559	419.382	229.358	183.413	354.365	62.9949	151.529	85.352	239.507	71.0867	53.0732	62.7057	16.533	196.021	23.9644	906.687	181.706	1151.97	42.1918	69.7172	93.6981	193.649	61.8348	91.3571	70.7437	90.1231	711.015	289.189	89.2037	116.928	52.4053	334.284	227.53	561.41	238.741	255.583	37.6565	240.446	69.0842	550.438	176.081	54.1085	540.043	6.94467	99.9248	943.867	110.868	974.746	1580.77	681.106	371.28	872.701	139.31	415.872	934.963	303.852	1317.78	951.019	59.4316	362.144	432.811	103.751	9.07934	9.71953	167.719	645.238	457.205	128.299	29.261	33.0866	34.4302	101.326	116.907	138.347	47.9508	148.997	1631.87	51.3818	412.079	170.578	624.485	118.974	524.252	98.93	120.155	197.288	19.8577	536.374	263.511	1215.22	1518.2	308.979	158.456	788.23	743.061	595.361	810.559	1060.12	559.802	776.066	620.559	410.172	685.466	661.355	282.557	406.538	451.409	1138.93	260.233	191.974	977.467	460.127	164.142	92.7533	47.1855	333.835	798.916	193.128	475.769	262.992	109.872	175.421	104.421	198.302	55.8025	87.5727	511.062	153.665	258.691	114.817	90.4665	95.1671	305.297	391.658	179.612	321.092	227.056	597.64	76.2762	110.38	120.961	283.004	260.22	492.203	148.935	112.139	216.144	95.5388	29.6019	340.176	333.648	383.617	72.1442	406.882	1064.56
N-acetylhistidine	2024.02	183.939	1652.17	412.669	800.962	104.065	168.359	203.646	1083.01	385.655	1209.35	2962.89	326.923	564.199	2163.44	2276.41	353.368	1271.36	3160.19	1203.53	2065.85	209.535	3999.64	36.0446	4007.88	916.814	4746.17	2956.1	1840.77	394.439	2416.67	1646.5	2204.4	3795.01	92.949	277.063	1985.77	2895.72	1613.67	1924.87	3352.25	878.946	953.847	1641.16	284.095	1370.61	1033.51	412.208	914.233	90.4433	3670.49	242.235	3719.11	1549.38	974.147	188.801	281.381	2670.79	111.859	481.68	2153.02	3222.46	1706.07	2881.71	766.044	1479.06	458.585	1396.93	2093.77	3770.56	714.296	657.128	466.368	1368.28	1419.2	5156.91	2017.68	350.434	82.0939	2702.9	562.319	1800.47	2956.04	1620.18	6609.45	1413.83	534.675	342.198	279.713	1061.5	1878.16	957.084	150.372	1361.98	1688.1	8304.09	2786	1304.78	430.784	195.991	1892.8	281.288	451.341	138.018	121.511	114.077	564.47	643.565	255.852	321.994	290.748	730.65	195.176	238.159	479.279	355.725	125.787	358.167	228.281	320.837	445.739	283.015	554.409	87.1344	339.077	165.403	478.868	1888.89	60.1549	51.6664	372.056	450.563	48.8003	686.254	883.04	339.887	162.769	127.398	1107.28	3660.21	596.654	215.471	482.313	160.152	1846.17	467.115	2736.61	281.241	1279.15	400.302	48.5006	1224.05	1114.25	6296.71	1986.91	2950.57	2211.67	1403.48	1932.55	2265.07	3869.58	2513.49	1453.6	2687.5	4037.57	3878.7	2953.71	1362.34	1111.16	5036.19	543.248	4998.3	2107.51	3180.32	3794.2	2125.6	1016.96	1971.24	1330.06	1581.81	406.322	833.087	3341.63	4423.91	4291.64	0	1924.06	1899.78	1835.13	4630.87	2971.63	4592.54	2351.82	1483.98	3420.72	321.995	1829.03	4019.99	2547.2	2325.17	1745.73	2460.59	3322.12	1031.03	3841.31	3143.29	41.8908	2502.5	1634.63	1561.75	2840.64	2383.95	2774.38	1611.09	1170.08	2317.46	4146.95	3466.56	2993.44	1620.99
N-acetyl-L-arginine	79.6174	216.149	17.3843	202.835	195.057	16.6943	356.663	312.084	137.143	110.183	82.7355	93.7138	90.9545	332.918	83.9956	234.304	29.0433	169.593	68.5398	67.5354	54.1497	20.0927	259.342	68.9903	596.117	361.53	446.55	112.192	377.528	165.562	177.308	181.166	205.669	60.1161	423.274	306.265	318.455	147.046	173.804	536.629	337.423	231.735	165.952	365.726	27.6814	321.828	253.093	174.98	174.188	11.6737	36.234	534.08	205.097	129.54	50.8571	611.119	160.838	20.221	79.4503	365.703	64.5641	588.358	43.2425	123.578	205.886	140.175	32.7929	54.5539	169.05	692.878	91.817	725.805	88.4577	281.31	128.61	32.1927	51.8107	38.0466	110.324	24.5233	57.7323	661.392	334.41	16.769	199.618	155.764	198.65	371.57	86.8803	344.307	73.0791	179.946	264.221	84.0114	94.3556	72.7495	115.956	43.4273	48.8087	97.0666	343.684	273.283	200.291	64.8125	206.738	275.906	198.796	326.554	503.342	68.3571	583.955	25.4774	352.575	286.539	753.704	112.398	116.219	416.103	247.196	653.577	296.327	639.831	564.539	198.194	170.963	282.998	51.804	71.8878	53.3029	667.775	98.0852	175.274	429.135	74.9691	51.1589	102.261	15.6295	278.181	220.673	62.7839	423.006	466.293	109.528	242.413	460.421	37.7104	314.991	379.861	99.378	142.694	39.8997	41.0275	449.082	370.715	908.188	204.443	729.985	688.841	185.143	233.834	193.423	103.462	92.5286	314.482	376.869	309.745	159.85	152.586	323.337	530.134	149.52	521.595	132.292	413.897	122.351	243.853	244.619	115.506	39.978	83.9283	66.6137	94.0397	282.854	239.26	255.388	102.46	34.0378	43.7468	51.3504	59.3393	108.998	487.569	87.4856	94.6686	40.7471	18.983	48.4109	763.633	95.4888	95.4565	258.439	81.1705	567.168	27.7716	98.1694	100.82	592.029	144.209	199.688	58.8342	19.9105	137.935	143.63	39.3654	18.2218	106.262	399.652	67.2994	458.3	104.69
N-acetylputrescine	158.416	187.05	1637.66	18960.5	1127.34	2818.28	324.172	16547.3	17173.3	17819.8	27560.9	109.031	119.222	90.6897	3488.44	212.995	189.198	24044.7	22287.5	17321.5	335.805	31577.8	1282.53	3923.75	2187.08	5369.77	305.256	153.891	1319.99	561.473	615.908	1278.73	91.3815	12668.1	688.665	258.58	579.002	4127.82	113.6	1452.44	921.528	403.577	45729.8	53805.1	42426.6	17553.8	345.757	39119.3	11170.3	48590.8	2329.4	214.592	12002.6	17750.8	4577.12	38.47	248.591	27473.2	14.2316	0	330.572	392.532	1286.52	145.053	35101	386.597	34.0499	138.082	2057.1	53.2576	19414.7	25360.7	38781.6	578.892	43268.1	1711.18	6278.13	20629.6	15685.4	4008.67	23.6869	1156.2	363.274	158.704	25925.2	2312.18	21526.6	5201.67	8307.54	1257.67	4508.65	52.0071	730.013	165.849	22058.9	6612.81	22055.9	5984.42	2093.56	24313	3693.92	19499	24.2487	1756.4	33.4061	0	3702.63	156.891	9677.58	16544.9	52.9222	420.446	0	40.0261	46.9054	1208.3	945.431	484.648	7.64365	1336.46	217.928	267.058	9694.97	4426.72	16978.4	26.7422	20.0189	1152.04	3609.96	1941.87	2349.62	3099.9	3759.64	9685.72	812.474	5744.84	15.5466	933.79	28677.9	5403.75	24079	32.6121	14661.7	19.5177	8347.55	9.31561	12417.1	12.9882	3016.89	11444.7	0	15448.8	1949.17	6036.41	131.125	211.03	251.593	48.0369	183.813	1630.68	395.849	70.6857	121.974	186.656	110.286	58.0792	3435.4	162.495	332.197	142.802	73.3817	201.875	89.2824	7060.89	671.734	539.981	823.566	22266.7	2124.73	19302.7	306.155	44.0435	17377.6	99.1836	62.971	7204.35	16.4168	17756.2	19.9748	86.5707	12011.4	5485.14	30.0905	598.977	1626.09	17142.2	6583.99	29667	631.334	26375.8	11149.7	1982.96	112.383	47.764	220.439	34526.7	70.1778	6990.44	218.117	248.24	59.5545	38590.5	375.928	3147.57	18575.1	87.7763	105.97	19209.4	114.582	1495.41
N-acetylspermidine	1247.23	1253.29	232.238	1190.02	1573.34	3673.56	341.387	2023.08	12601.7	4602.86	14216.6	3101.01	594.954	1358.34	4022.3	1265.61	1782.9	5211.81	8805.57	9428.5	188.522	3585.47	5555.95	7479.6	3326.53	21406.8	3993.45	609.102	2054.86	3548.08	2201.31	5451.73	554.945	3971.71	5644.8	2368.42	3173.43	23491.4	1795.5	11589.4	10091.3	2958.46	13435.6	16532.7	4673.91	3475.56	8438.88	313.912	2232.9	2257.12	3839.72	1568.04	2944.04	5751.24	2625.01	756.104	678.515	11933.7	71.5059	557.703	1255.31	1004.65	10916.3	3063.61	5731.75	1265.34	489.374	1740.78	2774.32	2058.19	14017.2	17083.6	2368.85	11608.7	14435.6	1215.34	5127.03	5453.68	9866.18	3249.77	976.502	3281.81	727.062	3148.06	2979.52	1027.82	1590.7	2343.82	9223.53	1244.72	3902.98	2102.71	2281.19	6133.83	5369.56	1312.68	1591.28	1530.84	4405.37	2553.19	20969.5	18910.6	477.689	815.644	307.114	155.707	634.383	386.392	539.203	1174.26	497.509	272.905	178.944	59.2384	1142.15	1052.8	66.0811	209.222	60.5982	390.736	1587.08	1684.61	4743.78	416.396	7961.76	18.5025	410.142	2936.02	560.122	7610.59	812.335	6176.61	5349.41	165.766	84.9044	373.435	152.478	1808.75	662.664	1978.27	16893.1	388.142	308.011	163.529	8051.16	63.8419	3556.38	307.442	1120.64	1045.99	104.659	11555.2	1109.18	2724.09	2183.41	312.137	6735.33	406.26	7552.62	9644.26	1790.44	2923.7	734.058	2779.6	9469.36	4704.35	15465.6	10051.4	10700.6	15634.1	6741.09	17327	982.484	8864.52	8374.49	2496.87	16705.5	9331.26	2192.37	18171.6	5277.5	91.9372	7390.96	16412.4	6538.91	3631.73	9936.2	954.987	8759.97	189.892	1208.55	5668.15	1332.59	2220.3	1680.89	299.947	4631.54	6812.87	2638.42	3370.1	13984.4	12651.7	7080.82	766.475	1191.37	9249.01	1661.26	8588.67	1818.53	422.904	284.35	5060.02	1891.56	3406.69	3331.97	3546.3	3575.95	9434.5	4824.16	21383.3
nicotinic acid	7901.74	4655.84	1151.35	3247.82	6136.1	1161.02	0	7180.64	8092.8	4915.43	6481.65	9927.58	4184.47	5473.3	15841.9	5766.54	3059.89	8046.31	2687.85	3048.62	4204.69	2185.18	11458.2	7218.57	7027	14980	9628.62	6693.63	16285.6	4942.83	6171.55	2091.31	4523.28	10382	11684	8482.28	9390.38	14225.6	7189.85	20233.2	9110.18	10477	4538.66	7074.29	2713.61	5735.03	9372.19	3376.25	1965.99	2786.29	2430.71	8572.29	4496.95	3495.72	1165.31	9901.24	243.948	9198.68	1739.86	7318.15	498.703	5776.46	4813.07	7492.66	6553.81	5131.32	2332.9	5433.34	764.512	4989.19	5116.51	4645.83	2599.32	7251.27	5863.68	3002.02	6860.1	888.197	6125.56	2257.02	5384.94	3993.75	9912.92	780.816	3148.11	404.938	1953.02	2976.25	8231.5	750.571	3822.53	7497.46	6759.7	3744.72	4940.74	2587.05	6424.58	6101.9	1405.92	1295.56	5118.26	4680.07	5517.05	4616.66	2365.89	3952.45	1946.43	434.569	837.766	6174.59	5238.82	397.953	3918.57	7278.74	10286.3	8286.63	3097.9	6893.66	4104.98	11346.5	8342.43	15452.4	9840.1	908.222	8220.16	4013.87	3158.87	952.432	487.462	2831.81	622.373	2872.6	3365.86	2392.84	606.413	2870.19	2476.52	627.4	6266.85	1534.77	9209.66	6147.93	4583.85	1771.84	6512.2	2414.9	1935.04	7533.12	4788.73	4076.16	1224.8	2323.96	8371.14	3774.2	8312.77	6503.56	7872.74	3151.36	5824.21	16307.8	9608.43	4077.7	3604.13	6982.41	7784.88	8905.17	11805.6	10964.2	12915.1	10395.8	3496.12	7982	4532.98	7699.34	12302.6	16396.5	12678	7641.34	4920.94	5222.22	7746.01	1676.51	8716.03	5514.01	4894.23	2717.22	3280.87	3856.09	3966.21	1757.46	4247.67	12074.3	3464.72	470.757	3878.55	1437.76	5306.32	9779.71	4969.87	3670.82	5320.75	9484.23	9308.38	2007.18	8317.23	6034.94	10711.3	11490.1	10257.1	2862.63	2320.38	6729.56	2475.29	3693.06	660.561	14163.6	8384.75	5039.1	7762.59	5658.76
N-methylproline	6624.13	14668.7	12930.9	5168.16	32321	8.40082	0	3782.34	2011.54	16513.9	388.64	3762.26	4303.84	11403.7	7081.25	376.088	11873.8	8641.87	208.992	300.893	4199.43	1280.93	669.546	9902.23	17486.5	1619.48	13074.1	2164.42	4284.19	24311.7	15232.3	170.258	128.248	1104.62	5417.48	646.339	4532.4	5435.9	7053.43	81946.9	21199.4	8528.46	2736.18	17663.4	51.7573	309.262	908.275	17.0275	8.27372	64.7455	287.989	7136.48	512.193	177.821	47.0425	4149.24	18.1555	43.754	4897.05	4180.81	0	2799.43	18190.4	7866.84	16011	25001.1	103.857	1127.19	49.3031	10514.1	168.645	1470.46	2537.04	2780	2180.22	108.254	271.885	1375.9	532.439	32.3992	35.3717	12045.7	201.047	1620.03	183.002	25.6706	103.942	178.723	329.376	18.4148	833.107	20077.9	399.069	32.7365	30279.6	3599.25	1925.36	1467.8	43.2879	12090.5	49.0099	64.6198	56.9615	607.115	116.112	1698.96	190.1	0	79.1851	829.021	37.5852	20.703	871.24	577.477	5657.8	892.431	139.626	1109.63	87.7617	2479.29	12546.6	622.464	16289.8	680.638	162.555	25.8203	94.2124	71.2732	56.3288	27.8601	21.3129	22.7848	22917.8	190.782	15.1794	400.404	1202.74	2322.39	107.086	163.104	0	60.4001	257.762	3618.84	30.3962	12.0646	19.3131	2784.52	180.391	54.4862	15700	74.0241	333.947	23.4588	721.805	153.159	1073.62	14281.2	6407.84	2701.36	684.666	268.545	53.0334	768.38	4702.45	1944.53	1201.59	439.933	20223.3	1646.17	173.894	15443	245.758	809.981	1529.39	323.648	40.7046	586.709	176.404	6030.4	475.122	143.727	102.234	771.559	804.268	94.1144	7293.01	1576.01	2004.23	2251.13	1432.81	1061.58	6708.66	20.888	3791.43	7196.39	7286.57	1276.02	2137.43	1807.98	0	865.011	16326.8	4498.13	275.111	56.6883	594.533	1050.5	42208.2	6188.37	4387.58	1236.11	11660.8	62094.1	16.2385	2648.56	463.891	768.733	18409.2	7287.18
NMMA	6.91623	12.0239	57.1093	0	167.38	157.379	21.1559	36.5152	27.9369	164.281	184.431	107.511	11.5461	8.61796	54.1833	102.784	60.0509	141.787	89.9874	123.286	45.3359	168.974	250.91	74.3444	43.9948	121.866	60.9641	95.6711	57.3052	12.8732	86.652	367.285	95.3702	75.3183	79.547	166.937	35.0928	253.731	167.993	107.809	322.491	80.3947	89.9003	23.2155	139.633	14.04	47.9043	125.733	204.455	96.3495	331.799	29.1868	933.153	249.206	160.527	28.0469	144.313	124.008	18.5521	12.0039	265.13	171.368	122.664	35.927	53.8419	113.178	113.621	119.55	337.255	41.673	45.9532	44.494	151.461	368.782	95.0081	1115.48	350.497	25.0551	211.808	1263.58	31.3389	185.941	23.1945	58.4817	1265.42	97.6783	103.785	163.554	49.1491	164.077	124.468	75.3014	128.967	118.24	36.525	1349.69	148.967	53.6364	229.85	22.116	199.698	105.39	10.2539	0	23.1106	22.8369	29.165	0	39.3754	29.3367	47.202	61.8627	33.9685	30.9148	44.3531	17.3445	11.3845	7.3242	0	26.3251	22.0682	30.9004	24.1419	0	25.616	5.07834	7.58619	214.24	68.682	86.7913	29.8041	31.7292	200.265	12.6708	14.3657	0	0	141.794	14.4864	465.799	202.728	13.642	40.4328	10.1022	225.015	9.94568	90.8595	0	45.9474	13.8771	7.93667	218.147	41.0841	39.7735	35.5341	32.4541	97.5651	57.7236	54.6984	69.8605	199.517	76.1591	24.1264	126.055	180.43	116.982	208.309	139.257	85.054	447.999	90.3449	109.253	125.248	58.1644	188.708	69.3289	138.513	119.832	29.3383	119.792	76.0622	41.9958	64.2078	276.897	40.2248	54.0323	42.6684	123.808	25.0293	59.617	151.814	52.6994	333.467	117.956	69.1861	17.9115	116.05	85.5061	241.439	57.0879	107.048	122.059	113.533	44.7165	45.0132	66.6981	55.115	209.436	10.5039	73.0507	70.8235	13.9261	16.2097	75.8537	26.5953	51.2804	44.6813	191.225	112.074	22.9432
ornithine	42.9918	9.34138	73.1228	13.9901	42.3715	77.1618	129.408	8.23447	63.5227	25.3866	137.944	111.367	54.6793	39.096	79.1635	54.7385	74.3812	40.2667	49.0314	150.212	50.8869	0	164.814	574.133	42.259	114.855	168.393	34.2257	33.5516	78.0219	78.2669	1856.16	45.4444	165.43	67.1831	41.3017	11.6234	126.671	93.9652	228.598	35.037	62.0648	35.3717	14.8103	16.1337	47.9445	90.0328	130.568	18.9868	12.1247	2370.36	24.9176	206.25	156.771	94.8859	199.01	68.8194	111.607	25.4832	21.4559	3821.88	13.0131	131.8	164.998	19.1659	108.984	53.1301	73.8125	1556.98	77.7254	121.546	68.2555	24.5284	99.5757	19.708	4137.22	88.2009	32.2482	185.713	1915.37	67.3996	60.5341	54.6161	74.8344	2011.96	17.0183	24.1137	237.035	81.1573	101.802	37.9882	33.4212	107.763	257.364	34.3467	2705.4	62.9594	47.4088	3272.66	6.39223	144.437	116.812	65.298	33.5542	18.3802	60.2153	22.1303	57.8735	0	12.2978	109.571	226.371	152.513	19.9656	76.0756	6.1938	67.9304	35.502	25.3448	51.3598	58.9952	19.7411	29.8586	3.88785	14.4595	10.0962	19.3664	970.653	10.2566	25.2439	26.0146	137.268	178.987	25.2077	0	17.6483	83.4559	56.1084	29.1648	176.331	19.2088	23.8981	0	54.2343	612.323	15.5576	64.0138	16.0969	74.5925	19.8845	6.42185	655.546	34.1516	47.4101	37.9423	176.768	305.747	86.8324	64.1215	196.911	167.167	158.584	31.3856	214.38	184.485	91.2069	170.618	155.452	240.13	198.717	50.5365	46.3538	82.8831	118.537	491.553	181.769	129.196	114.361	96.7924	45.2789	99.6086	18.9133	115.948	114.145	150.752	17.0898	41.089	65.604	50.5438	244.728	746.777	181.49	98.3958	39.8477	47.9005	35.2349	52.4991	108.291	149.203	63.605	490.602	84.5068	139.768	106.786	163.403	163.308	34.1203	493.11	22.2826	77.1497	60.2512	23.3189	18.58	68.3262	6.18939	170.972	193.571	207.987	106.809	19.0944
pantothenate	1152.2	768.847	263.263	561.158	1136.29	726.716	41.6147	864.794	1730.17	2908.24	828.215	2271.04	544.543	990.059	13045	1265.31	723.026	7395.35	328.46	357.537	842.961	242.483	2306.76	1546.07	2019.76	2938.76	1461.54	1457.6	3195.24	676.312	848.947	461.889	979.478	1583.31	1563.5	1507.67	1707.48	2010.85	1316.17	1467.98	1476.62	1985.29	316.678	1372.34	281.83	3203.61	2465.44	565.974	339.538	230.841	472.9	1107.48	670.352	694.221	180.585	1489.59	407.972	666.885	185.512	600.639	145.523	1184.57	1122.19	1046.21	1109.26	1133.6	312.103	695.097	436.537	954.943	787.268	983.089	617.591	1908.41	624.856	94.9913	599.698	203.701	870.502	235.952	840.586	870.903	2675.93	193.285	639.23	63.52	423.38	1100.27	556.182	148.85	924.04	1083.07	1472.75	674.733	1022.76	450.011	1426.8	1165.72	220.812	220.249	468.579	1124.81	1137.34	348.596	253.783	705.467	115.362	128.538	329.086	573.308	1378.4	66.973	972.365	1031.4	1790.35	1348.96	347.296	1003.38	1014.38	2374.18	1069.53	1882.54	1881.68	255.252	736.721	704.242	842.631	152.927	120.941	333.81	503.505	723.844	156.711	877.139	450.906	631.435	469.142	64.9232	925.434	299.823	940.864	1425.64	737.035	214.608	1161.6	180.981	327.677	1407.6	53.4607	581.178	503.794	436.133	1265.64	750.854	1451.87	1585.06	1486.71	511.873	828.139	2906.74	2300.93	1016.68	584.937	1814.48	1867.05	2225.51	1820.65	1572.68	2824.56	2097.68	420.803	1671.45	1334.85	2027.7	1535.17	2510.15	2152.5	1079.28	616.786	572.293	1408.99	235.728	1426.56	1281.52	1201.65	515.863	535.075	949.548	865.216	450.11	348.156	2038.53	369.156	90.2225	502.67	123.927	279.282	1219.9	431.25	1296.52	800.163	956.914	1277.43	418.472	671.73	427.601	1545.03	1021.15	1334.39	635.034	265.997	1224.62	374.865	332.126	30.1636	1136.17	1137.56	651.942	1740.48	563.609
phenylalanine	15573.7	1524.07	10609.6	1588.02	8677.02	27698.4	623.483	3832.75	9890.12	24858.5	19778.3	16444.1	1567.43	3260.69	9293.86	13516.9	6679.16	13103.4	28577.1	10623.5	18770.2	5290.72	17168.7	12204.6	26358.1	10047.2	18712.5	21246.6	10978.7	11737.4	17714.9	29751.6	13595.4	14541.9	11396.2	13463.5	11556.2	12722.2	10137.4	16801.6	17522.2	14543.9	16795.9	9900.79	4331.81	7778.41	7268	5015.45	22201.6	4564.4	34740	4095.32	25137.9	20271.3	8667.37	6587.9	21223.5	21045	1511.97	7701.96	20416.5	21817.8	32028.3	16356.8	14181.4	30843.9	9686.23	8649.42	38496.1	23390	8337.8	5198.62	8721.83	18134.4	12892.9	25581.4	10989	20435	11971	33415.3	10339.5	24178.1	20879.6	16280.6	24244.4	14749	9356.39	5988.43	11970	18485.5	12150	9356.01	17735.8	12350.7	11065.9	51492.6	20060.1	13881.5	7690.35	11203.3	5052.21	8708.37	1860.37	1198.1	2760.53	1378.22	1940.11	4816.56	2507.46	4622.46	357.023	12604.2	1806.05	1295.04	9595.15	10450.3	3532.68	9534.76	7984.47	3971.92	179.594	3010.24	1048.9	875.674	1987.89	4099.09	8359.07	21112.7	4264.92	12856.3	3287.61	5239.31	13107.7	15564.5	3104.34	8765.8	1655.19	18878.8	7793.76	31691.7	20135.3	10389.3	6755.19	5369.61	10484.9	2294.37	10152	4742.99	3968.59	1847.71	83.1945	10753.2	7488.29	11755.1	11462.7	20311.8	25943.2	14764.2	20740.6	15513.7	22287.1	18834.8	14403.1	22737.6	26831.1	28127	14046.8	14590.4	10804.7	19650	11707.4	21335.7	11651.4	21999.5	21663.9	18704.3	10935.6	17040.8	6908.02	14676.7	10790.3	11486.2	25383.4	12213.4	27013.5	14518.5	9493.62	36539.4	12232.3	28005.2	13934.8	21460.4	10916.6	10902.5	10378.8	6575.82	22621.6	27187.3	15847.2	11922.2	16462.9	14218.9	24768.3	3406.53	41373.2	13839.7	34538.5	19099.9	11615.8	12989.7	9070.61	10404.9	14212.6	10009.1	25156.1	7204.42	21861.2	23921.5	18633.8	10355.7
phytosphingosine	95.1357	83.4831	42.3255	130.468	324.29	690.807	967.102	104.279	633.363	847.373	743.611	295.764	114.739	99.265	557.312	627.789	122.382	1402.25	241.822	206.299	73.5045	189.501	166.59	285.642	163.862	214.178	591.936	47.8972	193.001	318.076	52.2172	91.9969	61.2381	412.636	40.0086	144.382	281.071	990.344	88.849	241.368	264.931	74.9703	353.117	464.549	105.387	1442.45	97.3123	69.6008	440.509	121.976	394.451	37.2694	148.997	607.773	772.427	47.9	278.616	1009.73	57.9444	60.7864	128.833	665.556	288.263	53.2193	541.124	176.174	24.5907	39.0304	265.436	81.2163	390.594	99.7004	149.254	219.162	313.007	40.6778	1573.61	909.674	1887.2	181.074	46.7508	65.1428	60.8416	184.399	60.2974	627.416	207.403	271.84	768.034	472.899	470.359	746.298	215.352	678.295	856.193	100.584	75.5569	46.8451	799.768	431.833	822.972	189.416	95.4072	432.662	253.709	52.7847	446.651	657.134	413.218	506.729	118.426	142.805	80.0409	43.1977	313.884	416.971	45.3922	445.502	49.1921	176.752	146.276	53.6171	601.456	158.008	192.089	30.2991	78.7647	470.685	70.9514	307.611	196.731	487.634	259.561	276.133	214.139	918.811	998.617	223.107	186.744	906.484	768.949	74.4517	124.456	70.0718	167.682	150.778	139.416	36.8265	170.842	368.264	81.3699	299.81	125.232	330.233	109.656	92.4078	108.55	96.5321	40.5501	67.6265	32.8019	43.2292	67.2814	148.345	34.6443	172.093	167.577	15.7092	57.4736	94.5278	58.4829	69.4725	38.7209	579.352	223.041	42.7193	183.051	319.432	70.8891	125.335	36.47	27.699	304.701	70.799	823.17	228.156	64.2247	207.776	542.056	73.7842	28.9909	251.83	158.169	335.786	313.484	84.721	188.934	53.8962	71.1838	531.12	210.147	2357.62	61.8171	87.2608	77.964	304.667	46.9133	118.515	70.1461	188.353	39.4089	803.988	428.74	391.521	38.0968	78.941	89.054	146.686	321.24	323.951
pipecolic acid	1994.12	1555.09	2388.34	1856.53	1047.3	347.493	0	2856.5	1661.36	210.905	501.073	1659.87	2524.22	1707.24	459.927	4765.67	2283.34	633.201	423.515	307.832	4815.41	643.87	1156.31	546.418	2005.12	1354.7	4345.52	2579.14	1505.54	1060.6	2889.42	348.273	232.221	1578.86	3367.5	3342.22	1021.46	608.1	6777.49	2413.36	1459.03	2877.03	100.177	586.825	1085.54	7118.56	662.932	545.716	31.2661	1654.79	103.458	2702.46	249.47	271.605	455.697	4091.42	11.9238	757.319	53.4283	1146.08	54.3166	1792.56	1284.12	2306.9	1680.54	3963.07	26.2694	1865.74	139.597	4861.61	1953.89	271.99	1070.58	701.519	397.459	373.348	696.929	2278.5	307.528	107.387	23.3475	1813.94	1983.28	7684	408.207	13.9013	121.01	173.589	1239.47	79.7044	436.966	3068.34	7600.52	837.327	671.795	603.583	747.846	2684.44	551.617	1037.66	750.972	83.6246	103.322	458.354	54.6494	2217.68	111.245	24.1811	572.653	818.478	2003.67	236.65	4289.63	8600.92	2739.65	1220.97	210.026	1308.49	1412.89	2465.19	1379.32	1940.5	1222.44	536.498	2109.33	92.6851	1390.39	58.8413	173.146	82.9981	154.641	32.9071	11.7119	1535.63	84.7455	2041.93	2022.12	21.6374	711.578	294.541	745.911	5330.67	692.916	5175.7	385.789	831.477	174.927	5296.89	268.975	1850.73	1455.93	231.266	552.506	181.593	882.246	3811.24	4557.47	2700.44	26.479	3123.48	3511.09	46.6278	32.218	3331.78	2075.39	1347.06	1521.1	211.27	2068.73	963.897	41.8182	479.087	25.0088	1989.57	1838.38	69.5759	1429.11	682.033	633.223	280.945	1077.75	13.0846	576.132	1347	1090.32	247.254	1489	1173.07	1384.48	3283.24	536.649	1759.47	1439.33	36.5116	2929.56	1468.59	376.821	1571.33	2683.08	136.92	954.354	834.838	1899.37	2761.72	1316.03	286.272	798.4	2395.04	1677.81	2712.69	7606.03	602.109	1507.36	823.53	109.359	2700.97	1218.96	468.699	1124.28	1972.8
piperine	324.835	320.662	54.7803	1785.49	650.867	6558.83	1568.38	411.666	9866.37	7.51779	57.0016	8910.24	277.604	1397.65	1545.69	52.785	55.441	333.055	239.921	37.3037	1493.18	2953.82	280.254	273.359	1125.19	8959.21	352.899	15.09	202.403	11770	2716.35	541.166	495.626	241.604	1022.66	614.312	745.94	220.132	582.636	46.2055	1321.47	22.9903	54.7186	69.6505	360.001	2293.57	1794.41	396.841	470.589	1055.29	721.092	324.74	37.0326	959.22	245.051	1935.49	393.381	388.614	52.5978	49.6603	363.875	4305.88	4315.75	1067.08	0	152.98	5419.58	122.209	213.456	676.201	10883.9	1247.12	3126.43	5029.89	9648.46	41.2747	3913.62	57.0494	1020.6	227.536	8.36492	704.818	757.809	745.319	177.786	254.868	4010.58	1653.05	184.165	1053.76	2754.85	108.947	1256.64	4767.43	1691.29	1234.28	298.308	137.547	876.836	845.886	82544.1	989.696	3878.75	367.217	177067	709.931	336.501	238.2	19729.9	2826.38	44909.3	4905.39	319.649	271.491	210.943	61.2403	1885.38	231.956	11384	13.5838	2891.3	35.5599	95.5433	4911.3	826.426	1266.83	16279.2	49856.8	469.758	492.986	1893.09	169.6	961.339	768.074	1463.51	401.805	54.1891	34.0283	0	672.8	270.875	9621.1	318.029	2759.38	130.732	15.3987	194.652	2667.77	6819.95	6670.28	64.7217	201.472	2644.24	2033.81	379.296	319.79	14.1081	162.319	58.4775	3884.46	345.366	15196.6	2790.59	57.7352	34.094	1362.87	20803.4	763.16	3872.03	112.77	40.903	38.8511	2348.9	281.568	36.6399	41.8086	28.2691	462.427	11770.2	5057.21	250.243	110.35	1416.51	6200.53	606.537	216.732	29.4291	173.789	1993.41	32.5515	488.859	160.557	5298.63	0	38.399	385.077	143.497	3855.64	457.974	66.19	447.719	436.211	88122.9	125.768	190.082	19896.4	96.5334	1365.31	926.624	88.9611	115.274	166.311	13.2944	44.2589	3311.8	14241.5	1531.07	83.7647	1991.36	881.683
proline	22337.2	1906.09	18155.8	4558.63	9681.54	4327.53	696.106	7053.76	10462.6	6784.19	6572.62	19720.3	3145.84	2976.12	14261.2	22675.6	15968	17615	5863.34	12309.3	21753.1	6915.03	23096.7	17551	28686	7443.29	22609.6	28399.5	15409.2	10062.2	21954.8	12847.7	25037.7	20035.3	19189.7	17988.5	10917.8	5783.8	16563.6	14303.6	20494.1	17935.6	8948.02	7769.91	2835.84	8875.13	12305.3	8585.7	41491.6	8047.58	13149.6	7298.18	22054.1	8931.32	10384.4	9013.57	25800.7	13337	3235.29	6833.13	33794	26348.5	21524	19834.3	19815.2	39661.2	16042.4	13303.8	61271.6	33059.7	8534.38	6296	10445	21916.8	15155	42830.5	19878	16075.1	19584.6	35557	18657.7	24975.1	31932.6	17053.5	38445.6	21722.5	952.847	12173.4	13012.2	30320.1	9855.92	15658.9	21955.7	13300.1	11133.8	43798.8	23036.2	16580.9	25081.7	837.722	4917.58	4282.12	4617.1	2562.56	3881.69	3921.88	2690.11	21585.2	6829.46	8853.52	3093.05	38512.9	5800.29	4256.71	11689.1	2156.56	5669.2	19073.9	9290.4	7127.68	2638.56	4329.02	3248.97	1809.82	3732.41	6212.31	10673.3	5338.26	864.458	17567.4	5371.81	10210.9	11568.1	24788.5	17246.6	12580.9	5904.19	35569.9	7514.57	41314.8	51671.6	18716.8	2421.71	8133.69	17297	3733.54	2987.11	10294.6	4201.22	3555.75	984.822	1263.07	2581.01	1588.76	2570.82	23975.3	13944.2	13478.8	17021.3	21866.8	25962.7	24897.7	21118.8	15929.7	28166.9	24155.1	18693.4	13209.8	15968.5	19465.5	12546.3	28707.7	21623.1	17882.5	18414.4	20409.8	13296.6	10592.1	4736.24	2931.67	14886.5	15986.2	19302.9	12560	16259	9120.82	8120.56	12208.9	7233.22	15329.7	10042.6	19895	7362.37	27792.2	10221	3718.19	5806.96	24635.8	14592	11447	15602.5	12461.9	17236.7	3973.85	9923.11	13213	28341.6	14305.1	8778.83	21124.5	8253.62	10164	12538.9	6824.47	25781.8	7973.48	16762.7	9540.37	14081.7	5106.35
proline betaine	123.504	486.304	2359.17	587.694	500.171	2387.63	62.5047	518.134	3408.88	66320.7	164.789	2966.87	911.808	1255.97	16293.6	1154.79	860.952	204.821	1611.94	1653.12	59.4985	14748.3	11402.5	2121.97	1000.71	2783.58	443.852	498.19	2090.83	23665.3	2109.61	1207.7	1220.08	1314.48	1076.17	690.008	656.263	4816.8	3516.55	1444.82	1894.44	1758.26	868.935	1573.53	730.942	1073.66	850.519	261.825	315.394	687.305	4986.8	555.288	6094.37	4772.32	4129.37	110.975	693.173	1503.04	221.827	202.76	17.2331	1927.55	9790.43	368.732	2172.09	1864.79	367.493	589.635	2339.66	11447.7	3277.97	1434.85	181.513	2015.62	586.441	1589.16	1805.23	3537.15	320.843	1821.6	23.3615	869.12	460.805	23.3979	748.342	2218.89	1351.87	12445.2	2526.23	831.598	1734.88	1160.22	2911.39	120.567	1383.32	804.262	2059.18	2120.76	1149.45	3392.47	1327.11	1572.64	252.924	1216.95	180.014	614.881	291.884	48.3281	906.589	4796.35	8828.41	173.28	5448.69	114.769	65570.9	1919.33	3325.68	347.583	223.224	281.97	2958.04	1755.57	149.323	155.37	2209.7	57.0421	9.43642	2242.47	1568.25	1339.72	2238.71	868.401	169.203	46.2392	68.1021	465.587	10180.7	24491.7	825.669	727.933	39.2693	1063.72	62.8802	79.5116	138.995	56.7681	603.189	1580.69	1945.4	135.251	181.904	57.1337	3483.88	1196.26	514.827	1020.58	3692.97	0	1268.38	7462.19	2217.33	1906.9	0	519.354	15057.6	858.996	3404.37	4777.8	3601.36	515.014	210.453	18545.9	519.266	4097.07	2623.27	921.358	17045	4158.19	1432.32	163.867	3179.37	0	3951.8	5632.63	4993.68	1126.59	174.214	3463.5	856.372	534.328	1934.59	1084.02	1155.41	2381.36	496.289	706.444	1992.76	1100.72	54.5212	2923.3	19.124	686.025	3987.1	2576.61	2862.72	2927.9	574.446	1105.72	23056.6	585.906	1522.63	285.374	1157.1	1927.32	47.5138	410.872	3674.88	3666.84	1698.58	2357.11
putrescine	214.978	19.5963	308.409	335.338	511.117	319.215	117.212	154.091	768.914	1663.54	2059.66	316.499	19.3314	14.0827	341.512	156.455	85.6737	753.319	2541.39	972.299	309.37	2672.49	165.498	379.951	737.681	390.609	122.313	28.6452	301.089	86.3443	353.491	133.023	223.183	807.376	278.046	481.133	517.952	443.759	93.3211	780.71	185.438	441.78	4316.76	3271.07	3022.52	650.601	257.613	1586.29	1327.54	3156.93	403.89	26.9435	1032.27	2159.91	2887.66	24.4202	301.402	2770.65	0	0	42.176	45.5293	993.711	36.4281	428.241	217.641	12.8593	250.282	228.62	118.424	1961.98	1000.2	1741.44	192.795	2921.44	777.021	299.993	791.477	1257.65	888.17	26.4259	193.872	139.197	12.4405	2341.89	1176.43	4144.67	346.445	867.055	255.802	662.248	683.398	199.033	64.2901	764.491	1779.93	459.427	227.117	141.146	1640.84	224.646	1991.79	0	82.2359	0	25.4889	169.494	100.501	413.332	164.086	34.5159	55.4623	0	66.4292	9.38704	246.054	49.5261	0	0	15.4031	26.7363	30.2848	100.295	7.29599	199.132	0	0	656.57	541.765	206.072	541.277	689.624	1355.87	212.398	294.868	46.2405	0	601.33	296.139	591.513	1534.43	12.0181	472.876	18.7645	1907.96	0	3364.97	0	140.266	374.717	31.3377	1394.85	504.92	460.486	180.355	203.245	107.389	183.467	208.064	304.152	254.857	130.592	35.4132	130.075	63.2482	50.5167	364.715	176.508	324.659	168.297	88.4611	284.507	145.499	594.845	281.906	241.37	292.331	1929.46	427.727	2215.65	197.575	58.3551	1546.9	257.87	249.669	234.424	265.653	1845.12	83.4477	71.7611	1207.17	452.717	35.4233	549.29	297.626	579.246	1890.27	726.82	330.646	1572.55	1365.03	208.859	227.645	72.9573	107.938	2244.89	646.932	530.733	1058.07	404.748	141.192	970.281	201.372	463.83	2957.18	75.5086	128.054	2747.71	525.857	456.278
pyridoxamine	1095.56	453.585	821.822	317.297	949.442	18.9829	24.8518	365.762	1194.22	727.124	488.426	1383.26	370.806	678.424	1069.13	1416.18	1228.49	1314.4	656.638	257.461	803.984	199.873	2476.01	647.165	1881.01	1621.28	2759.09	2616.6	1897.59	1626.14	1962.8	96.6336	2403.53	638.483	1978.32	2274.72	964.548	725.881	3605.5	2047.83	1310.11	1688.8	272.207	497.369	144.025	480.129	1407.22	65.3091	54.4652	320.644	211.265	691.591	489.551	599.351	161.43	791.357	18.2958	486.585	331.129	391.028	10.9717	1289.19	791.29	946.66	683.067	1354.27	2373.94	598.933	12.8618	2199.76	263.815	372.697	489.225	872.974	923.477	20.2979	566.458	1128.83	489.537	94.0443	1517.95	920.562	914.513	607.093	165.198	11.6909	96.7719	82.9569	1028.97	78.8005	1071.94	338.994	2619.71	497.351	535.475	207.804	541.41	588.919	9.56549	70.7812	482.516	375.118	714.712	80.963	349.622	188.23	65.6504	31.2856	104.168	227.435	729.618	17.0606	1292.37	1740.08	832.886	1017.28	1023.03	323.788	472.912	402.352	342.142	1207.5	773.294	229.036	495.013	216.15	1045.54	85.8835	51.6577	174.447	136.053	194.099	110.968	237.523	61.0341	119.182	202.999	32.0808	186	147.808	817.203	855.506	136.057	589.433	549.883	188.177	175.235	816.611	109.578	187.819	152.602	81.9563	1144.78	306.177	317.037	1129.07	1038.81	925.514	1672.65	844.55	1024.07	1203.55	735.392	1072.22	665.879	518.133	461.044	574.647	800.826	418.26	586.668	509.246	700.89	483.028	351.9	1289.64	459.483	35.2435	293.931	158.09	270.01	443.597	444.802	914.678	986.501	92.5463	708.723	188.781	505.185	1117.45	127.733	951.972	826.139	32.2551	484.343	64.7365	170.738	933.441	422.748	297.745	414.092	65.324	662.318	180.64	489.924	195.147	456.32	477.123	339.869	1176.2	619.267	685.269	314.253	611.958	0	649.171	368.119	1089.68	981.544	516.672
pyroglutamic acid	1123.42	473.616	749.021	352.548	568.216	427.702	371.953	558.593	969.046	558.604	764.747	1369.57	699.91	332.418	990.054	845.031	253.867	1107.62	1341.63	1679.68	1204.16	319.987	1983.66	1017.73	1604.87	817.986	1896.62	817.533	900.08	416.754	718.41	5043.72	1093.28	1137.77	942.592	749.793	1053.79	1047.03	316.359	1321.15	1908.78	1026.01	1988.21	1565.84	469.525	483.538	281.479	472.992	2225.19	119.58	1880.33	660.715	4866.74	973.975	752.463	973.563	14109.7	1791.34	133.731	261.157	7846.56	1429.93	1656.28	1931.19	2683.31	1391.29	274.093	702.041	7063.03	904.362	598.484	380.936	912	2855.81	1495.31	2101.31	909.907	457.571	1857.65	7505.31	445.51	1895.97	1042.9	1528.59	5420.4	2077.7	184.368	1031.49	1321.78	7726.5	1081.25	525.437	1862.33	1878.85	941.613	7857.29	1332.29	832.988	1593.26	372.392	955.292	369.132	251.599	115.486	693.673	104.835	742.956	1362.1	50.2244	642.243	38.211	2687.94	385.676	268.436	2384.42	381.067	490.667	2046.21	1353.18	287.961	0	207.337	273.178	126.67	35.7805	1142.38	2364.31	840.17	43.7279	1803.9	267.617	1150.57	350.579	659.972	0	2356.32	322.381	7536.97	584.064	7808.11	1285.86	3180.45	88.0675	1323.39	1478.02	561.149	1063.45	1197.75	305.879	114.812	41.4845	274.607	1017.67	1176.36	466.042	946.105	2286.41	1308.04	992.947	830.52	1278.47	549.838	776.939	749.806	696.667	2965.61	1536.8	1163.06	806.25	1841.64	963.102	1587	579.16	1684.76	1209.56	518.033	618.732	2229.09	609.507	681.441	865.964	863.491	2874.39	1272.26	2266.78	1916.94	718.556	1966.26	992.982	2703.85	1607.93	2580.2	1057.59	2215.34	1103.25	661.653	1028.97	3935.31	1464.96	1436.29	845.432	1435.72	2513.07	367.027	1704.5	1455.67	5433.55	2048.41	1288.05	333.199	874.842	1015.02	1001.7	347.711	5914.93	675.658	2506.11	2386.99	1903.53	878.325
serine	481.192	56.6755	422.551	124.29	528.192	184.865	0	175.528	460.745	311.122	468.149	906.2	43.208	94.3506	616.619	483.061	249.429	797.498	389.669	667.599	643.88	231.252	956.072	771.224	882.216	568.695	859.129	487.834	466.486	211.673	528.2	1808.24	644.779	639.258	575.45	600.43	487.304	677.992	361.09	646.581	613.201	577.212	579.977	470.248	193.416	364.914	272.225	290.268	718.971	173.71	812.63	202.644	1458	504.367	1212.34	360.531	975.267	983.943	96.4533	332.497	2013.62	838.148	961.9	515.54	987.274	878.368	208.468	572.904	2717.8	909.73	417.098	211.415	433.859	1161.28	647.598	2493.97	556.604	528.172	762.54	1566.2	358.446	935.807	559.556	449.164	1524.6	593.515	136.02	462.06	552.925	1451.36	462.131	415.796	854.219	485.821	410.911	2894.83	857.948	463.142	195.873	269.835	253.718	244.151	73.561	21.4483	117.12	69.5251	34.9841	28.9376	14.2605	135.271	24.9048	62.4943	123.364	73.8886	744.182	53.7122	112.21	745.245	458.223	93.6435	17.9131	129.732	44.2267	38.8386	50.2883	256.271	481.472	281.632	24.3577	677.686	0	527.361	514.023	706.421	0	531.08	104.496	1622.73	123.568	2028.97	463.5	751.175	24.6491	300.017	1082.47	119.768	537.018	294.573	16.347	34.8447	6.99077	150.035	513.515	568.501	252.773	629.307	1156.61	615.435	748.697	625.063	873.105	819.881	389.114	971.771	1050.48	1027.85	819.529	732.156	450.917	992.44	468.641	1155.6	531.188	967.34	1108.01	662.221	437.923	799.06	374.572	346.101	762.88	366.899	1113.86	711.175	1030.21	950.437	389.056	761.11	476.667	1006.73	645.599	1106.47	514.697	727.302	678.299	366.752	396.016	1527.44	701.395	575.506	376.048	563.874	1069.62	270.585	867.53	744.624	1951.54	900.165	605.7	609.738	524.961	514.678	501.008	484.765	629.663	370.982	1127.29	1020.65	724.117	422.514
sphinganine	3148.15	824.974	1520.63	1313.87	1669	755.964	250.737	3022.72	1433.07	2778.43	1135.64	518.921	2526.47	1750.3	1611.58	1095.55	30767	1252.81	564.141	1135.03	4216.32	764.643	1260.92	1276.79	5220.34	1985.66	6220.41	1279.03	944.449	5167.99	1199.51	229.196	1134.31	1594.8	951.527	5921.41	5032.68	2279.53	3298.12	437.739	1717.86	780.678	146.439	697.651	5705.83	4467.28	579.299	20.1221	1454.39	930.443	850.499	561.588	384.007	924.108	2398.84	1814.24	87.2824	2030.25	2118.77	1707.45	253.821	3750.32	6879	2950.48	1757.53	676.336	612.06	4860.67	555.595	13016.1	3054.09	167.564	8064.02	926	1320.46	478.989	5378.39	4307.08	2014.89	352.761	4889.89	993.689	1810.19	6920.2	978.914	533.294	876.066	362.926	1987.82	697.514	974.001	11312.6	4672.44	1818.36	1419.26	195.088	1173.36	607.786	467.201	974.559	293.089	656.854	621.374	555.042	645.45	699.496	219.543	719.649	713.04	3143.36	1276.78	192.687	1206.27	1132.5	4618.88	14914.7	2042.14	6110.4	1052.79	3298.49	4730.54	1180.59	1151.89	890.508	1827.93	286.272	385.941	186.585	197.006	557.181	244.373	781.794	527.923	5525.84	430.861	644.648	5882.88	821.615	3598.34	309.764	1064.42	846.398	1916.5	749.017	1126.04	566.28	299.471	261.165	418.119	658.74	3050.22	729.251	4393.93	1783.06	1145.64	890.754	5144.16	9415.11	573.317	2358.16	326.744	2651.59	1007.78	2290.52	1214.89	646.956	1316.71	1136.28	4084.13	2662.76	966.731	7776.71	1177.54	2528.63	2092.49	1636.27	885.615	690.033	2254.93	1950.74	2992.25	510.821	2437.66	1168.89	2456.15	1546.17	3205.35	1007.85	3322.31	1205.98	281.209	861.248	581.76	348.315	7735.3	526.407	1789.54	1075.01	8162.7	5102.31	1999.91	4826.63	2518.3	7871.61	1411.09	1765.1	226.099	765.301	9609.5	9313.6	450.891	4007.76	843.748	10731.8	324.014	1783.47	574.667	2135.92	2246.72	2498.81
taurine	22488.2	104.441	4225.86	3981.46	24.4525	11705.9	486.332	7583.43	13508.8	7664.66	8328.28	19624.7	3005.17	101.15	5501.69	39.0611	98.3902	7968.49	3673.88	13389.5	14684.1	2067.9	798.245	1234.31	60.289	2079.83	121.15	95.1682	12998.5	72.1204	64.6587	13509.2	29.9431	1091.77	86.5992	19536.1	7333.24	434.316	69.6741	317.574	15302.8	126.186	4605.71	9042.45	6293.71	14.8305	1176.45	5980.67	6039.04	8340.21	11292.3	316.688	12563.3	6566.12	7178.35	85.5778	16980.7	8266.99	66.2416	44.5585	3839.02	1340.42	11413.1	160.169	118.076	255.79	48.9028	942.26	5761.08	44.0125	11655.5	10878.4	13308	6942.42	4580.06	37116.1	33.0975	13.2435	7766.97	21677.9	48.0267	14821.5	60.2642	655.001	13941.9	2031.43	119.137	13896.9	11989	8020.6	3307.47	81.4648	936.755	14004.3	18210.2	19671.4	11813.9	6705.34	6356.46	13100.7	10187.7	1304.56	141.908	1369.67	41.7942	620.766	1306.69	186.696	5043.12	163.249	49.7713	3303.12	5479.08	185.74	61.4852	183.84	232.227	531.692	22.7016	586.117	68.4311	72.5137	5624.13	1454.26	499.065	20.818	4064.65	5498.24	278.396	6286.45	4151.15	6246.75	11618.4	58.8386	3808.77	1427.67	99.8195	2346.65	993.143	10101.5	9583.16	47.4076	371.274	0	9027.7	30.5248	3140.8	141.951	3300.7	9019.2	133.508	6428.11	1770.28	1917.3	167.848	91.6589	90.8665	23.1293	216.302	177.513	332.536	46.4648	42.0043	190.772	62.7785	13347.1	1591.02	73.7143	275.825	370.445	53.4479	199.531	58.0851	717.497	2772.9	216.061	118.091	7379.06	5867.57	3540.07	187.653	157.65	9271.29	165.356	127.066	13322	6796.4	10077.2	123.301	11980.7	6472.97	2748.5	19078.6	2574.05	4524.1	9331.77	12288.6	13473.7	242.195	6433.61	10998.5	257.726	59.1834	560.921	921.871	233.96	72.9528	1140.17	44.5781	847.241	13800.9	35.2932	17711.8	12.42	2463.99	1268.17	262.32	12648.3	18256.6	11649.2
tetrahydro-beta-carboline-carboxylic acid	67.5133	79.8435	104.544	116.792	52.8764	7.80545	0	43.3252	28.7698	29.4239	26.6203	159.987	54.0252	36.9405	77.399	185.891	197.974	101.135	20.4835	38.8346	66.6782	19.3464	128.528	129.87	127.143	167.945	181.488	238.359	108.485	84.2582	294.606	7.21763	436.171	73.5341	110.399	177.9	56.9485	86.9822	253.903	124.585	113.848	171.947	14.2798	23.9514	18.4171	75.0647	105.014	60.1995	0	29.1841	16.954	183.703	15.1941	16.7221	8.97833	144.308	7.21322	29.4561	122.014	212.679	9.32357	81.266	69.8809	51.8244	59.6809	135.064	155.234	248.965	36.9938	121.472	37.9072	75.4964	30.3748	48.3482	96.0174	0	27.2421	33.4171	27.5974	0	72.8332	114.431	53.5595	80.9403	0	11.2314	47.1697	34.0739	59.6175	8.3079	26.1716	137.602	111.371	74.2387	28.6398	0	22.962	99.3019	36.9796	84.8193	38.7986	18.1884	158.782	45.7702	180.716	138.118	30.3113	0	129.796	70.1326	115.709	121.491	229.747	232.321	108.115	68.4582	11.516	125.78	271.076	124.647	77.1735	256.516	91.237	37.152	53.6043	61.6722	101.065	0	20.1261	15.1575	24.0607	10.605	25.8692	21.192	37.0054	39.5802	43.3142	25.4503	92.0615	5.70759	97.826	212.346	38.551	30.8636	19.0785	82.36	12.2938	221.402	44.4849	51.5392	39.0127	12.0141	38.116	19.8071	68.8058	94.3396	111.315	128.859	344.548	69.0901	184.648	177.718	239.682	210.066	68.5298	47.2434	99.4687	277.011	74.9703	65.2005	168.263	179.048	122.596	73.3239	50.3411	171.385	70.1333	56.822	23.091	14.6869	89.9692	7.39216	33.9835	143.052	67.5719	16.6537	101.82	40.9581	64.4156	410.432	16.3313	53.0016	117.373	0	68.9513	50.5168	74.3842	233.899	120.079	12.7524	19.0979	43.9713	163.258	79.8081	26.7776	40.8365	86.1949	110.974	61.4865	100.629	32.8365	45.328	56.8054	39.042	8.66608	80.7334	46.9848	31.4953	43.7801	58.7346
thiamine	35490.5	2842.03	2790.67	407.506	1566.72	261.972	41.273	611.142	3476.76	37712.7	1572.5	2634.1	1501.32	311.611	81418.9	3415.92	97488.2	17442.5	1266.31	646.191	1990.16	218.273	4683.52	2755.81	4267.48	4019.07	6087.26	3206.51	3651.28	3584.11	3773.54	264.363	4999.72	2006.42	3490.45	11403	2417.47	2172.71	4327.8	5040.12	2776.03	7140.6	733.782	1106.34	1164.04	1631.07	3123.68	1496.85	192.669	1276.8	512.813	2714.09	895.364	1322.49	232.69	2754.74	40.2391	1198.63	1957.27	1122.35	393.472	3515.44	2265.99	1444.66	15346.8	3399.63	7392.83	7.13456	1255.27	4719.64	1622.71	562.229	2009.73	1726.82	1562.29	64.4443	2007.29	1856.73	18065.5	50.1041	114426	2962.99	3364.08	4140.62	383.033	47.2764	9854.02	1773.42	984.138	234.412	989.024	2020.89	18862.7	1157.61	1677.2	224.988	1983.89	3639.95	41277.7	823.573	39005.2	1493.38	3425.89	581.316	1885.36	1561.41	897.726	453.756	151.04	1299.52	2060.82	341.389	4081.75	3597.54	1905.89	3730.14	4557.43	1832.61	3403.3	1437.64	585.901	4550.92	30416.4	628.477	1114.79	1111.78	6042.82	137.718	79.8791	361.223	20077.4	318.48	201.498	1583.54	81.23	408.481	1370.98	86.3438	1393.86	175.397	867.74	5345.72	397.653	4227.88	1084.42	904.419	426.836	1680.75	1031.98	670.126	597.885	1085.29	1610.08	833.638	2756.89	2722.21	3366.41	2987.79	3013.81	1202.92	3727.79	4550.46	4236.39	3003.47	3588.98	2634.41	2188.65	5722.43	3352.1	1867.07	4437.9	2477.91	3802.28	1288.76	1798.72	4177.41	2299.18	1111.58	7092.86	904.649	4316.86	595.837	1858.01	2329.96	1870.08	2009.89	2479.69	2029.49	2099.56	4183.29	840.141	2072.05	2008.48	44.4883	908.982	1190.27	881.412	2018.52	3226.81	557.453	917.525	1554.38	2985.08	2180.41	973.604	1114.27	2562.14	15709.8	178.309	5115.53	1583.74	11925.1	1269.95	19665.5	79.8384	2015.21	2248.52	982.166	2948.05	1306.06
threonine	935.809	54.1277	761.703	61.9329	599.594	231.522	35.0684	371.194	650.339	464.036	762.554	1247.8	45.0587	168.003	696.754	804.574	312.59	1091.97	374.695	875.062	750.581	510.15	1095.55	1332.34	1473.99	773.409	1312.35	920.488	579.088	587.209	1163.8	2129.9	975.11	1056.39	789.92	943.717	580.969	953.926	585.476	934.471	993.795	725.232	806.134	677.105	340.636	689.562	505.947	363.273	842.861	278.013	1607.92	222.196	1786.56	677.898	1131.84	645.777	1811.28	1426.09	121.77	390.194	2617.79	1152.54	1512.66	1170.83	1808.1	1585.76	302.395	863.565	3310.12	1443.32	615.484	366.087	766.552	1408.56	1279.34	2374.42	842.754	935.371	1143.89	1865.01	610.115	1581.38	563.225	1146.29	1793.79	931.877	152.927	571.285	811.313	1820.9	667.424	550.537	1526.32	882.348	650.128	3953.91	1268.64	663.041	2838.84	281.189	337.204	278.494	78.0046	0	145.613	80.8634	54.5181	68.5387	26.0424	232.359	16.9116	74.3156	122.196	93.1672	883.595	56.6907	212.929	889.988	637.857	106.836	20.1316	124.842	35.1488	50.4171	74.3158	529.344	813.016	1487.5	30.3941	1008.49	54.0127	672.426	576.037	1730.63	0	925.25	173.315	2519.19	204.576	2418.69	799.068	1441.49	23.1115	586.066	1653.54	207.227	568.437	295.651	42.6459	65.2116	0	243.912	533.281	728.496	334.285	807.381	1645.95	839.048	1172.5	731.041	1218.6	984.084	942.142	1402.87	1363.72	1121.43	813.712	980.611	665.557	1250.29	764.5	1392.15	719.088	1191.04	1286.16	976.312	678.177	921.971	515.3	373.842	895.458	723.274	1493.88	832.263	1577.45	1600.72	618.923	803.375	724.529	1657.73	807.799	1424.32	768.723	971.12	861.886	471.251	707.027	1895.24	1091.58	642.434	453.24	821.656	1420.02	275.279	883.048	803.567	3470.04	1105.06	760.852	1157.09	607.885	827.134	1126.27	740.223	1011.28	481.025	1372.37	1007.02	1112.63	653.927
threosphingosine	1308.99	1932.04	721.571	732.586	3321.76	4678.2	1466.13	1366.45	2781.01	3385.36	3494.91	782.113	4560.34	3640.95	1876.28	540.057	6827.09	3114.83	183.148	1316.12	1549.66	874.402	818.67	2051.28	2012.96	1998.16	833.138	239.245	635.579	764.176	341.551	1656.26	311.459	1127.49	333.211	4919.72	3492.04	1886.63	493.44	445.208	1026.45	279.813	1626.9	4185.22	3616.83	9162.62	530.406	36.3536	4831.26	3799.05	1387.95	7408.19	1583.74	2248.55	6779.1	583.487	1218.81	8583.17	519.44	726.968	1600.03	3331.32	3383.79	1232.29	670.72	437.502	167.8	1533.35	1163.74	477.399	5276.9	1359.92	6716.85	835.146	838.1	2315.62	21327.5	17066.8	3298.08	356.187	1650.8	336.381	705.95	4901.63	1287.1	3256.04	1120.81	4425.24	3271.42	3818.41	1085.61	18337.4	4281.69	4832.12	2059.64	708.859	1099.97	696.749	1853.94	469.051	2362.14	1818.61	824.854	817.57	169.824	770.389	494.844	6276.88	5011.76	6628.19	631.864	1886.57	414.581	468.164	6689.75	6432.6	1577.67	7054.56	679.871	2824.11	2507.65	276.799	608.916	1426.7	4256.84	179.299	236.652	645.422	999.026	5866.98	2666.06	6492.42	3932.02	13640	1528.52	1726.34	5158.89	6478.15	9592.41	630.462	1537.03	361.505	3268.62	174.123	3965.97	152.507	488.885	141.272	1612.54	1867.04	1280.33	2095.36	2077.77	4037.19	945.133	359.046	6836.85	3833.95	237.298	577.535	113.976	605.116	706.898	3703.53	449.395	390.882	1050.71	329.679	2511.82	4244.47	197.614	2505.86	598.649	6540.49	1807.46	750.765	450.595	986.929	1448.75	1537.24	2007.29	124.151	1065.91	896.679	1177.32	1828	639.527	803.821	1207.94	393.747	393.379	1059.94	196.2	1739.5	5970.59	557.822	1703.21	247.702	3997.95	2755.52	3293.83	6033.11	1075.72	16725.9	4357.64	1838.18	235.814	894.09	1738.12	1138.62	337.708	9990.41	387.754	3210.96	339.574	2583.1	1188.86	4811.77	953.444	2460.53
triethanolamine	215.134	58.8638	348.819	1464.73	33.9602	148.673	2008.32	218.661	54.2071	87.362	46.7256	33.7888	515.197	33.5256	42.9273	32.7643	365.019	18.9126	20.3837	56.9204	16.1718	5.60812	32.1532	24.3825	187.634	119.577	65.3842	31.1283	26.5818	85.8132	111.346	43.6016	19.7752	220.544	103.492	36.077	158.529	25.9397	142.383	18.0273	97.1257	524.451	9.93727	20.0044	71.6251	26.5852	121.851	144.211	319.121	23.7478	27.7709	301.193	16.584	32.3982	49.928	590.651	53.0331	45.1607	218.126	69.1109	33.2505	21.6565	73.3448	0	228.352	28.8009	18.09	195.536	132.549	54.7615	42.4555	20.8989	0	653.485	0	73.2541	25.5345	11.1759	298.09	26.2714	186.712	16.98	79.752	196.51	17.8784	168.943	24.607	144.661	49.3316	66.53	16.352	17.5634	29.8704	26.7932	34.1087	36.7648	71.7436	79.0486	40.6984	158.602	15.1987	16.74	84.2111	434.014	36.1798	1032.21	295.773	864.205	49.2003	303.349	96.4281	628.595	805.345	57.6205	53.5531	62.7509	30.0646	750.702	315.499	59.1515	147.349	96.0979	156.463	14.2735	36.6941	223.015	51.2564	33.3915	142.549	23.5654	292.646	209.04	287.317	181.912	114.83	190.768	63.9768	54.5765	37.8305	45.7412	19.5811	327.23	10368	1085.89	69.3413	30.8788	305.813	70.1915	409.217	55.9018	51.4171	19.6611	98.6679	43.7427	69.8364	20.5506	13.4632	121.499	50.2077	21.6068	26.2867	175.621	63.157	74.9614	39.8367	49.7476	35.609	7.12452	40.2247	40.4191	44.5321	93.6503	82.332	9.10612	77.828	96.1405	22.5674	0	7.52015	26.3724	272.608	66.6462	44.4728	58.9221	49.2101	69.381	51.1066	11.1757	11.6964	26.5367	249.076	23.6614	75.5877	110.87	150.465	10.8152	20.1059	38.2056	13.8537	105.316	25.635	32.9939	24.5975	22.1949	21.1776	342.721	54.0439	35.9949	13.2972	60.8864	83.1428	19.7417	159.39	16.5299	43.0452	58.527	94.1262	42.6251	59.2018	16.4718
trigonelline	5368.35	414.006	67.0933	258.285	172.768	4.7454	326.891	2041.13	1766.44	1759.87	808.889	262.08	227.013	7252.21	5716.84	14.7017	11.6058	1072.24	2661.27	172.877	673.312	1627.91	1494.41	1190.76	1927	766.565	10.6558	855.114	3429.06	363.915	230.74	121.249	25.5826	607.535	37.262	497.607	2345.08	371.996	0	3810.41	535.326	1253.85	8664.27	194.327	1757	87.3954	66.7988	1867.52	170.297	7873.65	85.7862	1344.17	83.4006	110.163	18.6442	68.7114	492.647	89.624	76.2018	0	1714.49	10691.7	1892.21	238.952	1013.05	300.006	616.982	145.572	606.338	768.177	1180.81	70.3587	221.861	3448.61	1369.48	49.0189	1205.27	232.129	1854.75	722.743	13.5808	3375.5	230.11	393.621	440.036	477.449	560.3	441.944	412.473	26248.2	600.858	15.4285	396.048	372.818	3774.47	145.497	1489.18	587.169	83.387	2644.99	27.752	2447.28	25.1205	249.013	112.883	130.647	188.761	4270.07	637.315	63.8676	44.6195	45.6747	20.8598	321.818	208.74	3308.1	20.2109	8.2088	16.8941	954.428	233.514	233.26	762.03	244.471	218.441	86.5251	987.494	28.2755	194.394	49.3073	165.585	944.955	24.3219	74.9308	64.8179	51.4844	13.5413	1012.24	47.1615	3622.16	1504.04	275.503	52.7842	61.1625	28.7251	101.227	334.788	1605.18	752.32	1542.32	254.777	106.539	1796.02	448.735	927.173	27.9298	684.783	12053.8	397.796	30.9504	73.2254	229.648	85.4026	657.805	285.083	2298.49	202.965	66.2366	440.145	4414.81	30.7384	232.495	32.6975	597.774	318.438	41.8153	1913.37	327.932	1396.36	206.182	6129.91	64.6715	895.097	976.267	424.794	5136.99	207.723	136.871	871.242	458.249	1065.35	1878.53	1196.23	110.948	553.938	508.311	176.899	778.877	438.037	1362.78	559.791	4476.74	251.038	2235.8	1731.59	519.969	218.003	172.282	2859.31	611.248	80.0845	1755.15	3392.73	3308.78	21270.7	279.67	90.3422	324.01	182.036	2303.14
trimethylbenzene	110.583	301.062	49.3334	522.618	120.35	220.93	86.857	45.7939	45.4283	244.506	252.753	29.4993	70.2	106.158	30.3631	116.914	28.5655	22.1574	265.172	22.0932	83.6646	199.286	70.5248	31.5783	77.5712	126.563	79.9168	95.629	79.071	221.842	234.241	107.335	182.116	65.9619	94.0695	371.487	419.178	93.8936	104.412	54.6903	39.7533	184.942	116.137	65.2623	107.011	54.4354	74.391	69.8493	15.6503	152.972	25.8177	376.641	227.723	481.959	128.086	89.4482	22.4073	26.0614	212.236	139.634	108.085	62.1585	61.3136	78.3044	277.507	225.509	96.9097	32.7078	17.7494	82.8032	62.4858	94.4796	47.0304	35.5635	43.8782	32.5401	37.3013	33.2071	56.1102	20.5614	76.572	66.5577	38.5519	54.2087	17.1423	12.12	32.2715	31.8835	24.2903	14.4225	37.3701	43.5703	58.1748	48.462	48.5533	9.66449	33.6906	64.8086	33.1525	32.7711	43.1259	170.054	282.535	512.457	137.074	48.8934	52.2168	204.921	100.759	64.5203	126.566	58.1252	208.292	994.1	76.647	622.3	444.179	72.7251	135.588	510.315	167.316	173.853	129.417	33.8917	62.076	62.6488	69.2785	35.2505	339.354	67.0388	0	40.8034	4.76283	44.0897	480.849	42.9685	81.7809	25.3844	103.577	15.9645	43.2995	175.173	63.8412	121.168	34.4313	48.9305	49.5534	105.689	134.429	35.7117	299.055	27.9667	256.908	33.3641	46.4946	199.543	63.3284	419.359	89.708	36.5991	62.5529	115.219	164.506	54.0066	75.4802	82.8592	61.4988	44.2143	135.732	46.6798	463.71	55.676	145.765	60.0191	42.2666	130.521	36.1502	26.0679	32.9151	151.882	88.709	228.262	26.8214	82.5103	100.754	41.6291	30.5673	38.4459	59.9241	39.2339	70.1102	30.4287	47.784	33.7879	97.0454	38.3297	22.5902	62.2056	0	25.6328	25.0485	39.4628	34.2702	31.4625	21.2625	60.3728	52.6735	38.9561	104.014	185.175	40.4108	34.5468	66.0767	138.934	262.747	40.9039	61.5551	68.1739	138.404	121.449
trimethyllysine	244.588	105.54	508.638	153.133	569.729	180.152	1783.17	86.4864	1086.86	3875.81	563.581	1749.23	114.101	67.2075	373.992	527.684	649.01	1004.93	275.891	9430.45	255.966	5417.11	609.928	1490.88	838.17	2614.29	419.418	190.833	895.872	317.032	440.458	4952.35	561.863	957.327	1471.29	637.013	493.969	1250.36	410.114	839.087	1371.64	755.558	1246.82	376.282	282.541	248.065	2008.24	8201.65	4493.76	12215	2584.33	519.143	2242.11	1505.76	3765.16	184.311	2501.86	13123.3	58.0532	317.531	5930.77	3151.62	621.612	440.983	338.945	477.661	458.349	904.305	10106.4	491.86	582.164	7187.68	432.011	1272.52	606.336	4302.63	386.032	792.365	832.245	5011.64	166.048	1432.09	358.698	411.849	3321.89	8970.88	1819.67	210.703	641.38	3255.29	329.408	5926.14	1011.36	706.507	341.8	3206.14	549.144	841.012	11490.3	143.883	806.251	6455.41	89.6052	6316.77	170.744	53.6946	1212.37	1251.81	132.817	3088.71	150.005	5228.54	319.257	76.3778	381.687	95.0879	516.132	194.209	77.4865	80.0694	65.1921	155.165	109.207	38.135	444.308	67.1343	123.072	8738.5	4342.49	959.458	20294.8	9716.2	21679.8	180.228	1535.64	228.928	62.6747	6341.27	153.653	7014.97	11350	218.793	1997.73	140.34	13259.1	71.6345	5806.07	43.1169	90.3434	133.378	58.3827	267.2	5676.94	1620.95	444.482	128.934	1094.71	377.367	381.916	594.007	1374.21	962.01	256.77	1369.83	867.915	863.114	1518.4	1033.8	666.552	9210.58	385.413	672.121	784.275	994.667	612.657	728.368	667.454	635.517	390.737	9133.03	1240.82	606.67	726.908	537.884	463.452	1178.83	244.909	1132.06	181.706	433.488	829.715	400.132	646.347	14514.7	351.421	472.349	3175.66	587.88	457.235	457.523	1294.16	444.457	921.274	572.86	637.126	1048.62	783.733	1357.36	501.074	865.147	234.909	420.773	519.067	494.11	5364.68	344.708	781.34	1444.8	766.242	2648.08
tryptophan	3497.4	278.66	2432.36	325.284	1936.77	551.492	393.24	577.661	1944.41	6058.39	1970.79	2961.49	420.864	545.366	2028.66	2150.11	925.303	3018.65	1292.72	2608.67	3363.24	781.988	2973.13	2741.09	3883.98	2026.36	4223.62	3144.82	2155.1	1369.95	2547.11	6784.79	1416.35	3432.12	1761.83	2269.08	2411.53	2534.7	1637.15	2714.2	3632.05	2324.77	1781.41	2556.79	839.277	1658.58	1242.06	850.286	4286.43	1508.09	5152.07	739.372	4643.4	3336.75	3813.31	1225.8	3565.04	4018.19	321.618	1318.46	5428.37	2846.87	3882.41	2914.82	2796.62	5305.6	1523.31	1723.83	11412	4628.9	1870.87	1780.74	1988.53	3860.31	2720.15	4925.96	2262.07	2961.83	2624.64	6084.92	1432.5	3965.35	2225.39	3586.25	5885.52	3288.95	4711.5	1094.01	1917.55	3182.74	1763.63	1273.73	4478.41	2167.57	2182.11	5630.37	2948	2366.63	12513.9	1213.69	1919.99	660.357	275.28	110.544	437.072	306.017	289.846	1620.7	1249.91	926.976	117.646	6705.07	245.803	294.551	1849.25	493.678	527.732	1789.63	1285.85	769.902	112.647	498.333	306.31	185.05	1893.21	635.425	1593.07	4944.14	211.375	2979.86	220.215	1360.59	5498.34	3095.6	68.0568	4401.03	325.654	5368.05	754.513	6656.91	7504.13	1675.07	584.661	957.431	2842.86	301.3	1423.45	965.71	132.431	300.168	18.7889	1392.37	1794.72	3101.88	3129.58	2982.11	4720.03	3437.56	3562.41	2680.46	4048.31	2947.54	2258.5	4395.92	5078.46	5837.8	2641.16	2370.03	2121.51	4201.25	2211.36	4109.68	1825.69	4240.82	4936.47	3405.24	2368.22	3723.25	1243.51	1040.43	1951.07	1667.55	4436.47	2286.77	6189.61	3021.95	1653.25	2575.17	2699.71	5712.45	3545.15	4430.37	2152.04	3125.21	2251.05	1386.43	1945.63	5808.39	3314.73	3763.98	3880.03	3145.75	4377.9	700.062	3519.99	2977.4	8079.84	3904.24	2059.8	2713.23	1609.75	2174.41	2588.63	1898.01	1224.04	1370.12	4843.07	3618.26	3950.49	1935.27
tthyl hexadecenoate	2089.11	7342.11	340.747	3807.8	7540.73	7618.31	2935.44	1749.69	974.969	6181.79	2117.84	377.184	1858.32	7175.89	660.743	1406.64	735.388	314.579	1278.22	380.731	3043.29	10085	840.465	1230.2	488.614	5645.89	2019.26	1306.46	2248.97	961.771	1121.73	2400.55	6207.03	888.597	1046.09	452.706	5295.54	7259.34	1022.35	1901.97	1660.37	4171.5	5705.46	2764.73	4007.32	3550.94	1408.28	2480.19	1570.35	6488.46	748.163	1301.74	235.125	504.674	5802.54	3378.71	170.209	1074.16	4348.89	2440.18	3448.02	453.827	3382.55	1033.9	1349.77	358.68	4998.07	1311.7	648.674	935.431	2582.85	280.835	2515.99	692.725	2069.98	54.3736	1177.62	4544.86	5481.31	102.054	613.034	3477.4	1724.41	1516.5	116.046	1046.65	5267.37	426.791	640.064	698.537	1658.31	2120.01	6441.63	1994.52	2293.43	678.956	737.241	1011.32	907.633	1248.29	953.15	14196.2	10233.7	1463.76	1565.69	177.911	1508.37	41.0067	5621.72	2551.08	4083.93	2643.01	16224.1	955.879	3944.23	24831.7	5282.66	500.81	5674.35	1374.65	3099.87	6145.46	4639.79	1279.27	1217.83	468.309	3393.79	787.7	1727.22	1919	1213.96	1205.41	478.675	4044.44	91.4253	594.612	860.221	738.912	4204.4	284.85	2034.68	3570.23	1043.15	18122.2	1121.07	2409.43	948.959	1054.16	520.258	2112.61	22419.4	1149.46	1242.9	1230.69	5705	3912.18	844.338	3017.27	6739.58	2732.45	1877.86	5127.32	1071.21	4734.71	3624.95	2666.32	2619.84	1268.67	9001.58	716.453	1466.25	1748.01	7441.79	3136.29	846.689	3771.75	4257.52	1492.76	758.818	10617.4	2154.13	13369.8	629.013	2007.03	5122.7	904.231	2668.85	1405.64	2553.11	955.198	3237	632.333	676.614	567.907	1551.2	6251.79	1087.12	4529.29	1547.23	1026.45	1349.36	1617.56	766.544	839.008	1660.72	2890.14	1514.21	1947.72	3430.42	21828.6	489.358	2609.39	1727.45	21811.3	11362.4	1535.84	1229.83	3561.05	21508.5	3506.15
tyrosine	2597.23	415.725	1633.4	481.283	1610.65	4586.6	76.9979	886.442	2110.3	2043.01	3427.11	2978.76	321.11	713.741	1909.75	2505.92	1247.22	2742.85	4809.88	2036.04	3399.3	379.64	3199.87	2189.9	4927.35	2065.43	3468.15	3915.16	2219.08	1966.49	2967.3	4675.49	2331.88	2752.07	2025.13	2816.41	2181.07	2407.43	1876.53	3070.83	3308.04	2887.07	2634.95	1633.54	358.681	1493.32	1396.05	969.408	4248.88	270.703	5598.74	833.726	3339.6	3679.44	1462.01	1398.97	3171.23	3494.86	312.048	1632.29	94.9621	3742.58	4401.81	2908.97	2151.6	5387.79	1322.16	1800.2	4319.05	4138.4	1615.11	1237.74	1675.58	3816.44	2482.27	4733.22	1817.08	1542.12	2581.39	6207.65	1950.07	3861.07	3671.67	3051.9	4852.5	1425.58	3906.51	1284.9	3192.94	2806.34	2386.38	1843.6	3395.33	2298.13	1774.17	9722.13	3419.22	2566.25	869.449	3754.17	1196.66	537.552	390.477	316.56	464.707	258.335	355.713	945.394	727.653	1281.56	66.4456	359.341	472.446	272.761	1999.71	3146.94	668.539	2221.91	1376.24	766.534	74.8596	522.098	353.183	135.807	632.459	705.694	1522.3	3572.16	704.931	3045.07	542.35	1295.38	2855.31	2925.63	235.991	1904.06	265.306	3325.29	896.928	3708.64	2398.36	2195.68	72.6936	1038.77	1771.96	267.313	2232.66	1137.26	201.949	494.803	10.7864	2285.83	2084.65	3058.26	2855.77	4029.49	6307.21	2961.34	3803.47	3175.3	4287.4	3701.67	2966.2	4395.64	5447.98	5855.01	2840.48	2889.34	2161.49	4517.23	2256.68	4433.25	2183.42	4289.49	4207.07	3761.45	2319.82	2968.63	1537.38	749.07	2119.13	2052.21	5246.27	2505.65	5188.55	2950.97	1775.62	10964.5	2282.25	5754.1	2628.67	4240.71	2172.29	1838.85	2098.97	1301.64	1652.94	5823.72	3247.31	2448.21	2605.73	2592.92	4906.44	706.299	7407	2764.07	7238.99	3467.58	2519.69	2550.24	1659.94	2112.67	2841.77	1843.9	1264.08	1514.03	4025.04	4505.66	3744.15	2219.57
urobilin	205.886	258.947	317.37	37.8104	0	0	0	0	10.5184	0	18.9176	25.7511	2915.87	74.2921	0	23828.6	9194.65	206.265	0	10.2034	348.182	8.69173	5019.93	4784.31	4050.67	27.1952	161.994	21435.6	14130.5	685.54	6491.04	21.2355	11031.2	23.8758	19991.4	2212.77	7515.25	3.14975	8668.51	17687.8	4.02075	3945.68	0	16.1894	0	0	5634.36	0	0	0	0	5490.47	0	86.5151	0	3514.56	0	0	5228.9	14102.9	0	166.638	0	898.499	1.97155	21858	9094.31	1244.11	0	1911.62	7.07718	0	50.8446	9.17335	0	0	0	0	0	0	23826.8	1371.37	11324.5	881.795	0	0	21.9175	0	4.08442	0	61.3353	5124.01	10561.3	0	7.45598	10.2979	12.3434	466.48	0	7.78298	2.77555	0	12472.8	128.857	9349.2	20.1977	29.0694	0	0	2.12071	32294.9	0	7183.39	35537	7874.83	8980.62	6621.72	138.307	18175.1	23819.1	25256.4	17184.4	293.092	575.782	57.7438	5854.9	964.23	0	0	0	0	0	0	8.77377	27.2848	22.7614	38.8408	0	101.929	0	0	14166	863.609	19490	0	233.837	0	3492.38	0	0	15.2805	0	24.2062	145.499	2268.68	24518.1	11813.8	199.939	16453.2	26794.1	23572.4	11078.4	15183.2	12511.1	8420.35	13.3192	19754.7	16325.7	43.0292	7122.19	24533.6	14565.1	6983.24	7.71612	8407.65	18905.7	12473.7	0	506.954	0	616.695	15280.4	1.4109	928.522	59.1213	0	140.876	414.352	65.3662	1164.45	917.377	4621.48	4.94052	0	251.038	4.90837	2.31664	0	47.7143	0	0	7.27973	720.921	971.142	943.368	0	405.772	8489.7	2294.86	12240.7	427.475	0	107.489	2275.56	0	102.301	6.29326	10.2377	244.236	1.59068
urocanic acid	15665.7	230.937	3355.72	323.066	9744.98	2238.46	121.363	808.346	8105.44	7090.65	9777.75	7966.45	91.3571	235.019	6965.15	6507.29	5406.39	3178.19	6009.92	6036.39	2276.22	188.436	8653.74	7435.23	12305.5	5364.2	12655.4	11422.9	10991.6	6380.8	10282	2932.3	12723.2	15941.5	7475.88	11041.9	7855.65	3814.98	8083.21	12090.3	10687.1	15262	8441.09	6069.31	2481.57	4301.82	4336.58	1194.48	3744.85	1653.94	5805.52	1233.49	440.447	9320.77	6090.14	1283.27	549.4	3883.69	834.574	479.88	271.94	6682.12	395.906	9861.45	1507.25	11710.9	3579.41	11072.1	537.027	8753.22	6467.11	2761.92	3335.02	9306.44	9761.81	8099.87	1555.67	5878.34	8185.63	8982.84	10359.4	10171.4	1970.15	11982.3	8864.72	1672.15	486.498	3258.65	8958.08	3062.04	7443.3	6282.58	17364.9	3726.46	12828.7	5176.88	2312.37	11269.7	619.08	657.368	5368.78	6654.62	963.973	27.3827	843.933	263.242	67.922	134.457	13.6588	602.313	275.208	3167.29	605.913	1175.97	5533.35	1122.25	1791.35	3297.49	2121.37	1544.23	90.7915	1015.97	109.033	106.983	103.847	2384.01	2392.86	5446.05	54.048	14740.6	28.1415	5169.34	3291.56	1335.61	142.233	2495.13	477.762	733.971	1389.51	1639.71	7879.96	4042.5	257.174	1298.32	4540.76	1073.99	1035.34	1624.04	89.0371	310.187	67.1381	103.698	7778	9205.11	491.039	18747.4	19974.6	7868.64	9502.99	5390.22	14114.6	12504.9	7191.89	11255.6	24832.4	8991.75	11899.4	13024.1	10772.1	16269.8	7800.45	16248.7	13847.9	8692.34	13252.2	11561.8	12689.6	2512.13	6041.23	171.258	8655.8	11014.8	7655.21	11590.7	5482.35	1186.42	9597.27	19016.2	7281.71	18019.3	6288.16	13521.6	4398.07	268.777	4584.25	4359.59	353.969	12879.2	14025.4	12751.9	4304.15	8259.07	7429.88	5844.91	12085.6	6141.5	18497	6165.11	9372.02	13944.6	10615.1	7690.95	19061.3	5330.34	5.3357	5659.97	17205.4	7431.67	9822.8	3426.59
valine	9555.28	385.239	6625.12	2194	4961.99	19279	1138.52	1717.86	11835.7	12913.7	13052.1	10762	382.861	1186.12	14495.5	8969.33	5190.06	16810.2	14338.8	10723.4	11045.5	11013.6	10302.8	9363.46	16057.6	6794.2	11098.1	12609.8	6916.25	5691.57	12198.4	18465	10192.2	12238.4	5922.47	9625.72	10205.5	9162.98	7115.81	8110.94	10060.3	8483.42	15395	9337.56	4022.11	7533.13	5645.8	30796.8	13824.5	4062.33	25057.5	1680.6	13426	24042.6	19203	2488.87	6969.46	15113.5	747.815	1907.97	11409.7	11944.3	10485.8	8607.62	7818.28	19465.2	5454.35	6706.71	21439.7	13946.4	5129.56	14056.7	5870.78	11670.6	9908.18	12177.2	6525.84	10681.6	21892.1	14081.5	7567.71	13768.8	13339.1	9377.52	20072.3	6591.16	7357.2	5737.55	8839.89	8766.09	7886.32	6104.48	10815.8	7970.66	6448.91	24973.6	12028.2	9393.27	9193.64	3776.09	6848.1	18703	614.731	11240.1	1139.32	1102.31	3568.17	1874.86	2106.04	3160.33	249.317	15968.5	552.342	653.016	4218.65	1115.45	1314.25	3951.39	2295.62	1994.9	220.961	934.425	10665.4	417.816	1423.95	1803.86	3094.7	20069	12692.3	11457.7	9210.15	18430.5	8553.82	6420.66	2487.11	8102.81	633.54	9124.48	1680.99	15203.2	21677.6	6377.92	5482.64	2302.99	31298.7	917.793	20440.1	1765.3	13127	7674.58	80.2505	11721.3	3807.05	4690.47	3351.2	12545	14156.4	9178.89	13602.5	11122.9	14170	14732.1	10406.9	14011.2	16447.8	15319.2	10649.6	9685.16	7065.83	10596.3	7832.38	14123.3	9221.97	13519.9	12070.1	11102	7362.16	11925	4169.94	10356.2	6845.44	8028.61	30407.9	6556.88	13358.1	30142.1	6193.15	11704.2	5887.34	13907.8	10751.4	13011.8	6513.41	5118.56	7706.36	4703.24	26371.1	15854.6	10568.4	6020.3	15748.5	8074.66	14148.4	2460.67	16847.6	7055.3	19616.5	10064.5	6425.71	8507.07	5679.62	8601.87	7350.59	8055.58	23738	3959.79	11804.4	32476.5	10611.3	15125.8

metabolite_name	rtimes	quantified m/z	Adduct	Feature	Method	HMDB
1-methylguanine	5.2	166.0718	[M+H]+	HILIC-pos_Cluster_0245	HILIC-pos	HMDB03282
1-methylnicotinamide	8.14	137.0706	[M+H]+	HILIC-pos_Cluster_0110	HILIC-pos	HMDB00699
2-deoxyadenosine	5.14	252.108	[M+H]+	HILIC-pos_Cluster_0728	HILIC-pos	HMDB00101
2-hydroxyphenethylamine	6.22	138.0909	[M+H]+	HILIC-pos_Cluster_0114	HILIC-pos	HMDB01065
3-methylhistidine	9.83	170.0918	[M+H]+	HILIC-pos_Cluster_0272	HILIC-pos	HMDB00479
3-methylxanthine	3.28	167.0558	[M+H]+	HILIC-pos_Cluster_0254	HILIC-pos	HMDB01886
4-guanidinobutanoic acid	7.21	146.092	[M+H]+	HILIC-pos_Cluster_0150	HILIC-pos	HMDB03464
4-hydroxy-3-methylacetophenone	1.7	151.0749	[M+H]+	HILIC-pos_Cluster_0177	HILIC-pos	HMDB59824
5-acetylamino-6-amino-3-methyluracil	5.22	199.082	[M+H]+	HILIC-pos_Cluster_0422	HILIC-pos	HMDB04400
5alpha-Cholestanol	1.7	371.3658	[M-H2O+H]+	HILIC-pos_Cluster_1370	HILIC-pos	HMDB00908
7-methylguanine	5.69	166.0718	[M+H]+	HILIC-pos_Cluster_0246	HILIC-pos	HMDB00897
8-hydroxy-deoxyguanosine	5.25	284.098	[M+H]+	HILIC-pos_Cluster_0914	HILIC-pos	HMDB03333
acetylcholine	7.67	146.117	[M+H]+	HILIC-pos_Cluster_0152	HILIC-pos	HMDB00895
ADMA	9.69	203.1497	[M+H]+	HILIC-pos_Cluster_0447	HILIC-pos	HMDB01539
ADMA/SDMA	9.58	203.1495	[M+H]+	HILIC-pos_Cluster_0446	HILIC-pos	HMDB01539
alanine	7.8	90.0553	[M+H]+	HILIC-pos_Cluster_0008	HILIC-pos	HMDB00161
anserine	10.47	241.1285	[M+H]+	HILIC-pos_Cluster_0667	HILIC-pos	HMDB00194
arginine	9.14	175.1185	[M+H]+	HILIC-pos_Cluster_0295	HILIC-pos	HMDB00517
asparagine	7.93	133.0604	[M+H]+	HILIC-pos_Cluster_0099	HILIC-pos	HMDB00168
atenolol	6.74	267.1691	[M+H]+	HILIC-pos_Cluster_0817	HILIC-pos	HMDB01924
beta-alanine	7.96	90.0552	[M+H]+	HILIC-pos_Cluster_0009	HILIC-pos	HMDB00056
betaine	8.95	118.086	[M+H]+	HILIC-pos_Cluster_0048	HILIC-pos	HMDB00043
bilirubin	1.64	585.2676	[M+H]+	HILIC-pos_Cluster_2052	HILIC-pos	HMDB00054
butyrobetaine	8.68	146.117	[M+H]+	HILIC-pos_Cluster_0151	HILIC-pos	HMDB01161
C14 carnitine	6.68	372.309	[M+H]+	HILIC-pos_Cluster_1374	HILIC-pos	HMDB05066
C16 carnitine	6.56	400.3403	[M+H]+	HILIC-pos_Cluster_1486	HILIC-pos	HMDB00222
C16:0 LPE	6.26	454.291	[M+H]+	HILIC-pos_Cluster_1684	HILIC-pos	HMDB11503
C16:0 SM	7.13	703.5715	[M+H]+	HILIC-pos_Cluster_2293	HILIC-pos	HMDB10169
C16:1 LPC plasmalogen	7.53	480.3428	[M+H]+	HILIC-pos_Cluster_1773	HILIC-pos	HMDB10407
C18 carnitine	6.46	428.3717	[M+H]+	HILIC-pos_Cluster_1593	HILIC-pos	HMDB00848
C18:0 LPC	7.57	524.369	[M+H]+	HILIC-pos_Cluster_1899	HILIC-pos	HMDB10384
C18:1 carnitine	6.48	426.3559	[M+H]+	HILIC-pos_Cluster_1586	HILIC-pos	HMDB05065
C18:1 LPC	7.62	522.3534	[M+H]+	HILIC-pos_Cluster_1893	HILIC-pos	HMDB02815
C18:1 LPC plasmalogen	7.74	508.374	[M+H]+	HILIC-pos_Cluster_1855	HILIC-pos	HMDB13122
C18:2 carnitine	6.52	424.3404	[M+H]+	HILIC-pos_Cluster_1580	HILIC-pos	HMDB06469
C2 carnitine	8.59	204.1223	[M+H]+	HILIC-pos_Cluster_0453	HILIC-pos	HMDB00201
C20 carnitine	6.36	456.4028	[M+H]+	HILIC-pos_Cluster_1691	HILIC-pos	HMDB06460
C20:4 carnitine	6.22	448.3402	[M+Na]+	HILIC-pos_Cluster_1673	HILIC-pos	NA
C36:2 PC	6.49	786.5963	[M+H]+	HILIC-pos_Cluster_2372	HILIC-pos	HMDB08039
C3-DC-CH3 carnitine	8.5	262.1275	[M+H]+	HILIC-pos_Cluster_0790	HILIC-pos	HMDB13133
C4 carnitine	7.89	232.1534	[M+H]+	HILIC-pos_Cluster_0625	HILIC-pos	HMDB02013
caffeine	2.82	195.0872	[M+H]+	HILIC-pos_Cluster_0405	HILIC-pos	HMDB01847
carnitine	8.76	162.1119	[M+H]+	HILIC-pos_Cluster_0230	HILIC-pos	HMDB00062
carnosine	9.3	227.1131	[M+H]+	HILIC-pos_Cluster_0590	HILIC-pos	HMDB00033
choline	8.17	104.107	[M+H]+	HILIC-pos_Cluster_0022	HILIC-pos	HMDB00097
citrulline	8.36	176.1022	[M+H]+	HILIC-pos_Cluster_0306	HILIC-pos	HMDB00904
creatine	8.3	132.0763	[M+H]+	HILIC-pos_Cluster_0090	HILIC-pos	HMDB00064
creatinine	6.42	114.0662	[M+H]+	HILIC-pos_Cluster_0036	HILIC-pos	HMDB00562
cytosine	6.12	112.0505	[M+H]+	HILIC-pos_Cluster_0032	HILIC-pos	HMDB00630
deoxyinosine	4.98	253.0923	[M+H]+	HILIC-pos_Cluster_0734	HILIC-pos	HMDB00071
diacetylspermine	10.2	287.2429	[M+H]+	HILIC-pos_Cluster_0936	HILIC-pos	HMDB41876
didanosine	4.71	237.0974	[M+H]+	HILIC-pos_Cluster_0637	HILIC-pos	HMDB15037
dimethyllysine	10.22	175.1437	[M+H]+	HILIC-pos_Cluster_0298	HILIC-pos	HMDB13287
geranyl acetoacetate	1.75	239.1633	[M+H]+	HILIC-pos_Cluster_0657	HILIC-pos	HMDB38256
glutamate	7.61	148.0598	[M+H]+	HILIC-pos_Cluster_0160	HILIC-pos	HMDB00148
glutamine	8.05	147.0759	[M+H]+	HILIC-pos_Cluster_0156	HILIC-pos	HMDB00641
Harman	6.25	183.091	[M+H]+	HILIC-pos_Cluster_0340	HILIC-pos	HMDB35196
histamine	9.12	112.0869	[M+H]+	HILIC-pos_Cluster_0033	HILIC-pos	HMDB00870
hydroxyproline	7.89	132.0651	[M+H]+	HILIC-pos_Cluster_0089	HILIC-pos	HMDB00725
hypoxanthine	4.83	137.0453	[M+H]+	HILIC-pos_Cluster_0108	HILIC-pos	HMDB00157
imidazole propionate	7.39	141.0652	[M+H]+	HILIC-pos_Cluster_0121	HILIC-pos	HMDB02271
inosine	4.86	269.087	[M+H]+	HILIC-pos_Cluster_0822	HILIC-pos	HMDB00195
isoleucine	7.04	132.1016	[M+H]+	HILIC-pos_Cluster_0092	HILIC-pos	HMDB00172
kynurenic acid	5.22	190.0492	[M+H]+	HILIC-pos_Cluster_0383	HILIC-pos	HMDB00715
leucine	6.91	132.1015	[M+H]+	HILIC-pos_Cluster_0091	HILIC-pos	HMDB00687
linoleoyl ethanolamide	1.94	324.2884	[M+H]+	HILIC-pos_Cluster_1148	HILIC-pos	HMDB12252
lysine	9.37	147.1125	[M+H]+	HILIC-pos_Cluster_0157	HILIC-pos	HMDB00182
methionine	7	150.0577	[M+H]+	HILIC-pos_Cluster_0167	HILIC-pos	HMDB00696
methionine sulfoxide	8.62	166.0528	[M+H]+	HILIC-pos_Cluster_0244	HILIC-pos	HMDB02005
methylpyridonecarboxamide	4.25	153.0653	[M+H]+	HILIC-pos_Cluster_0191	HILIC-pos	HMDB04193
N-Acetylglutamic acid	4.51	190.0705	[M+H]+	HILIC-pos_Cluster_0384	HILIC-pos	HMDB01138
N-acetylhistidine	8.36	198.0844	[M+H]+	HILIC-pos_Cluster_0419	HILIC-pos	HMDB32055
N-acetyl-L-arginine	8.12	217.1287	[M+H]+	HILIC-pos_Cluster_0524	HILIC-pos	HMDB04620
N-acetylputrescine	7.83	131.1176	[M+H]+	HILIC-pos_Cluster_0086	HILIC-pos	HMDB02064
N-acetylspermidine	9.71	188.1751	[M+H]+	HILIC-pos_Cluster_0374	HILIC-pos	HMDB01276
nicotinic acid	3.65	124.0392	[M+H]+	HILIC-pos_Cluster_0062	HILIC-pos	HMDB01488
N-methylproline	8.57	130.086	[M+H]+	HILIC-pos_Cluster_0082	HILIC-pos	NA
NMMA	9.34	189.1339	[M+H]+	HILIC-pos_Cluster_0378	HILIC-pos	HMDB29416
ornithine	9.28	133.0968	[M+H]+	HILIC-pos_Cluster_0100	HILIC-pos	HMDB00214
pantothenate	3.03	220.1171	[M+H]+	HILIC-pos_Cluster_0540	HILIC-pos	HMDB00210
phenylalanine	6.66	166.0859	[M+H]+	HILIC-pos_Cluster_0248	HILIC-pos	HMDB00159
phytosphingosine	5.81	318.299	[M+H]+	HILIC-pos_Cluster_1113	HILIC-pos	HMDB04610
pipecolic acid	7.93	130.086	[M+H]+	HILIC-pos_Cluster_0081	HILIC-pos	HMDB00716
piperine	1.89	286.1428	[M+H]+	HILIC-pos_Cluster_0927	HILIC-pos	HMDB29377
proline	8.07	116.0705	[M+H]+	HILIC-pos_Cluster_0041	HILIC-pos	HMDB00162
proline betaine	9.17	144.1013	[M+H]+	HILIC-pos_Cluster_0134	HILIC-pos	HMDB04827
putrescine	9.29	89.1077	[M+H]+	HILIC-pos_Cluster_0007	HILIC-pos	HMDB01414
pyridoxamine	9.03	169.0966	[M+H]+	HILIC-pos_Cluster_0268	HILIC-pos	HMDB01431
pyroglutamic acid	8.04	130.0495	[M+H]+	HILIC-pos_Cluster_0079	HILIC-pos	HMDB00267
serine	7.68	106.0499	[M+H]+	HILIC-pos_Cluster_0024	HILIC-pos	HMDB00187
sphinganine	5.71	302.3038	[M+H]+	HILIC-pos_Cluster_1017	HILIC-pos	HMDB00269
taurine	6.1	126.0218	[M+H]+	HILIC-pos_Cluster_0066	HILIC-pos	HMDB00251
tetrahydro-beta-carboline-carboxylic acid	6.36	217.0962	[M+H]+	HILIC-pos_Cluster_0521	HILIC-pos	HMDB35665
thiamine	9.5	265.1105	[M]+	HILIC-pos_Cluster_0797	HILIC-pos	HMDB00235
threonine	7.6	120.0655	[M+H]+	HILIC-pos_Cluster_0049	HILIC-pos	HMDB00167
threosphingosine	5.68	300.2883	[M+H]+	HILIC-pos_Cluster_0998	HILIC-pos	N/A
triethanolamine	7.64	150.1119	[M+H]+	HILIC-pos_Cluster_0172	HILIC-pos	HMDB32538
trigonelline	8.85	138.0546	[M+H]+	HILIC-pos_Cluster_0113	HILIC-pos	HMDB00875
trimethylbenzene	1.66	121.101	[M+H]+	HILIC-pos_Cluster_0054	HILIC-pos	HMDB13733
trimethyllysine	11.17	189.1589	[M+H]+	HILIC-pos_Cluster_0379	HILIC-pos	HMDB01325
tryptophan	6.45	205.0963	[M+H]+	HILIC-pos_Cluster_0455	HILIC-pos	HMDB00929
tthyl hexadecenoate	1.68	283.262	[M+H]+	HILIC-pos_Cluster_0913	HILIC-pos	HMDB59871
tyrosine	6.78	182.0807	[M+H]+	HILIC-pos_Cluster_0333	HILIC-pos	HMDB00158
urobilin	6.42	595.3462	[M+H]+	HILIC-pos_Cluster_2093	HILIC-pos	HMDB04161
urocanic acid	4.5	139.0499	[M+H]+	HILIC-pos_Cluster_0116	HILIC-pos	HMDB00301
valine	7.36	118.0861	[M+H]+	HILIC-pos_Cluster_0046	HILIC-pos	HMDB00883