metabolite_name	Tips_R	0hpa_P	Tips_M	3hpa_L	24hpa_P	3hpa_S	3hpa_T	24hpa_S	3hpa_M	24hpa_R	0hpa_K	3hpa_B	Tips_O	3hpa_R	Tips_K	0hpa_M	24hpa_T	3hpa_O	Tips_L	24hpa_L	0hpa_B	24hpa_O	3hpa_G	0hpa_O	0hpa_T	3hpa_K	0hpa_S	0hpa_G	Tips_B	3hpa_P	0hpa_R	24hpa_M	Tips_G	Tips_S	0hpa_L	Tips_T	24hpa_K	Tips_P
Trimethylamine (TMA)	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Ethanolamine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Aminoacetone	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
1-Methylguanidine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Glycine	N/A	N/A	21538.00168	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	33670.96444	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Trimethylamine-N-Oxide (TMAO)	21331.09361	15658.084	24163.21611	37419.73953	32119.72287	17387.61796	28451.823	27802.6235	42728.22886	30045.54202	27811.15795	52855.35376	31672.70496	28787.88293	24002.27798	27934.14914	27818.77909	18532.50498	52187.31012	58867.54349	24286.57881	21430.76472	21837.40238	40052.41864	25710.27926	39083.37741	46234.46238	32670.57912	31234.60472	21849.78764	25687.44765	28570.48603	23523.21056	29350.99321	40963.51254	33848.51054	33983.0248	19152.7942
3C13-Glycine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Putrescine	634745.4139	431471.8916	707178.5238	1599642.525	1167508.666	486782.4962	881112.2243	824962.1081	1982449.286	1306179.95	1035978.914	1894858.538	854365.2471	956143.2643	652278.4525	890245.5343	859383.1386	99876.53672	2139353.772	2552882.158	1183088.445	657823.1826	891967.8662	1441854.878	859729.9736	1649013.536	867125.5075	1088543.973	801796.6297	740192.0587	987465.1849	1135760.224	979210.5499	953748.9466	1897479.319	793948.3675	1771149.26	1111162.654
betaAlanine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Alanine	31582.63448	72908.61589	88299.95468	320899.143	104122.8333	83844.27086	85350.98887	80972.86967	382218.6104	124801.1525	461506.793	285968.1724	59384.67649	152638.1339	45263.86853	146383.3329	125299.9721	50204.44709	119061.5557	281092.7602	240676.2489	136987.8859	255593.6614	257718.3664	112529.9287	311462.9541	88881.87238	155388.1	49345.87426	146958.4424	124398.0961	165152.4663	60130.542	56391.22981	228516.0514	45884.10113	265912.0244	46454.75571
Sarcosine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
4C13-Alanine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Betaine Aldehyde	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Cadaverine	426654.93	447660.94	422863.2245	588156.6211	472341.5848	461946.2459	498571.6467	465613.8623	643542.535	486115.0973	489404.6926	744769.0878	471865.2345	476662.6755	512520.4549	485905.5947	672008.3957	541624.5995	994780.516	688011.4719	480091.8954	455771.8095	731219.609	633946.0731	474588.3747	760358.1423	743936.5145	401673.7643	440059.4801	440448.0961	401732.0659	456321.5296	411352.7816	526697.3607	715106.7648	432702.0989	538883.3461	683033.9218
3-Aminoisobutyrate	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Choline	4049196.872	1524012.116	4215091.489	4435709.276	3467643.666	1691456.633	2662436.617	2572965.569	4682530.568	3055959.421	2759921.796	6876985.437	4717414.875	2600493.475	3592076.674	2095723.203	2561250.646	859120.0528	12665270.04	5490948.131	3319379.673	2215496.389	3833718.653	4332051.424	2482505.444	4694118.027	2274322.457	4508785.871	5093251.165	2423287.667	2661999.539	2761349.763	7066454.904	5162136.548	4457056.16	3872749.173	4150221.516	6686041.15
Dimethylglycine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
L-2-Aminobutyric Acid	18271.03111	23707.31711	24026.15048	76666.52812	38268.38389	10369.72949	13861.76673	12697.30746	123394.4759	10539.40478	67804.47017	138665.683	119571.8479	15476.61566	8397.454154	33363.29709	15054.34695	18743.40491	144095.4047	78057.45841	57649.77342	38041.54579	164693.8161	97859.89167	18243.88012	37610.09955	46884.78891	18064.86764	100936.5759	38314.72214	26193.3913	27857.19577	17728.13086	122681.2524	81081.9365	14260.77135	43427.18942	197826.3376
2-Aminoisobutyric Acid	N/A	N/A	N/A	N/A	22718.99101	N/A	N/A	N/A	N/A	N/A	N/A	24789.45232	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
2C13-Choline	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Serine	180889.8135	186687.4067	477402.229	204254.5512	177142.4533	150994.8407	131543.2786	147483.8454	239689.885	163131.0615	377060.7241	332820.8586	212974.2232	131187.8512	199438.8736	185296.8881	147523.5293	73006.5403	522358.2215	259950.1696	153106.6852	186285.5321	208173.797	182130.9064	261511.1458	1177212.472	126884.6912	268027.9888	127286.2646	151271.055	147204.0124	157627.2411	165130.278	109503.7881	269303.7809	134749.0039	293187.5155	205459.6084
4C13-Serine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Hypotaurine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Cytosine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Histamine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Creatinine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
5,6-Dihydrouracil	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Proline	48134.17003	39666.9722	101305.25	68509.11696	75822.93948	51273.24494	30556.41906	64497.60033	75138.30929	66439.69534	98592.96231	93462.96569	75563.36436	39299.56338	61538.38097	62201.26398	92760.99688	19221.44804	82584.68384	93878.4641	81252.19835	52212.02205	21399.66322	76419.41129	56971.3735	183716.0188	46120.2216	83927.33578	78814.49653	45686.02041	39511.7107	63752.97327	84149.86799	30030.1662	43283.08979	44360.7651	85894.6217	70302.13296
d3-Creatinine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
5-Aminovaleric Acid	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Betaine	13113614.55	11026249.63	14377704.71	17283546.63	15420104.37	11779485.84	14545610.55	15297781.02	20872740.39	17746186.04	17941736.56	23838292.74	18922072.13	17770596.43	15925246.29	16104085.46	21159526.91	11435921.12	20454073.85	22113046.25	18121416	15574313.23	21633288.45	23032001.14	16400051.81	22281762.57	15883165.78	16600968.22	15790677.5	15423712.92	15773084.66	18907971.54	17652011.4	17602007.21	23153297.4	14944968.32	22233046.58	19848094.1
Valine	29940.71099	30464.20971	49535.16526	39591.52872	27643.49562	23442.09311	30498.59587	29830.43523	28437.00819	36741.31762	47872.01405	61889.46974	35172.21496	22287.28359	46537.29634	32240.43336	32762.26051	13808.00787	72552.63132	65725.22823	38256.77886	25033.2859	74354.63121	38189.4948	30308.02219	101846.8202	14426.17461	60316.53265	34119.90935	19815.3702	30572.69253	32922.73501	52295.04638	18819.37717	48750.28972	27098.4086	48580.99737	38762.3053
Indole	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Threonine	66091.79011	59330.33869	107512.7084	92551.28019	75186.84358	44807.80589	50018.79126	49103.47428	90684.29052	53673.06846	131831.8289	128819.0201	88851.20716	51609.72005	61822.08455	54086.39962	68286.73928	19358.62176	188508.4744	111484.532	55021.04483	57884.5195	86051.94517	77261.9664	92145.61328	298370.8618	39729.34871	94696.81133	50524.2681	49625.23124	56767.38127	55554.48523	71698.14005	43577.08353	101099.334	46906.94266	109219.7246	62797.31918
Cysteine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
6C13-Proline	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Niacinamide	195230.5635	214667.2672	200230.7213	587226.1584	491922.7743	209381.2192	316198.6734	423009.6151	750943.6554	546881.1601	399410.2686	912246.0552	238229.6762	401932.1633	191420.1392	386404.4433	460840.4616	73709.06193	599955.6038	1083325.684	661033.4028	537921.5227	689273.817	691798.3322	323665.0363	555160.7944	304744.2641	618245.029	246265.2371	359259.5523	454260.7546	610804.1153	452840.3671	280256.8221	691174.8228	255726.3419	825141.2601	277617.9219
6C13-Valine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
5C13-Threonine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Taurine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
1-Methylhistamine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Imidazoleacetic Acid	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
5,6-Dihydrothymine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Pyroglutamic Acid	114748.9363	106592.7378	226330.0908	25805.91325	39583.03901	61076.89203	23326.67029	58391.03749	45283.00829	71142.70078	210932.1054	50468.23772	131328.9392	63475.04665	92225.54356	77765.29856	40075.53234	49928.8535	77498.41655	37263.08343	74587.81269	87614.63951	35933.36358	33083.99728	122826.8072	194441.6976	29047.66225	124594.1237	45541.66752	57141.84991	53279.1583	59257.49642	66863.5255	22248.03169	47090.15899	55283.612	56924.63107	30248.84588
Pipecolate	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Agmatine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
N-Acetylputrescine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Creatine	316560.3999	1667037.355	380648.1044	10081504.08	2588550.162	1609412.218	2344092.645	1922637.369	13365856.68	3183222.673	15989329.12	9691185.392	364560.448	4481307.636	350754.5652	4765003.59	2806066.462	1197245.243	1506131.362	7058674.158	8048808.847	3152377.77	8132642.62	8387318.708	2651110.492	6150076.892	2526633.353	4562562.576	604500.441	3740091.825	4248856.777	4339126.366	901447.3391	312136.6618	8158001.559	478061.7647	7269038.239	335455.4881
Hydroxyproline	24722.04927	44687.25248	25881.08186	220171.0316	96982.50434	45685.12151	82772.14612	64673.50551	304001.572	110793.2524	285820.2808	294731.0285	23599.33833	109424.1614	24369.02539	103665.0953	87191.83725	29328.72197	79217.55705	240067.2418	169533.3477	86575.10968	217571.2042	177653.9237	70422.97102	161426.4006	69979.89396	117666.7469	42814.30928	97948.30325	116859.2456	132947.4339	50838.03249	37708.32812	196896.6613	34966.15986	212862.6179	36295.5711
Aminolevulinate	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Leucine /D-Norleucine	93846.18318	98350.95933	145638.1181	249151.9503	151885.2906	67798.95198	101759.9227	112699.4506	159284.0876	114708.258	222315.6096	217357.9143	126983.1658	101849.685	122177.587	123624.0846	120289.6238	51152.73902	242202.891	212790.5113	186931.6852	129068.5802	167783.1946	216995.5108	130090.9401	272274.3689	95282.08296	224892.9029	127458.7219	112742.7358	128560.6045	152953.5752	196553.3077	121465.7447	215277.9806	113601.2168	210352.5466	147869.9082
iso-Leucine /allo-isoLeucine	35289.37179	30328.61716	68537.49118	67046.60395	49230.34486	23120.86238	31437.61591	35731.44925	54830.47313	36115.47594	73314.19627	38072.35345	43565.6606	29669.28658	45940.76824	35748.44582	38957.75016	10867.75786	28205.38342	83175.92864	60803.7657	36468.72343	73660.43166	47034.02292	44558.83874	101829.7164	40045.64781	71446.84316	64213.54966	30192.09387	30075.34624	44925.25362	72459.89843	30464.38015	51105.61745	21906.72658	47776.98066	59617.97583
Ornithine	61197.21599	63074.22369	111243.8666	97106.88594	69372.98274	53045.71322	61531.8573	56231.56527	101421.9759	63934.62237	189410.4824	149975.6258	86266.46329	72025.26309	68868.88694	73757.05235	42944.04472	41311.38627	172307.318	107793.5493	89760.74665	67166.87853	97098.5442	98572.03362	49812.6954	382884.7862	64728.89905	71472.02508	35959.02274	43021.86603	62976.84314	68539.63774	55502.75107	47464.01725	105783.8466	50036.466	80091.88935	59142.69313
Asparagine	51022.37534	65259.01321	57956.22945	67954.7997	52577.82906	65007.86699	79583.53618	55905.14445	68131.5247	67184.47159	60466.60888	67909.33249	51059.10333	53516.71729	44016.53869	76985.52431	53398.35947	56206.5626	99577.6774	109966.5351	82902.2914	48431.76305	98403.46563	86286.19643	89581.12038	109278.8754	81881.97964	98054.62159	91103.67854	91412.46642	80399.46809	94939.38504	63137.55364	80623.84099	88644.44999	61917.59807	87370.17417	83062.51908
Aspartic Acid	169668.0251	174256.9683	188507.2355	400887.2152	366625.7873	235383.7579	251000.8461	253006.088	560693.6777	369002.6318	278710.6404	471020.9063	274994.6037	382036.8959	235010.3743	321313.3087	403053.0551	160221.5287	463383.0928	668514.4897	270094.1881	354078.7926	409463.6643	443108.9458	334311.0068	435042.1783	315965.7741	259541.9645	218438.0036	244485.9102	286529.4333	434596.1277	219624.8777	336922.7845	535759.1112	289732.8895	601292.1941	277497.2751
Homocysteine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
S-Methylcysteine	24780.65315	26683.58001	31110.22705	53476.42458	20264.29811	17329.75272	21033.86601	39499.57268	38956.05468	28331.99086	49135.32488	50295.78198	25535.97386	37105.73219	32194.93507	30118.15761	32006.59593	20721.00332	27147.68368	36013.59256	41607.73213	20568.74395	18761.89116	41531.70787	42908.69895	43663.97931	36761.06159	55039.73423	26324.68717	28495.64104	33886.13096	31690.15718	24722.72826	19790.98515	49898.53278	26079.13926	30490.73105	26232.86617
1-Methylnicotinamide	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Tyramine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
4-Aminobenzoic Acid	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Trigonelline	24487.84232	N/A	24751.38238	42488.90819	N/A	N/A	N/A	26144.60426	28861.90235	N/A	51242.52987	47368.53718	49250.72654	N/A	44321.26378	23777.57615	N/A	N/A	42903.73963	N/A	41785.4911	21212.55319	N/A	44606.18893	22358.133	23701.60256	N/A	N/A	30654.38277	N/A	N/A	N/A	36079.03916	25930.73509	N/A	N/A	31133.0453	22703.67868
5C13-Aspartic Acid	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
6C13-Asparagine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
7C13-Leucine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
7C13-iso-Leucine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
1-Methylimidazole Acetate	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Imidazole Propionate	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Spermidine	31531.29105	21723.9386	14325.58107	61184.92149	50076.7059	32326.95115	141774.8869	59632.41664	143524.6929	80023.19649	50039.72455	247478.6173	66761.17672	79489.84515	56150.466	42157.00968	26934.10245	9981.471083	188767.6914	234751.7609	52159.75062	38954.85218	95965.78345	63985.67999	172359.9332	668376.4873	440857.2754	110535.4105	64599.00773	128567.2923	130675.2625	178584.4928	87064.02982	184282.3635	503858.7302	99543.15116	304178.4857	370752.5497
4-Guanidinobutanoate	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Acetylcholine	N/A	157758.9135	N/A	836745.1225	551604.481	201571.099	246347.5788	295224.3278	1185812.408	575000.5962	555843.7781	872182.3747	N/A	502411.2241	N/A	408808.02	N/A	N/A	N/A	1957951.356	977793.9026	N/A	N/A	501467.2176	334000.9269	443255.8577	138125.3245	465048.0849	N/A	370185.9954	538786.7278	421542.6086	N/A	N/A	496535.7516	N/A	976493.5823	N/A
Glutamine	146200.0354	124678.2391	136870.9351	255294.446	270454.8867	63945.28991	114441.1367	130563.0282	237219.0511	219875.9367	228014.7862	326259.9997	113574.5167	149487.2586	140665.2186	132517.5674	128271.2408	30166.33141	343443.1582	435999	213332.8588	110941.4895	227806.5592	176960.0301	66830.22051	322423.1503	97501.98566	223507.6603	257157.9788	189114.2425	147564.0652	161851.0533	272893.8188	151333.7855	257510.9829	114416.7267	455099.5074	193719.8454
Lysine	236574.0086	224681.0548	261142.7327	559583.1993	456881.5716	237841.0866	314861.9328	265764.5773	557134.161	338585.1412	532778.4406	968364.0903	253581.105	340695.5404	219881.3218	322092.138	339105.697	91787.06354	448038.5312	771217.356	645863.3395	283412.4973	606824.1752	727671.3099	252176.666	847240.5399	300161.0325	582575.6318	351109.9275	387583.087	305283.3508	418871.0154	359757.7431	236720.1145	551818.5468	195012.5767	668269.7493	326211.5025
Deoxycarnitine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Glutamic acid	591361.4163	638610.1473	661934.9009	1543705.091	1607047.767	496179.4469	834588.3106	1104763.438	1737680.901	1575646.66	1141581.554	1708246.747	547741.1457	1077730.416	636679.1255	938554.5742	1330201.713	283977.4756	1601329.242	2728084.355	1273283.239	1281704.523	1306212.682	1591176.563	830855.8734	1607169.178	757698.9715	1042850.155	755589.7127	1055333.476	1176927.667	1614606.789	1063568.604	768370.2454	1674211.183	628029.7062	2267719.798	821364.7099
Methionine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
2C13-Glutamic acid	76938945.09	81825496.44	80779357.98	107248894	95970112.45	83966839.74	105342753.4	89006347.46	122071859.4	93160757.9	88216310.78	144681188.4	97510842.07	94974747.64	92958803.29	94813074.87	126181435.6	97305822.94	193399198.2	136231785.4	85850416.71	87104929.6	133794735.9	123997015.1	89221109.26	138092249.5	134764321.1	79843169.43	83487477.08	79152896.78	81059076	83260227.21	81717015.88	97680515.03	136900291.5	79496371.94	106499202	127242055.5
Guanine	41413.91628	35111.1697	37258.24135	128001.0292	103600.0849	39026.31582	73167.53562	75277.63522	139626.1332	88070.55763	55455.65214	159243.1861	58609.98588	62669.42644	46984.2911	45893.43648	73588.28715	10384.0582	104175.1767	209808.034	69465.17407	63419.94312	104385.2963	71388.67452	58212.61691	125149.3208	51521.65271	76459.28882	55772.88927	59991.78714	65022.6055	80713.38587	69988.8554	59790.25782	94755.93279	48729.68989	153046.2888	58747.7785
Cystamine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
7C13-Glutamine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
6C13-Glutamic acid	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
8C13-Lysine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
6C13-Methionine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Histidine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Serotonin	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Tryptamine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Carnitine	389343.5833	256201.2152	360670.1041	1101378.634	783894.3281	308800.7792	413813.9256	594970.7985	1267970.071	735458.7813	902535.5331	1064805.3	447176.6462	707439.3907	268930.2983	513244.7209	544342.1079	132733.3437	1024801.975	1336053.83	702688.0894	596025.9527	745949.5222	900807.8521	369523.5674	884080.7438	391955.021	534172.8463	411672.5972	456670.6797	524348.1826	660791.3669	507768.807	412763.9248	823644.2788	401964.6902	905120.4863	379686.9131
9C13-Histidine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Phenylalanine	183877.2592	167286.5696	197438.4302	465257.0273	208541.3984	132386.8092	190253.2133	163586.7221	438441.4029	186536.41	423566.0765	614013.277	198616.0995	212307.488	160382.6396	284210.2546	149977.4983	67877.43876	375069.5583	290242.8303	489783.2136	203557.8619	472869.9861	533578.2262	237972.8352	594875.8645	241592.5763	647528.6366	203044.4662	203936.4914	259424.9594	232225.7662	300816.6478	194385.0906	506145.9962	182030.8394	303598.6036	244199.868
Methionine Sulfoxide	9818.607441	12080.97498	13262.83425	17452.31339	9250.708049	12797.7196	14769.18471	9362.757874	23226.06362	14359.86186	10224.97599	20436.23335	10907.89521	11102.21961	14136.43075	12260.10489	19133.77694	4915.95094	22045.95539	16798.94341	14190.80782	17362.01544	32431.2782	17113.95033	18631.52303	32638.97216	19737.93665	19406.19676	18117.77426	15052.78475	13885.65601	17486.82287	16660.97033	20553.52444	18951.44253	11622.5376	25036.80068	24784.56185
7-Methylguanine	22086.94595	27767.24264	25887.13149	110783.9718	55519.73146	31032.1159	55245.17061	55880.38886	133734.2715	87741.27669	79187.44395	120798.9244	33298.25895	59494.77553	19460.70566	72879.83256	65335.63357	12161.18853	74686.12756	183857.6318	73369.68119	58723.10404	60596.42604	109191.7051	62872.58855	109101.0479	60725.30057	63818.22185	42792.62601	54631.55457	70609.64365	80073.2386	43470.16869	36740.92002	147136.2139	29038.65801	145549.729	47735.34157
Normetanephrine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Taurocyamine	107441.49	94397.82899	115975.2423	135565.3758	114421.828	129926.5819	148828.8945	112285.7025	141658.4011	164642.5351	110862.9084	165235.2578	126736.5261	117495.6647	147663.39	133559.7567	172802.0364	126911.1028	186273.4622	164932.2274	120082.0821	134723.2245	125185.2268	145534.845	123307.2753	190580.2409	195421.6254	120258.0047	119677.5282	126534.7844	115817.1085	150079.4414	129736.7069	145269.863	179073.7087	133324.4914	155590.9999	153196.3826
Pyridoxamine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
1/3-Methylhistidine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Norepinephrine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
n-Glycylproline	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Arginine	249901.911	259302.6747	335785.1899	539513.1156	515816.6411	187677.3006	297450.8452	297449.4566	581159.7849	390472.7513	422759.0134	642236.9322	232017.2166	285825.7333	180718.4917	311873.7271	364233.626	78261.68095	628425.9013	745190.5689	383568.216	287434.6137	449523.2019	536982.6356	443347.6958	1055058.713	258243.6546	458196.4235	337152.7708	325281.0322	333030.8929	417400.3584	457252.5518	283621.4675	612942.9042	222219.4808	784305.4781	340269.949
N-Acetylornithine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
10C13-Phenylalanine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Cotinine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Cysteinyl-Glycine (Cys-Gly)	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Gluconolactone	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Glucosamine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Theobromine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
1,7-Dimethylxanthine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Tyrosine	172725.03	190451.4337	207832.7918	354722.0688	244898.6039	199899.5438	234450.1248	232966.35	326607.9086	249375.0236	390001.462	388028.3905	211671.7037	281938.9157	221487.8639	280795.3032	230909.8557	171466.5663	210633.9378	323158.0258	410110.8034	239416.8048	223700.3661	463173.6521	292466.3172	422140.694	308756.7453	474533.3004	205683.5598	279715.955	276955.0701	265019.8975	278046.566	196426.1132	432544.2883	222792.9816	298020.1747	217656.5598
Epinephrine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Se-Methylselenocysteine	6769536.672	6957841.261	7008531.461	7982363.111	7663701.145	7705456.845	9043012.505	7923458.701	8848266.694	8556742.824	7741835.788	10561130.9	7880581.126	8345901.825	8711623.823	8730390.408	9372939.286	8520836.239	12843679.56	10590019.45	8121318.483	7968447.291	6903507.28	8982068.898	8526190.462	12351850.66	12253136.07	8428450.638	7614315.58	8122041.274	8558479.544	8652154.085	8302493.903	7784206.08	10983897.69	8036664.928	10173608.75	9560619.056
2C13-Tyrosine	5744589.77	6029552.939	6107672.992	6580035.347	6572158.112	6632675.834	7632757.173	6642986.201	7245831.502	7447190.405	6772788.637	8578728.234	6724301.248	7426945.833	7292874.849	7351981.078	7900638.01	7193311.839	10639619.52	8763808.736	6743919.858	6945388.86	5627731.171	7593853.871	7191666.378	10381926.6	10061775.67	6962108.501	6250187.837	6711077.517	7524080.666	7234985.391	7333846.471	6483570.367	9243349.769	6694319.078	8690746.312	7746691.065
Phosphorylcholine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
10C13-Arginine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
N6-Acetyl-Lysine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Homoarginine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
N6-Trimethyllysine	190513.7855	53993.15625	189670.9573	282438.6494	173797.767	64223.12168	128596.8905	128886.7055	325182.5533	187452.9856	152901.1309	561570.7148	227539.1644	115836.2078	122343.1946	121004.1146	175817.6287	30528.27092	812472.4543	503917.7593	224155.7034	122567.0789	337524.7698	307580.1049	121046.6158	292408.2152	125205.5789	290568.0753	356419.833	93599.55526	137333.8546	166490.9836	475458.1248	239979.2298	293573.0464	186182.093	276887.5614	335312.2542
Homocitrulline	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
10C13-Tyrosine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Caffeine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Salicylurate	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
DL DOPA	517154.8353	476152.1909	709808.7153	4566516.026	858209.5489	489272.3598	713446.8334	612735.9336	6399208.516	1072731.795	1188671.292	3854379.267	586521.9723	1561480.639	548685.0774	1649453.59	899252.7921	353291.5776	2248963.516	2423792.773	3599912.992	1163099.849	3439212.867	3486151.684	815742.9762	1931763.879	702638.601	1818985.306	866407.1104	1130424.041	1449452.908	1705453.618	1019377.102	715008.7466	2888790.14	629103.7153	3009024.969	576121.3523
Selenomethionine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Dimethylarginine (A/SDMA)	330905.6207	410894.6189	363612.5815	1994449.808	1469572.287	518119.2701	951326.6411	979862.3194	2265080.317	1174650.263	921419.4337	2849721.368	407269.615	881120.9117	366902.4628	867669.9767	1099794.117	157086.8678	1327666.932	3313846.919	1321915.939	785649.2499	1813936.801	1830852.802	800502.2753	1878521.033	757121.1245	822940.2968	457802.6292	705510.782	847480.5624	1133484.549	465888.7453	475963.0123	1887672.36	362354.8451	1853400.508	569703.3441
Spermine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
3-Indolebutyric Acid	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Acetylcarnitine	13779202.76	7822581.276	13534603.02	14852724.87	12157239.68	6689565.483	12212714.53	9923391.024	17687753.73	14390167.73	16786747.67	23834376.17	13910746.47	12030333.47	13644295.18	14211055.36	11105184.12	2620741.149	32725421.51	27408068.41	19185342.45	9423093.056	11169398.27	23786196.33	15552438.55	19872184.34	12081703.6	16772931.77	13654915.42	10098049.22	16222155.06	12334176.32	18535285.5	16516607.43	24434940.83	15245141.84	19773331.78	16036535.54
Tryptophan	43301.18394	36821.0782	72621.6127	172366.4141	47094.78502	37165.03706	54907.68174	44807.61495	186028.5271	56119.77071	153104.5624	269952.0049	56879.45644	85908.31626	57129.02018	110370.3544	30649.25439	17087.18294	90746.35099	101783.9867	204972.4393	50125.61614	156492.8007	199536.1983	95082.54216	166538.0656	69630.81975	213944.4057	66361.87533	66128.40135	83856.95255	58887.31792	99970.31991	48488.03398	178800.6312	53552.98903	99420.69601	61512.37061
L-Kynurenine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Phosphocreatine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
N-Ac-Arginine	56303.30667	51030.98555	69484.10084	116861.9407	58936.215	20936.93229	63175.95542	37926.99345	115857.0612	26110.03536	80457.89906	97004.3512	58579.26042	62214.97322	58150.0193	64380.66441	46206.42218	24782.22077	95390.37239	82300.95048	65085.0105	35643.31103	60156.679	135588.8899	56385.31386	102817.0894	38038.27303	63808.79734	44196.41913	52217.31033	47101.10084	54779.33422	63878.87683	55583.28523	100992.8322	50538.53716	68544.14468	38731.29327
13C13-Tryptophan	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Carnosine	21299.1322	26137.22486	18935.12054	88159.86921	33638.96387	18376.79826	22645.46653	27231.98878	152547.3869	46023.22235	174487.6193	89178.16913	18750.7403	42891.69824	21719.24315	64173.63833	41209.48382	5692.666018	60199.77212	103931.9108	66172.06251	35393.36651	56266.78271	105828.4423	52380.84877	83227.59504	39982.21468	44428.80294	14327.18055	30495.03639	38313.2977	49054.7618	15879.16991	25042.16869	89991.37208	16347.659	87009.40309	19269.57457
2'-Deoxycytidine	22853.43587	26420.32453	25994.93988	55853.32819	68407.70165	22953.9188	35581.49935	54950.66177	48416.12739	70719.31261	46519.77317	64467.01303	19579.55467	36875.45508	20963.9558	50392.12243	50217.99541	4257.849509	30256.14912	77235.55171	34234.74297	44279.71256	35998.10681	48635.49607	25606.99871	51166.66949	28692.66462	51895.02655	22376.67781	31143.60899	39580.98339	61107.89549	37399.50718	23430.0141	40556.24689	21819.27687	52972.63854	17063.79458
2'-Deoxyuridine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Biopterin	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Anserine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Cystine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Cytidine	109894.2997	116218.4768	105157.6303	272818.9848	294065.1485	143456.118	162416.277	210616.3265	261720.0602	324530.4579	211402.3841	380409.1058	87539.36473	194685.9374	134768.2319	235766.0717	194795.5957	15301.65855	200203.2193	388418.0423	222053.7408	192655.0001	132320.263	252470.9093	195068.9856	430236.7499	203984.5254	412713.61	121013.987	190691.2816	251281.2426	328118.8738	320235.477	163272.6355	322992.9129	137386.4326	369326.9284	110958.0528
Uridine	41575.34807	41077.51191	35369.17981	74759.30603	91007.77196	38957.4171	55057.16342	68904.48334	79739.95407	89727.90795	72442.15043	115271.9695	31039.76366	65126.46466	46448.69729	78367.35133	59157.98857	6692.71821	79843.72627	115667.6658	82381.97023	62894.35718	71651.01074	100144.2118	66487.48619	136414.0114	66957.42772	137298.2175	43607.97275	66600.51362	88578.90356	100431.7565	111920.5864	61871.43391	109537.9006	42013.11862	126332.4707	47663.61729
isoValerylcarnitine	55667.16456	59248.86185	44372.13988	94687.80325	141803.5039	31400.32479	38384.25083	82713.83522	82850.83574	121863.4395	99595.44939	126839.8233	54803.05116	71567.84918	47293.64343	49187.01727	84815.20346	23413.68036	102324.6413	229206.2645	80244.8157	87735.10681	109447.0895	80203.28545	45677.36606	90482.46672	40604.28862	76323.35518	23180.72218	70287.16293	69715.26475	116182.6783	37884.56616	62905.05763	88861.6776	44962.40917	159990.7311	49308.23105
8C13-Cystine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Neopterin	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
11C13-Uridine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Glycerophosphocholine	635331.6512	202294.1213	346552.2874	733440.1242	575861.6818	236258.1399	229524.4429	439182.9304	450960.1688	583261.776	198763.6913	902907.8431	399141.3072	300973.8038	317279.6525	191871.4433	417233.1451	82745.55229	880561.1251	1004651.898	322184.6069	608424.3943	466706.0136	323110.0602	206752.3281	450328.7075	178816.3727	405276.6088	330677.0412	428500.6765	281681.1153	640022.1061	440936.0358	428027.4914	451574.9153	336302.2274	877397.5491	505303.5481
5-Methylcytidine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Phosphotyrosine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Succinylcarnitine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Thiamine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
2,3-Diphosphoglyceric Acid	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Deoxyguanosine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Adenosine	751171.7926	553659.738	977894.9268	1321161.598	1304994.011	556156.9291	961506.1482	1441146.904	1568024.099	1644414.339	1340395.563	1954595.269	734022.6442	1025240.119	843746.5497	1518003.196	567629.5233	31193.75738	2528128.837	4175387.726	1441412.577	956753.1795	824194.0255	618381.6425	1423084.006	2487037.776	1310869.111	2501870.592	1732599.976	1330404.751	2619035.673	3310485.11	3504945.797	2480184.672	4945902.523	2283832.638	4525134.224	2327598.287
Inosine	44068.64574	323143.0879	58614.59367	357140.7568	278203.9077	106295.549	236359.1584	264155.4134	403359.642	297297.7674	212228.7269	429773.4267	48704.90532	201951.559	57239.193	248749.6618	867304.6529	32526.24719	161565.3198	579790.8743	167154.4392	657057.0739	570373.3423	631979.9745	337576.4887	724246.9973	436053.4407	498827.6862	55157.19256	315997.2587	421414.4349	548429.7657	171220.1411	107944.1314	771720.6458	69763.00286	903757.1606	76300.68248
Glutarylcarnitine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
1-Methyladenosine	14515.37476	7553.882617	8934.197154	10907.07078	26986.22868	12725.1236	13914.62711	25520.3495	6821.449185	20280.73461	15912.50971	22271.92084	5825.620953	11514.59547	12436.369	9956.778396	21376.58551	2233.936566	15819.21671	36113.04531	10900.54971	9987.648631	4014.984528	4977.418093	10595.21841	21375.09847	5789.397809	11068.97473	5822.928926	7924.593774	6247.691606	31554.29049	15758.12009	8706.406463	9362.527262	15776.22435	20055.43856	6600.148173
6-Methyladenosine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Guanosine	28001.95326	75517.33483	34575.54251	105531.1083	74588.28612	32720.96807	75099.03088	82234.61198	110613.5879	106944.442	68319.67339	125498.7693	31601.82029	78066.03511	34490.4137	75368.46217	152141.4183	5662.01091	105064.6801	213729.5931	81047.77094	147082.1406	107904.3148	123405.1391	101914.3314	199011.3899	92080.71469	147406.2379	56380.65867	88941.06262	122077.7406	180041.2685	104966.9267	75663.42886	214492.4748	59495.50817	221601.5347	55905.80443
Retinal	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Retinol	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Argininosuccinate	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
5'-Methylthioadenosine	6133.159939	2887.654755	5081.879757	11959.83996	18889.87261	3369.463147	5957.417053	11092.69025	11879.54756	15522.08438	9772.577359	20483.99149	6135.951399	8292.873273	5616.422858	6644.169406	7643.134525	N/A	21786.62082	32297.00857	14004.47117	10791.91716	14472.0303	9381.684223	7550.491908	16405.24952	4767.732542	13346.75269	15023.28524	9226.534591	6992.662943	15726.10952	17596.56198	9313.084426	11120.8182	10414.70136	30475.36321	12831.46379
N2,N2-Dimethylguanosine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
UMP	275369.4977	186387.5775	328926.4992	702675.3117	592472.2715	290025.1632	387545.3386	388650.9492	930456.1903	541612.8559	425906.0655	887812.2117	489982.9528	462356.8769	334004.3704	376915.5886	451906.7733	151944.818	964254.9102	1118766.012	661943.4801	400262.1326	637643.5092	727750.5283	471819.2418	712132.2873	382262.2315	533020.1222	470023.2952	442073.4143	468767.6277	574110.6382	601489.5545	503517.0295	851095.8117	455798.2329	881661.3215	606833.5733
cAMP	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
GMP	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Riboflavin	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
SAH	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Cholecalciferol	41472.50436	32532.81918	44470.12136	84778.10058	50932.97308	34251.57745	52542.82075	42873.7425	81008.43202	50374.98441	66459.81615	82661.37572	54068.29482	51093.54563	41400.7173	56942.73349	64670.08347	8163.511133	15260.3908	100980.0647	64346.54726	8646.178754	26951.12133	79010.26499	48590.59181	78936.75369	42862.21486	65541.64513	43852.12847	42632.6676	54402.79752	51295.80759	58780.51889	53241.92773	91801.95287	46044.81874	69849.26991	61468.28069
Ergocalciferol	33139.67547	24137.58536	33104.73885	41966.12869	37958.13001	27472.06119	38299.49531	33341.16127	52157.82567	39471.29824	38945.86032	53418.83199	42404.09418	36788.54108	35177.06657	38474.19069	51256.073	8597.704242	41474.96866	65699.17429	32079.83599	14212.55393	45587.91625	35669.29805	29056.18296	48630.84	40768.13373	39439.48001	40938.43804	33328.99182	35281.82098	33129.7531	43998.06446	37775.97192	54287.33535	36781.44124	45315.50202	50226.43936
S-Adenosylmethionine (SAM)	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
CDP	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Thiamine pyrophosphate	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Folic Acid	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Vitamin K1	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Biliverdin	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
NAD	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Methylcobalamin	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Cyanocobalamin (Vitamin B12)	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
NADPH	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Thyroxine	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
FAD	23719.17637	18550.88424	21613.22873	71455.45504	46243.38626	27426.17764	41637.2012	33554.96246	111517.013	46924.61595	52041.66757	94811.54957	32056.21733	64443.38308	27711.0224	53728.40959	18654.5962	1320.169597	87610.39071	132545.2008	89419.09022	13036.34789	29047.1046	53109.66177	51672.26121	93467.27807	43905.39016	59400.33539	11114.74912	35803.8733	54001.50862	49741.49499	35811.28286	40539.60342	94613.22059	29722.8828	65950.15889	45599.50284
Adenosylcobalamin	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A
Ubiquinol	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A	N/A

metabolite_name	Q1	Q3	RT, min	DP	CE	HMDB ID	KEGG ID	Molecular Formula
Trimethylamine (TMA)	60.00	44.00	5.18	50	30	HMDB00906	C00565	C3H9N
Ethanolamine	62.00	44.00	7.50	25	15	HMDB00149	C00189	C2H7NO
Aminoacetone	74.00	56.00	4.50	20	15	HMDB02134	C01888	C3H7NO
1-Methylguanidine	74.01	57.00	5.72	35	19	HMDB01522	C02294	C2H7N3
Glycine	76.00	30.00	8.38	25	17	HMDB00123	C00037	C2H5NO2
Trimethylamine-N-Oxide (TMAO)	76.01	58.00	7.81	175	35	HMDB00925	C01104	C3H9NO
3C13-Glycine	79.00	32.00	8.38	25	17
Putrescine	89.00	72.00	9.10	50	15	HMDB01414	C00134	C4H12N2
betaAlanine	90.00	72.00	8.35	15	11	HMDB00056	C00099	C3H7NO2
Alanine	90.01	44.00	8.21	60	20	HMDB00161	C00041	C3H7NO2
Sarcosine	90.02	44.00	8.04	50	15	HMDB00271	C00213	C3H7NO2
4C13-Alanine	94.00	47.00	8.21	60	20
Betaine Aldehyde	102.00	58.00	5.40	129	31	HMDB01252	C00576	C5H12NO
Cadaverine	103.00	86.00	8.99	75	12	HMDB02322	C01672	C5H14N2
3-Aminoisobutyrate	104.00	86.00	8.05	50	10	HMDB03911	C03284	C4H9NO2
Choline	104.01	60.00	5.91	150	25	HMDB00097	C00114	C5H14NO
Dimethylglycine	104.02	58.00	7.67	50	20	HMDB00092	C01026	C4H9NO2
L-2-Aminobutyric Acid	104.03	30.00	7.96	15	33	HMDB00452	C02356	C4H9NO2
2-Aminoisobutyric Acid	104.04	87.00	8.32	20	17.5	HMDB01906	C03665	C4H9NO2
2C13-Choline	106.00	60.00	5.91	50	17
Serine	106.01	60.00	8.56	50	17	HMDB00187	C00065	C3H7NO3
4C13-Serine	110.00	63.00	8.56	50	17
Hypotaurine	110.01	92.00	8.15	25	13	HMDB00965	C00519	C2H7NO2S
Cytosine	112.00	95.00	4.76	75	25	HMDB00630	C00380	C4H5N3O
Histamine	112.01	95.00	7.82	50	20	HMDB00870	C00388	C5H9N3
Creatinine	114.00	44.00	3.77	75	35	HMDB00562	C00791	C4H7N3O
5,6-Dihydrouracil	115.00	70.00	9.50	109	19	HMDB00076	C00429	C4H6N2O2
Proline	116.00	70.00	7.75	55	25	HMDB00162	C00148	C5H9NO2
d3-Creatinine	117.00	47.00	3.77	75	35
5-Aminovaleric Acid	118.00	101.00	8.28	50	15	HMDB03355	C00431	C5H11NO2
Betaine	118.01	58.00	7.32	125	35	HMDB00043	C00719	C5H11NO2
Valine	118.02	72.00	7.68	60	15	HMDB00883	C00183	C5H11NO2
Indole	118.03	91.00	1.25	50	30	HMDB00738	C00463	C8H7N
Threonine	120.00	74.00	8.32	50	15	HMDB00167	C00188	C4H9NO3
Cysteine	122.00	59.00	7.99	1	31	HMDB00574	C00097	C3H7NO2S
6C13-Proline	122.01	75.00	7.75	55	25
Niacinamide	123.00	80.00	1.86	50	25	HMDB01406	C00153	C6H6N2O
6C13-Valine	124.00	77.00	7.68	60	15
5C13-Threonine	125.00	78.00	8.32	50	15
Taurine	126.00	108.00	7.78	50	15	HMDB00251	C00245	C2H7NO3S
1-Methylhistamine	126.01	96.00	7.44	50	30	HMDB00898	C05127	C6H11N3
Imidazoleacetic Acid	127.00	81.00	8.21	41	23	HMDB02024	C02835	C5H6N2O2
5,6-Dihydrothymine	129.00	69.00	1.85	21	19	HMDB00079	C00906	C5H8N2O2
Pyroglutamic Acid	130.00	84.00	7.89	26	21	HMDB00267	C01879	C5H7NO3
Pipecolate	130.01	84.00	7.77	31	25	HMDB00070	C00408	C6H11NO2
Agmatine	131.00	72.00	8.94	15	21	HMDB01432	C00179	C5H14N4
N-Acetylputrescine	131.01	114.00	7.38	50	15	HMDB02064	C02714	C6H14N2O
Creatine	132.00	90.00	8.24	50	20	HMDB00064	C00300	C4H9N3O2
Hydroxyproline	132.01	86.20	8.10	50	20	HMDB00725	C01157	C5H9NO3
Aminolevulinate	132.02	114.00	8.48	1	15	HMDB01149	C00430	C5H9NO3
Leucine /D-Norleucine	132.03	86.00	7.18	100	15	HMDB00687	C00123	C6H13NO2
iso-Leucine /allo-isoLeucine	132.04	86.00	7.30	100	15	HMDB00172/HMDB00557	C00407/C21096	C6H13NO2
Ornithine	133.00	70.00	9.25	75	25	HMDB0000214	C01602	C5H12N2O2
Asparagine	133.01	74.00	8.61	75	20	HMDB00168	C00152	C4H8N2O3
Aspartic Acid	134.00	74.00	9.00	50	20	HMDB00191	C00049	C4H7NO4
Homocysteine	136.00	90.00	7.66	50	15	HMDB00742	C00155	C4H9NO2S
S-Methylcysteine	136.01	119.00	7.69	25	13	HMDB02108	C22040	C4H9NO2Se
1-Methylnicotinamide	137.00	94.00	7.11	52	29	HMDB00699	C02918	C7H9N2O
Tyramine	138.00	121.00	4.72	20	17	HMDB00306	C00483	C8H11NO
4-Aminobenzoic Acid	138.01	120.00	1.95	25	21	HMDB01392	C00568	C7H7NO2
Trigonelline	138.02	94.00	7.52	45	29	HMDB00875	C01004	C7H7NO2
5C13-Aspartic Acid	139.00	77.00	9.00	50	20
6C13-Asparagine	139.01	77.00	8.61	75	20
7C13-Leucine	139.02	92.00	7.18	100	15
7C13-iso-Leucine	139.03	92.00	7.30	100	15
1-Methylimidazole Acetate	141.00	95.00	7.72	35	25	HMDB02820	C05828	C6H8N2O2
Imidazole Propionate	141.01	123.00	7.88	20	17	HMDB02271	C20522	C6H8N2O2
Spermidine	146.00	72.00	10.12	50	20	HMDB01257	C00315	C7H19N3
4-Guanidinobutanoate	146.01	87.00	8.09	25	21	HMDB03464	C01035	C5H11N3O2
Acetylcholine	146.02	87.00	2.96	40	20	HMDB00895	C01996	C7H16NO2
Glutamine	147.00	84.00	8.51	50	25	HMDB00641	C00064	C5H10N2O3
Lysine	147.01	84.00	9.21	75	25	HMDB00182	C00047	C6H14N2O2
Deoxycarnitine	147.02	87.00	8.32	50	20	HMDB01161	C01181	C7H16NO2
Glutamic acid	148.00	84.00	8.88	55	20	HMDB0000148	C00025	C7H16NO2
Methionine	150.00	61.00	7.48	55	30	HMDB00696	C00073	C5H11NO2S
2C13-Glutamic acid	150.01	85.00	8.88	55	20
Guanine	152.00	135.00	6.42	45	27	HMDB00132	C00242	C5H5N5O
Cystamine	153.00	108.00	8.88	50	15	N/A	N/A	C4H12N2S2
7C13-Glutamine	154.00	89.00	8.51	50	25
6C13-Glutamic acid	154.01	89.00	8.88	55	20
8C13-Lysine	155.00	90.00	9.21	75	25
6C13-Methionine	156.00	63.00	7.48	55	30
Histidine	156.01	110.00	8.71	75	20	HMDB00177	C00135	C6H9N3O2
Serotonin	160.00	115.00	5.40	45	31	HMDB00259	C00780	C10H12N2O
Tryptamine	161.00	144.00	3.10	30	17	HMDB00303	C00398	C10H12N2
Carnitine	162.00	85.00	8.20	75	30	HMDB00062	C00487	C7H16NO3
9C13-Histidine	165.00	118.00	8.71	75	20
Phenylalanine	166.00	120.00	7.12	60	20	HMDB00159	C00079	C9H11NO2
Methionine Sulfoxide	166.01	74.00	8.46	30	19	HMDB02005	C02989	C5H11NO3S
7-Methylguanine	166.03	149.00	4.28	45	27	HMDB00897	C02242	C6H7N5O
Normetanephrine	166.04	121.00	6.03	45	23	HMDB00819	C05589	C9H13NO3
Taurocyamine	168.00	126.00	7.75	43	21	HMDB03584	C01959	C3H9N3O3S
Pyridoxamine	169.00	152.00	7.92	24	17	HMDB01431	C00534	C3H9N3O3S
1/3-Methylhistidine	170.00	96.00	8.87	50	25	HMDB00001	C01152	C7H11N3O2
Norepinephrine	170.01	152.00	9.10	40	15	HMDB00216	C00547	C8H11NO3
n-Glycylproline	173.00	116.00	8.62	15	19	HMDB00721	N/A	C7H12N2O3
Arginine	175.00	70.00	9.17	60	30	HMDB00517	C00062	C6H14N4O2
N-Acetylornithine	175.01	115.00	8.46	53	17	HMDB03357	C00437	C7H14N2O3
10C13-Phenylalanine	176.00	129.00	7.12	60	20
Cotinine	177.00	80.00	1.80	50	30	HMDB01046	N/A	C10H12N2O
Cysteinyl-Glycine (Cys-Gly)	179.00	76.00	9.72	165	25	HMDB0000078	C01419	C5H10N2O3S
Gluconolactone	179.01	82.00	9.47	40	19	HMDB00150	C00198	C6H10O6
Glucosamine	180.10	162.00	8.60	50	10	HMDB0001514	C00329	C6H13NO5
Theobromine	181.10	138.00	1.85	30	25	HMDB02825	C07480	C7H8N4O2
1,7-Dimethylxanthine	181.11	124.00	1.85	61	27	HMDB01860	C13747	C7H8N4O2
Tyrosine	182.10	136.00	7.71	75	20	HMDB00158	C00082	C9H11NO3
Epinephrine	184.10	166.00	9.10	30	15	HMDB00068	C00788	C9H13NO3
Se-Methylselenocysteine	184.11	167.00	7.58	25	13	HMDB04113	C05689	C4H9NO2Se
2C13-Tyrosine	184.12	138.00	7.71	75	20
Phosphorylcholine	185.10	87.00	9.02	43	23	HMDB01565	C00588	C5H15NO4P
10C13-Arginine	185.11	75.00	9.17	60	30
N6-Acetyl-Lysine	189.10	126.00	8.13	25	19	HMDB00206	C02727	C8H16N2O3
Homoarginine	189.11	144.00	9.07	25	23	HMDB00670	C01924	C7H16N4O2
N6-Trimethyllysine	189.12	84.00	9.01	40	29	HMDB01325	C03793	C9H20N2O2
Homocitrulline	190.10	173.00	8.49	20	15	HMDB00679	C02427	C7H15N3O3
10C13-Tyrosine	192.11	145.00	7.71	75	20
Caffeine	195.10	138.00	1.57	30	27	HMDB01847	C07481	C8H10N4O2
Salicylurate	196.10	121.00	3.50	20	23	HMDB00840	C07588	C9H9NO4
DL DOPA	198.10	152.00	8.10	25	19	HMDB00609	C00355	C9H11NO4
Selenomethionine	198.11	181.00	7.38	21	15	HMDB03966	C05335	C5H11NO2Se
Dimethylarginine (A/SDMA)	203.10	70.00	8.82	20	33	HMDB01539/HMDB03334	C03626	C8H18N4O2
Spermine	203.11	129.00	8.54	25	17	HMDB01256	C00750	C10H26N4
3-Indolebutyric Acid	204.10	186.00	1.57	20	19	HMDB02096	C11284	C12H13NO2
Acetylcarnitine	204.11	85.00	7.65	50	25	HMDB00201	C02571	C9H18NO4
Tryptophan	205.10	146.00	7.18	75	25	HMDB00929	C00078	C11H12N2O2
L-Kynurenine	209.10	94.00	7.20	50	20	HMDB00684	C00328	C10H12N2O3
Phosphocreatine	212.10	114.00	9.28	20	21	HMDB01511	C02305	C4H10N3O5P
N-Ac-Arginine	217.10	158.00	8.34	35	23	HMDB04620	N/A	C8H16N4O3
13C13-Tryptophan	218.10	156.00	7.18	75	25
Carnosine	227.10	110.00	9.11	40	31	HMDB00033	C00386	C9H14N4O3
2'-Deoxycytidine	228.10	112.00	5.36	45	17	HMDB00014	C00881	C9H13N3O4
2'-Deoxyuridine	229.10	113.00	2.80	60	20	HMDB0000012	C00526	C9H12N2O5
Biopterin	238.10	220.00	6.87	35	19	HMDB00468	C06313	C9H11N5O3
Anserine	241.10	109.00	9.11	45	31	HMDB00194	C01262	C10H16N4O3
Cystine	241.11	120.10	9.48	100	35	HMDB00192	C00491	C6H12N2O4S2
Cytidine	244.20	112.10	6.93	60	20	HMDB00089	C00475	C9H13N3O5
Uridine	245.20	113.10	3.99	60	15	HMDB00296	C00299	C9H12N2O6
isoValerylcarnitine	246.20	85.00	6.36	35	27	HMDB00688	C20826	C12H23NO4
8C13-Cystine	249.20	124.00	9.48	100	35
Neopterin	254.20	206.00	7.94	41	25	HMDB00845	C05926	C9H11N5O4
11C13-Uridine	256.20	119.10	3.99	60	15
Glycerophosphocholine	258.20	104.00	8.46	37	23	HMDB00086	C00670	C8H21NO6P
5-Methylcytidine	258.21	126.00	6.47	30	21	HMDB00982	N/A	C10H15N3O5
Phosphotyrosine	262.20	216.00	9.22	15	19	HMDB06049	C06501	C9H12NO6P
Succinylcarnitine	262.21	85.00	8.69	45	29	HMDB61717	N/A	C11H19NO6
Thiamine	265.20	122.00	7.54	16	14	HMDB00235	C00378	C12H17N4OS
2,3-Diphosphoglyceric Acid	267.20	169.00	9.95	40	17	HMDB01294	C01159	C3H8O10P2
Deoxyguanosine	268.20	152.00	6.64	15	17	HMDB00085	C00330	C10H13N5O4
Adenosine	268.21	136.10	3.91	60	25	HMDB00050	C00212	C10H13N5O4
Inosine	269.20	137.10	6.04	60	20	HMDB00195	C00294	C10H12N4O5
Glutarylcarnitine	276.20	85.00	8.49	25	29	HMDB13130	N/A	C12H21NO6
1-Methyladenosine	282.20	150.10	7.61	40	30	HMDB03331	C02494	C11H15N5O4
6-Methyladenosine	282.21	150.10	2.82	50	27	HMDB04044	N/A	C11H15N5O4
Guanosine	284.20	152.10	7.32	60	20	HMDB00133	C00387	C10H13N5O5
Retinal	285.20	161.00	1.50	50	15	HMDB01358	C00376	C20H28O
Retinol	287.20	269.10	1.50	50	15	HMDB00305	C19962	C20H30O
Argininosuccinate	291.20	70.00	9.53	35	53	HMDB00052	C03406	C10H18N4O6
5'-Methylthioadenosine	298.20	136.00	1.88	30	23	HMDB01173	C00170	C11H15N5O3S
N2,N2-Dimethylguanosine	312.20	180.10	4.58	60	25	HMDB04824	N/A	C12H17N5O5
UMP	325.20	97.00	8.75	26	19	HMDB0000288	C00105	C9H13N2O9P
cAMP	330.20	136.00	7.75	30	33	HMDB00058	C00575	C10H12N5O6P
GMP	364.20	152.00	9.05	50	20	HMDB01397	C00144	C10H14N5O8P
Riboflavin	377.20	243.00	5.85	30	31	HMDB00244	C00255	C17H20N4O6
SAH	385.20	136.00	8.56	11	25	HMDB0000939	C00021	C14H20N6O5S
Cholecalciferol	385.21	91.00	1.27	40	83	HMDB00876	C05443	C27H44O
Ergocalciferol	397.20	91.00	1.27	20	85	HMDB00900	C05441	C28H44O
S-Adenosylmethionine (SAM)	399.20	250.00	9.35	31	23	HMDB01185	C00019	C15H22N6O5S
CDP	404.20	112.00	9.67	41	23	HMDB01546	C00112	C9H15N3O11P2
Thiamine pyrophosphate	425.20	122.00	9.50	35	41	HMDB0001372	C00068	C12H19N4O7P2S
Folic Acid	442.20	295.00	8.64	46	23	HMDB00121	C00504	C19H19N7O6
Vitamin K1	451.20	187.00	1.23	42	33	HMDB03555	C02059	C31H46O2
Biliverdin	583.20	297.10	3.00	25	43	HMDB01008	C00500	C33H34N4O6
NAD	664.20	428.00	9.15	25	37	HMDB00902	C00003	C21H28N7O14P2
Methylcobalamin	672.80	665.30	8.15	60	27	HMDB02274	C06453	C63H91CoN13O14P
Cyanocobalamin (Vitamin B12)	678.40	147.10	8.31	35	41	HMDB00607	C02823	C62H88CoN13O14PR
NADPH	746.20	729.00	9.55	20	25	HMDB00221	C00005	C21H30N7O17P3
Thyroxine	777.50	731.60	3.00	80	33	HMDB00248	C01829	C15H11I4NO4
FAD	786.20	348.00	8.96	30	29	HMDB01248	C00016	C27H33N9O15P2
Adenosylcobalamin	790.40	665.30	8.73	55	29	HMDB02086	C00194	C72H100CoN18O17P
Ubiquinol	866.20	197.00	1.20	140	47	HMDB13111	C11378	C59H90O4