Metabolite_name	RefMet_name	M5B2	M5B3	M5D7	M7C6	M10C5	M11C2	M2B3	M2B6	M2C1	M3A7	M6A6	M12A1	M7D6	M8B2	M8D2	M10D2	M11A2	M4B1	M4D5	M2A1	M2B4	M2C6	M3A2	M3B2	M3C3	M3D5	M1C1	M1C2	M1C4	M6B3	M6C3	M6D2	M12B3	M12D3	M7D5	M10A7	M10B5	M10D3	M11A7	M11D3	M2B7	M2C4	M3D6	M1A1	M1B2	M1C5	M6A5	M12B4	M7A5	M8C1	M11B2	M4D4	M2A3	M1D1	M1D7	M6B6	M6C2
Factors	-	TreatmentDuration (days):30 | ph treatment:high | DO treatment:high	TreatmentDuration (days):30 | ph treatment:high | DO treatment:high	TreatmentDuration (days):30 | ph treatment:high | DO treatment:high	TreatmentDuration (days):30 | ph treatment:high | DO treatment:high	TreatmentDuration (days):30 | ph treatment:high | DO treatment:low	TreatmentDuration (days):30 | ph treatment:high | DO treatment:low	TreatmentDuration (days):30 | ph treatment:low | DO treatment:high	TreatmentDuration (days):30 | ph treatment:low | DO treatment:high	TreatmentDuration (days):30 | ph treatment:low | DO treatment:high	TreatmentDuration (days):30 | ph treatment:low | DO treatment:high	TreatmentDuration (days):30 | ph treatment:low | DO treatment:low	TreatmentDuration (days):31 | ph treatment:high | DO treatment:high	TreatmentDuration (days):31 | ph treatment:high | DO treatment:high	TreatmentDuration (days):31 | ph treatment:high | DO treatment:high	TreatmentDuration (days):31 | ph treatment:high | DO treatment:high	TreatmentDuration (days):31 | ph treatment:high | DO treatment:low	TreatmentDuration (days):31 | ph treatment:high | DO treatment:low	TreatmentDuration (days):31 | ph treatment:high | DO treatment:low	TreatmentDuration (days):31 | ph treatment:high | DO treatment:low	TreatmentDuration (days):31 | ph treatment:low | DO treatment:high	TreatmentDuration (days):31 | ph treatment:low | DO treatment:high	TreatmentDuration (days):31 | ph treatment:low | DO treatment:high	TreatmentDuration (days):31 | ph treatment:low | DO treatment:high	TreatmentDuration (days):31 | ph treatment:low | DO treatment:high	TreatmentDuration (days):31 | ph treatment:low | DO treatment:high	TreatmentDuration (days):31 | ph treatment:low | DO treatment:high	TreatmentDuration (days):31 | ph treatment:low | DO treatment:low	TreatmentDuration (days):31 | ph treatment:low | DO treatment:low	TreatmentDuration (days):31 | ph treatment:low | DO treatment:low	TreatmentDuration (days):31 | ph treatment:low | DO treatment:low	TreatmentDuration (days):31 | ph treatment:low | DO treatment:low	TreatmentDuration (days):31 | ph treatment:low | DO treatment:low	TreatmentDuration (days):32 | ph treatment:high | DO treatment:high	TreatmentDuration (days):32 | ph treatment:high | DO treatment:high	TreatmentDuration (days):32 | ph treatment:high | DO treatment:high	TreatmentDuration (days):32 | ph treatment:high | DO treatment:low	TreatmentDuration (days):32 | ph treatment:high | DO treatment:low	TreatmentDuration (days):32 | ph treatment:high | DO treatment:low	TreatmentDuration (days):32 | ph treatment:high | DO treatment:low	TreatmentDuration (days):32 | ph treatment:high | DO treatment:low	TreatmentDuration (days):32 | ph treatment:low | DO treatment:high	TreatmentDuration (days):32 | ph treatment:low | DO treatment:high	TreatmentDuration (days):32 | ph treatment:low | DO treatment:high	TreatmentDuration (days):32 | ph treatment:low | DO treatment:low	TreatmentDuration (days):32 | ph treatment:low | DO treatment:low	TreatmentDuration (days):32 | ph treatment:low | DO treatment:low	TreatmentDuration (days):32 | ph treatment:low | DO treatment:low	TreatmentDuration (days):33 | ph treatment:high | DO treatment:high	TreatmentDuration (days):33 | ph treatment:high | DO treatment:high	TreatmentDuration (days):33 | ph treatment:high | DO treatment:high	TreatmentDuration (days):33 | ph treatment:high | DO treatment:low	TreatmentDuration (days):33 | ph treatment:high | DO treatment:low	TreatmentDuration (days):33 | ph treatment:low | DO treatment:high	TreatmentDuration (days):33 | ph treatment:low | DO treatment:low	TreatmentDuration (days):33 | ph treatment:low | DO treatment:low	TreatmentDuration (days):33 | ph treatment:low | DO treatment:low	TreatmentDuration (days):33 | ph treatment:low | DO treatment:low
1_2_4-benzenetriol	1,2,4-Trihydroxybenzene	291	802	857	607	1274	670	531	968	681	409	494	520	458	1056	79	319	437	778	301	599	447	217	1408	416	591	270	425	916	174	313	464	330	807	213	554	561	720	582	412	600	456	510	769	674	84	578	164	522	463	815	798	606	496	1130	867	462	728
1-kestose	1-Kestose	1084	638	678	288	325	386	449	708	365	267	1075	236.5000	240	245	178	270	443	205	463	366	154	192	367	770	114	515	705	722	260	263	456	484	779	504	673	527.5000	357	1689	1606	588	1290	486	237	230	183	134	380	492	297	269	701	1327	327	1039	593	485	549
2_3-dihydroxybutanoic acid NIST	2,3-Dihydroxybutanoic acid	1049	836	976	1408	996	641	506	603	723	497	647	635	404	1211	188	850	607	671	688	683	382	642	1996	1103	596	436	767	669	321	399	951	662	1032	612	873	1123	1002	1132	696	1906	940	992	1088	615	321	827	602	850	995	1706	736	1405	629	1477	1322	851	1411
2_5-dihydroxypyrazine NIST	2,5-Dihydroxypyrazine	15232	17251	15512	13206	10616	13878	11458	10618	16375	12431	10255	17003	10173	17186	10230	17305	17702	10123	14809	21096	6474	15628	21882	19905	14615	11834	11219	7505	14122	5427	17921	16431	29810	24717	20157	19754	17956	25936	16450	25105	21018	28068	30751	10245	8974	16482	8988	13451	20970	17487	15583.5000	24716	14268	14662	17403	15743	21686
2_6-diaminopimelic acid	2,6-Diaminopimelic acid	2911	705	1391	558	2645	2340	1438	2194	3333	1606	1521	904	1217	1540	406	1047	540	4071	845	1608	1022	2186	1320	810	2864	1691	1188	1003	431	726	1574	653	1014	329	796	1260.5000	556	1509	3678	2461	1765	687	2214	1195	1255	2097	731	1385	3757	1716	1234.5000	356	2000	1200	1693	843	1046
2-aminobutyric acid	2-Aminobutyric acid	38987	94163	56245	55738	92734	41601	39504	136923	75393	56574	97509	50338.5000	65908	98020	21064	71683	65370	102570	58870	76934	70964	61084	49988	67438	81003	91284	119223	123491	49818	61049	124781	76160	159192	84050	63730	51689.5000	64767	121647	95232	118565	64879	46357	67963	55015	39382	40391	44912	44131	68907	26103	75080.5000	77217	53059	55011	33203	94731	53083
2^-deoxyguanosine	Deoxyguanosine	1540	1382	1153	1788	1410	1575	1637	2150	1565	1109	790	834.5000	774	2125	536	660	655	1454	591	1224	755	724	2226	2110	1436	771	695	1151	534	672	1105	1121	819	911	956	919.5000	1223	1647	1003	1288	1051	1390	1803	1542	741	1652	553	1389	1477	1026	839	1391	1530	801	848	2238	1568
2-hydroxyglutaric acid	2-Hydroxyglutaric acid	9377	8603	8803	7905	6718	18678	10904	21268	6926	5741	6996	8251.5000	5526	10470	6083	8012	5697	10674	4018	7939	5188	5436	13109	6652	9108	9498	11616	18464	4828	7192	10768	8996	16904	10639	13936	10727	26264	35150	8067	21807	13515	12065	4681	10351	3436	14755	4950	7113	5838	9118	8208	8819	6409	10047	7882	13606	7989
2-picolinic acid	Picolinic acid	282495	223682	185609	201238	185778	177600	305158	205710	323171	83334	176271	152850	57966	273250	86327	165131	151315	162822	116555	229153	58323	143372	500099	305898	145613	95364	136227	212013	50422	124802	194665	204630	317371	126453	191532	231054.5000	238912	343117	205406	333496	227409	136497	252038	163112	106307	439603	129110	500312	253877	438041	188798	138468	219105	167767	179953	478265	246473
3-aminoisobutyric acid	3-Aminoisobutanoic acid	5770	4199	4106	5589	4812	4845	3839	5226	4746	4085	6323	5147	4133	5330	2717	3389	3207	5173	2784	4093	4379	3680	5627	4404	4920	5585	9822	4441	3792	4783	3632	4623	5298	5377	2525	3462.5000	3572	6121	6439	4942	4738	4169	3884	4674	4684	3504	3706	3757	5004	4303	4766	4148	4377	3990	6634	3969	7889
3-arylcarbonyl-alanine NIST		958	1286	1202	1576	1270	780	1511	1839	749	1091	1062	572	451	1469	854	1182	629	969	1377	659	570	403	5906	2403	2671	370	838	1018	427	441	1341	1863	1014	838	1944	1749.5000	1238	1207	1007	1468	1509	1747	1402	932	1157	3591	1941	793	966	1649	815	1490	1249	1480	2325	2879	1337
3-hydroxybutyric acid	3-Hydroxybutyric acid	471	694	3669	3478	3658	1946	541	458	1072	1497	286	3076.5000	1572	1195	2165	1079	2041	646	1666	819	1530	1515	1226	1346	582	452	920	363	2059	1277	935	1080	4059	1084	508	1204	984	1296	3198	677	2909	842	1565	1104	1855	585	559	409	1786	1032	677.5000	344	1602	4207	528	4999	723
3-phosphoglycerate	3-Phosphoglyceric acid	1478	1524	1281	1892	1002	1562	2215	1789	1901	573	1011	750.5000	466	1336	816	1217	1066	1386	1047	1815	483	1038	1323	988	580	342	1917	1474	320	539	1927	2028	96	2363	1149	1332	1127	2253	1295	2237	2114	1259	1890	919	991	2141	827	2361	1505	3913	1894	1216	1718	1868	2856	2490	3721
4-aminobutyric acid	4-Aminopentanoic acid	22335	20594	17856	22323	18341	21725	18955	20242	24791	16416	8774	14611	8262	23168	7871	14036	20407	27624	10315	20830	7724	12536	25040	16598	18270	10940	16311	16981	11735	13304	16958	20820	23990	16535	18336	17936.5000	28724	23064	21947	24850	18522	23111	19226	14558	12413	33139	16413	18949	22463	30421	17282.5000	20959	12661	23700	21071	21624	28762
4-hydroxybutyric acid	4-Hydroxybutyric acid	3481	3951	6630	5857	9353	4696	5077	4318	8040	2799	2548	3329	2410	8633	2320	2355	3407	6018	2221	4262	2382	2315	10316	4404	4613	2124	2338	5080	1621	1963	3887	3625	5647	2237	2025	3358	6237	5049	2748	4881	2417	5248	8062	4569	2036	7107	2086	9125	4012	5969	3840	6512	5359	8304	5426	4911	7815
5^-deoxy-5^-methylthioadenosine	5'-Methylthioadenosine	271	355	428	339	249	363	251	468	506	229	313	241.5000	182	546	202	196	208	395	185	427	241	381	476	453	359	175	368	211	130	211	228	462	379	311	244	213.5000	281	719	547	270	349	590	416	185	170	553	229	356	283	401	281.5000	320	390	249	500	519	800
5-hydroxynorvaline NIST	L-2-Amino-5-hydroxypentanoic acid	2298	2451	2418	2795	2616	2758	3110	2439	3141	1659	2348	1911.5000	1352	3936	1325	2143	1504	3276	1441	2246	709	1298	4445	2924	2195	2004	1982	2881	1357	1313	2359	1922	3333	1802	3158	2286	4001	3758	2119	3146	3111	2499	3013	2124	1814	3658	1412	3420	3074	2935	2566.5000	1741	1979	2582	3374	3457	3681
5-methoxytryptamine	5-Methoxytryptamine	1599	1416	1877	1851	1871	1202	2639	2152	4430	1501	1466	2332.5000	1267	2145	690	1182	1079	1441	1244	1478	1967	3508	2737	1137	5081	2609	928	1312	521	592	1140	1218	1434	1135	773	1293.5000	1789	1711	1096	2532	742	1714	2554	1441	531	3211	586	3610	5475	2987	1434.5000	1638	3415	1775	1433	1217	2659
adenine	Adenine	2363	2671	2775	3281	3769	2717	2589	3984	3505	1625	2107	2705	1295	2445	681	1921	1771	2927	1568	3178	1620	1742	6906	3878	3148	1714	2476	2603	510	958	2255	1623	5053	2467	2861	2887	4023	4628	2499	3485	3074	3742	4019	2082	1170	3926	1627	3339	4031	3916	2875	2509	2199	3659	3931	3789	3979
adenosine	Adenosine	8032	11708	9418	10551	4697	32436	8350	12151	9571	9573	6693	7389	3322	11489	3642	4236	3882	7396	2757	7677	3793	2191	18463	10445	9640	8055	4531	7133	8905	3628	7861	6893	17938	3851	7046	5606	12173	9208	5615	5978	4377	9473	7462	6257	2550	5248	3256	5632	7714	3311	6030.5000	9912	7479	8520	6604	9527	6765
adenosine-5-monophosphate	AMP	16348	25001	26320	17781	16392	13648	26168	47969	21229	13065	24767	16088	12175	22715	19821	18074	10699	16180	15220	21302	18163	12147	8552	18409	29675	12951	22123	20787	8629	14615	22449	14538	13611	23697	13001	23814.5000	21748	27860	18380	11366	33975	21170	32891	24927	11242	22515	11935	24368	19709	13929	23587.5000	26079	27965	16670	31455	21669	23539
alanine	Alanine	2374149	3238457	2023533	1764525	2769898	1537351	2278343	2336504	2661195	1967381	2433660	2141561	2206066	1689163	2001031	1401122	1247258	1045345	973620	1891080	1293153	1218821	1060894	1358075	1601140	1768915	2942393	2307283	2216567	1326177	1963443	2017924	2549699	3114595	1560192	1395348.5000	2731939	1516142	2677898	967699	2715022	2098101	1850007	2010072	1946273	2264604	950193	2072747	2271117	2531785	1437539.5000	2083289	1728935	2425419	2679771	1598707	2897559
alpha-aminoadipic acid	alpha-Aminoadipic acid	10157	22181	20107	13705	7138	18927	9086	13484	14695	38852	8643	25476	24015	38198	22747	26127	39257	22865	41189	20004	40209	46834	12427	23584	20235	15697	23788	28969	50600	38084	23190	34921	11884	33416	13563	26842	14316	12021	11935	27926	21060	33949	13057	28913	33138	21384	45096	11241	9317	16849	17275	12213	36759	32429	11274	8504	13305
alpha-ketoglutarate	2-Oxoglutaric acid	454	757	370	317	350	524	318	427	325	215	121	438.5000	137	624	627	424	329	676	537	232	186	223	456	554	268	152	343	797	530	284	736	605	465	769	448	1083.5000	480	611	115	619	673	627	478	378	308	781	274	320	216	484	628.5000	297	274	370	457	733	489
aminomalonate	Aminomalonic acid	743542	635473	611590	1076687	494573	778134	499182	708736	718706	529001	499753	637043.5000	191182	956879	214812	639580	440908	599213	480941	605577	306695	456869	1227638	975913	877656	297060	432748	493454	266223	441575	597083	433211	842572	443085	1110552	949530	495293	1091352	688360	1133681	868136	962183	653797	424229	297428	953068	506490	1065301	683412	690754	729577	552495	705032	1163521	619200	1019867	734672
arachidic acid	Arachidic acid	5258	2932	3950	1590	2447	4447	955	5416	2333	1161	2653	2425	1977	4889	1035	2408	1631	3464	1696	3557	526	2821	4727	727	2554	2367	998	2775	1162	1288	3008	2780	3859	2709	3311	2356.5000	2700	6413	2762	4214	2958	3875	3805	1228	1179	1440	1350	5059	4049	22174	3414	4975	2311	3458	5603	1731	3805
asparagine	Asparagine	50701	145027	64806	77231	100846	123742	50709	85560	86384	117667	65385	125747	130422	55854	134311	66506	140318	74946	59381	71514	81846	45903	37967	25485	72083	70219	50719	38902	111321	84974	81497	108891	60148	75501	55967	67608	81837	40922	74779	67074	53206	34721	39857	53805	110272	40537	75333	46855	79173	43868	86306.5000	80575	105607	59419	44103	62266	99743
aspartic acid	Aspartic acid	727887	1032330	764606	1103631	810502	831136	640134	877496	791092	663118	615408	757411.5000	636198	799949	669137	649362	860281	489649	545523	814233	337182	486053	752376	635949	567818	449449	502231	398350	564712	479945	669590	752471	1020168	648139	838417	670570	1085595	691869	747696	751158	843837	781195	930923	566473	610841	1010134	445139	1148094	741257	1398541	934232	642877	731482	829803	1041351	825683	1222209
benzoic acid	Benzoic acid	3004	2783	2703	2904	3781	2584	3107	3163	2432	1364	1917	1859.5000	1121	2798	653	1637	1983	3193	1419	2934	1063	1035	5612	2734	2336	1356	2397	2992	764	1406	1987	1927	5569	2331	1717	2685.5000	3374	3240	2750	3349	2981	2658	5480	2058	1006	3984	1623	4030	2823	4122	2649	2354	1278	3358	3346	3482	4707
beta-alanine	beta-Alanine	17093	18925	20297	30150	28373	19967	20321	26146	27064	9382	10707	11674.5000	8490	22769	6899	8516	11004	19891	7036	29508	7765	9643	39954	18828	15137	10980	14293	17987	6091	8096	13753	16452	32409	14030	12337	17189	25878	22663	16252	18561	14215	23026	36637	13756	8036	28641	8454	28015	23320	30398	19265	17343	15583	23431	21813	25699	33149
beta-glutamic acid	Isoglutamic acid	9679	7394	23104	5838	23744	20253	11903	30929	6559	24288	16292	23493	18224	8199	2591	10606	12569	29330	15585	13454	13734	7001	9461	7118	9229	2536	7781	7301	24458	4172	11199	6377	26322	6502	15099	6598.5000	7389	17075	13067	14973	23545	8817	7681	6741	6850	10187	7866	13180	5793	26890	11509.5000	25708	6342	8097	16676	14631	9422
butyrolactam NIST	2-Pyrrolidinone	8360	4979	5807	6206	8597	4572	4626	10669	13594	3904	7094	19116	4821	6753	2842	3084	3955	5469	2739	5857	4586	5176	12754	3897	7221	17104	4579	4102	2360	2471	4853	5771	6532	4298	4451	3646.5000	7618	5622	4755	6522	4506	5160	7763	4547	2351	7460	2852	11484	39586	9185	6407	7190	4245	7150	6028	5203	7627
cellobiose	Cellobiose	1463	718	1681	911	603	1283	546	1581	2454	478	917	794	620	816	403	1349	488	1588	958	1000	797	817	570	2096	1315	1341	492	997	164	598	4558	1215	420	315	1132	8703	681	1022	700	762	1336	1159	2441	467	505	1334	1056	1215	359	1052	1061.5000	3184	1054	1025	1389	1404	1840
cholesterol	Cholesterol	1731	7546	4076	2129	2153	1180	2549	2049	6900	3071	6859	1610	1463	4706	2569	797	3628	1954	666	2097	3839	474	7597	13663	3562	1240	2019	16173	756	2268	3533	3918	10217	1117	1825	2651	3315	3273	1110	2635	1085	1976	10715	2680	3767	4215	1446	3209	3536	5203	5516	5926	4509	3048	3207	7556	2151
citric acid	Citric acid	2908	4876	4310	6698	4291	7636	3365	10609	5744	8555	5887	6656.5000	4467	19291	7574	4383	5820	5391	4776	18026	26687	8473	14238	16244	23225	7473	27226	10362	6069	17328	8191	27022	6019	20399	8885	5835	5671	11669	2852	10914	13907	13062	3713	14647	7982	6394	8860	4094	9338	4997	4588	7308	5054	10149	3122	10227	3977
citrulline	Citrulline	141733	81996	83305	82042	95287	89445	121274	113425	76991	52033	86755	61097	51375	72926	41004	60899	49282	99022	58007	76404	47040	33601	127231	66075	83770	33545	82337	90055	32056	53677	81003	84513	96196	102670	71662	60031.5000	114879	110894	117455	93155	81571	52654	114345	66778	45279	134672	46182	124237	91459	171722	89897	76760	60690	73794	151657	89334	111254
conduritol-beta-epoxide minor	Conduritol epoxide	2651	2864	2520	2648	1894	5382	2566	2500	3358	1412	3060	4242.5000	1451	2666	1054	1888	2017	1506	1126	17970	1943	2163	7512	2454	3374	2757	2114	1925	820	1909	4017	1825	4846	2475	1479	2919	2278	3657	4997	3089	3392	2348	3080	2010	1941	4431	886	2704	6704	1965	2621	1266	2307	3285	2798	1891	4662
cystathionine nist	Cystathionine	66289	115615	92131	132710	46504	400964	194824	323661	101955	177158	148318	161519.5000	50700	254759	122396	327386	206002	60577	337404	291565	93527	84326	321666	420639	178105	117782	119144	54754	138248	235119	246157	134212	313793	68389	320506	503349.5000	89742	634324	140042	271494	296951	310262	83681	84031	126302	108214	196869	132603	87389	127255	322566	196350	418846	343982	249132	258777	216234
cysteine	Cysteine	25673	18255	14863	16226	14583	14917	19126	30029	44628	23368	23011	47623.5000	23298	23446	13594	14136	14397	13433	12077	21051	33005	44035	43785	18427	51862	37800	18213	13291	10455	8664	16444	19445	12951	20804	16028	19875	14043	22708	19198	26902	22000	22205	25937	14097	14178	18166	13839	19005	103614	16155	19636	22381	34803	18790	25395	17392	20106
cysteine-glycine	Cys-Gly	1304	1230	1442	1630	696	1017	1401	1085	993	978	1043	979.5000	994	1159	855	793	186	1447	698	792	938	1144	559	944	1484	805	1068	803	356	846	883	1058	779	1566	443	915.5000	863	1160	933	308	1244	1189	1267	1554	795	1312	710	1185	1006	986	807.5000	798	1734	956	1746	1158	1349
cystine	Cystine	26959	18876	14768	21241	20189	23721	17015	31612	32344	19552	19900	17085.5000	24960	36392	10270	7772	10796	21691	8406	14277	34790	28051	45487	18578	43146	38088	15862	21107	5054	14165	10772	15710	6679	7704	8232	14606	12029	21391	12051	14146	14028	20319	15342	14290	18593	19460	14012	23356	60637	13877	13404	23003	37843	22816	16078	15919	18851
dihydroxyacetone	Dihydroxyacetone	1074	8571	542	1198	301	1777	1852	9564	1111	248	1459	532.5000	296	1078	377	657	441	1162	704	711	334	764	2161	1411	1109	38	860	550	231	538	460	636	1737	670	4329	919	1289	1132	787	1034	1042	1017	2640	5170	282	2375	491	918	1471	1162	672	651	649	707	1984	1233	2277
dodecanol	Dodecanol	830	854	738	807	928	776	807	1037	682	408	607	481	398	854	568	378	703	782	340	496	343	603	1455	680	629	381	372	801	313	374	697	212	827	347	408	648.5000	823	567	658	883	566	528	1177	544	412	902	421	714	704	565	787	642	770	823	649	979	1177
enolpyruvate NIST	Phosphoenolpyruvic acid	1044	906	558	874	965	532	947	671	658	420	602	448	333	619	214	461	423	796	401	622	351	296	1252	747	807	281	796	816	219	355	335	523	1004	970	256	642.5000	871	889	908	846	602	464	1650	739	285	1165	496	1102	841	1523	474	470	501	475	988	864	1289
ethanolamine	Ethanolamine	288083	491120	352025	424635	272068	335608	400673	523240	216327	231268	187156	342471.5000	129907	359801	171513	290043	215215	215762	288352	412942	169299	213526	615964	516402	510683	203512	235019	318151	133238	269397	284746	219117	584028	191054	395679	502950	287930	665601	286212	390008	412326	506879	403284	207409	153553	414491	227937	369772	381416	324822	353403.5000	248321	344058	369507	274673	364892	291877
fructose	Fructose	289	445	350	428	445	361	802	558	575	221	227	196	128	346	110	256	132	196	183	526	175	230	526	426	311	317	206	313	151	166	277	369	324	254	309	266.5000	706	272	370	235	436	497	309	323	108	373	196	456	453	382	269.5000	419	278	358	575	603	315
fructose-6-phosphate	Fructose 6-phosphate	1159	1684	1559	1194	1441	1084	2298	3034	1810	669	1089	1064	668	1307	567	1500	844	1350	842	1743	672	580	2816	1324	1666	1672	1097	2123	573	652	1485	1829	2461	1740	2700	1339.5000	1839	2741	1928	1967	2188	2573	1844	1140	634	2249	658	2235	2853	1518	1484.5000	1702	1469	2452	2238	2543	3571
fumaric acid	Fumaric acid	2883	2590	3772	3530	3935	2620	2837	4526	3962	2386	1879	2495	1991	3922	2360	1477	2106	3662	1747	2871	1776	1995	4189	2036	3398	1586	2066	2703	1876	1481	2807	3045	1871	2829	1569	2211	3557	3390	1812	3514	2597	2852	3723	3310	1650	3143	1956	2787	2599	2971	3114.5000	4203	2936	3316	3322	2211	3139
galactinol	Galactinol	464	521	468	689	412	866	1032	891	488	191	251	308.5000	176	450	258	261	234	548	125	568	258	184	932	605	379	301	400	706	177	346	364	778	577	108	206	382	621	579	156	654	300	455	820	621	267	884	328	1006	371	1244	569	424	494	584	809	685	645
gluconic acid	Gluconic acid	755	556	209	619	537	244	696	657	500	289	513	337.5000	214	279	178	188	218	591	152	354	188	149	450	350	221	192	352	401	117	178	186	308	372	423	213	191.5000	408	468	323	324	300	410	304	224	211	615	118	456	426	625	318.5000	304	298	599	763	515	539
glucose-1-phosphate	Glucose 1-phosphate	4603	2816	1588	4523	4368	2842	4386	3253	4529	1067	1970	1073	1205	3012	855	1933	1847	2347	1154	2790	1258	1479	6056	3714	1468	1514	2082	4468	886	1314	2542	2460	4823	1935	1765	2537	3378	3802	2359	5451	2357	3450	4637	2431	981	5801	1446	4454	3060	5025	2464	3427	900	4846	3658	4400	5082
glucose 2	Glucose	81101	85385	82706	105766	58679	111053	137250	216053	85933	43740	74292	49711.5000	38207	43002	40566	28890	47576	41788	24615	85771	42602	22261	53866	98932	74267	57727	64289	82310	33128	45068	71000	87335	46241	52776	143243	66816.5000	86672	116784	70568	114723	109139	122652	21573	95974	33864	97119	49794	70070	38479	54676	72165.5000	68730	75420	79142	79337	91057	65222
glucose-6-phosphate	Glucose 6-phosphate	1308	2435	2786	2726	2346	3032	4408	4077	2473	936	1486	1298	853	1925	924	2072	1581	2241	1538	3165	1178	1900	3992	4516	2709	1749	1689	3088	941	1466	2716	3167	2714	2375	3730	2350.5000	2500	4958	2509	3890	3527	3355	3215	1958	891	4134	1425	2472	3722	3095	2476	1984	2109	2349	3838	4549	4318
glutamic acid	Glutamic acid	684463	1553620	857384	925992	836022	1039041	397452	1196574	882777	1247586	578887	889997	687968	1495569	884954	1188981	1282564	1412159	849843	877237	491661	578824	613600	551836	832201	830204	853770	804741	1340159	943978	1125880	1176172	809662	711390	1037142	1015238	1195058	1075695	800724	1323029	747013	966196	421907	779712	1322537	955738	1173045	626731	740081	693032	892751.5000	934335	857750	995998	671515	1237286	816190
glutamine	Glutamine	96380	138783	92894	72850	110030	131357	50914	146965	135774	123418	83644	90356	96120	104006	117224	84849	114098	92426	69306	80980	78279	44309	58608	34885	74153	53701	97810	82178	114270	100347	100792	117063	95470	106470	68949	58044.5000	80434	47658	120955	99723	75342	69550	53864	83279	117420	49040	108514	57664	109849	52347	98205	106029	120390	89114	39957	90148	86421
glutaric acid	Glutaric acid	297	198	197	230	210	364	344	373	385	274	261	331.5000	190	389	122	211	289	254	242	256	311	349	744	418	612	150	234	234	194	275	284	336	362	299	166	198	247	400	232	310	186	321	337	341	194	380	390	384	294	348	216.5000	293	325	332	276	340	320
glyceric acid	Glyceric acid	12889	9017	6569	12014	9651	8076	11166	10765	9673	7026	7008	6789.5000	4964	8272	5621	3390	4588	10229	2828	8179	3502	3696	15450	8287	5736	4018	6618	6853	3405	4745	4604	8159	11773	6683	4743	5204.5000	13855	9283	6324	6072	6778	12382	6711	5855	4179	9730	3215	8592	9691	7667	4709.5000	6349	4346	11511	7962	7136	7710
glycerol	Glycerol	52417	50824	43335	46096	49416	40530	44993	67227	43804	27385	39919	31482.5000	20733	45361	15700	22743	21049	39475	24301	40021	19359	18636	61284	57529	40712	28706	32683	43807	14125	24109	28949	30210	55135	26574	31435	29791.5000	62438	45742	31881	30287	31525	39723	40468	33094	16896	47681	15128	45843	38752	36596	31614.5000	38830	30876	49270	40776	45533	32860
glycerol-3-galactoside	Galactosylglycerol	1376	1254	897	1180	939	1207	1228	2455	1557	651	738	733	335	1032	613	545	635	1068	567	1759	719	702	1670	1460	1542	548	1019	1396	309	833	902	667	918	761	1224	1055.5000	1125	1217	1116	1503	1235	1106	1711	960	523	1746	624	1368	992	1138	952.5000	762	619	993	1396	1507	1284
glycerol-alpha-phosphate	sn-Glycero-3-phosphate	32420	18777	17436	15644	13745	16307	25316	24323	24290	6284	16585	9752.5000	4830	15096	7139	8688	8051	23537	6971	13634	5070	9738	22852	17044	13558	4405	22894	21457	4190	9621	14564	19343	16982	19936	9825	15890.5000	14647	22362	16082	24209	18357	15472	21175	16426	12746	54559	11304	26267	17507	41206	21280.5000	15443	20733	20550	30995	27348	29093
glycine	Glycine	4360016	1896561	3470787	2451451	2305965	799780	4048651	2961998	3761076	1811783	8109068	1753673	1515890	3005010	1317367	1411904	1893250	3967073	974172	2483660	2305629	1660902	6268537	3340534	3191498	1412802	3849398	2414776	1083172	1411838	1038736	1612280	7380569	3756077	2219814	2936988	2796038	1152238	3123681	973854	2284360	2709711	6787688	2758465	1289796	2649275	1045661	6337949	4827587	3709552	2900560.5000	3001848	2313403	1883912	1542876	4923117	5619129
glycolic acid	Glycolic acid	1332	1704	2436	2142	2536	1670	1068	3417	2111	1025	1077	2744.5000	848	1997	304	938	572	2211	1012	1946	895	467	2881	1400	1715	716	1189	1695	473	951	2023	723	2258	916	748	878.5000	2352	1990	974	1102	1349	1487	3430	2051	417	1702	677	2657	1862	2117	1960.5000	2942	1597	1910	1967	1727	1941
glycyl-proline	Gly-Pro	5958	2713	7609	5696	8128	12165	6608	7452	3829	5284	4444	8038.5000	7158	7773	10295	3271	2855	3185	4776	10103	5032	6556	7282	2385	8784	9007	4894	3356	4365	3908	2050	5303	2509	11809	4520	5533	3843	5125	7729	3595	4800	6547	5697	7442	3429	5431	4495	2766	21083	2627	4564.5000	2072	8082	4993	4670	6487	5292
glycyl tyrosine	Gly-Tyr	886	1590	2001	1322	1955	2316	1364	2723	1301	792	2764	1743.5000	1347	2064	1178	1431	764	1562	1464	1653	1326	1066	1061	2545	1688	1595	1947	1070	870	1060	1204	1210	2071	3053	1316	1255.5000	1303	1996	3746	759	2068	1097	2623	2276	2560	1783	1212	1334	3317	1819	1829	1513	1220	1778	1756	1605	2631
guanine	Guanine	21832	11256	10316	18440	22046	10887	21391	15588	19877	6152	12034	6795.5000	7040	9294	5065	8727	8036	13868	6035	15542	4158	5632	20592	9603	9506	7430	8976	14014	6876	6699	10673	15127	16570	13892	9480	12070.5000	24703	15951	12344	12626	13584	10460	22671	10535	6128	18257	7093	21417	26361	27446	16425	9153	11944	16147	18740	24621	21140
guanosine	Guanosine	5502	6512	5669	6422	6751	7037	7287	9171	7820	4081	4701	3598.5000	2022	7761	1469	3902	2936	6395	2325	6327	2849	2896	8893	12078	6791	4276	4160	5341	2375	2348	5101	5488	7263	4305	5161	4666.5000	6273	9190	4743	5584	5757	8017	6979	5914	3016	6846	2833	6704	7329	5662	4731.5000	5993	4987	5474	4853	7237	6901
heptadecanoic acid	Margaric acid	2100	2008	2464	1345	2350	2051	1949	1584	3734	701	3127	1941	1181	2168	917	1270	1031	2484	1277	3751	1555	1686	4081	3730	1354	1783	951	2305	1073	977	2018	2033	4044	1740	1882	1408	2161	3949	1736	2012	2194	2783	3460	992	932	2124	852	1993	2924	2803	2034.5000	2593	2392	2996	3198	2988	2740
hexadecane	Hexadecane	29324	22251	70779	26188	32006	43599	25596	40943	29333	17863	49648	17226	19167	20849	12158	20058	22357	21150	13662	23967	42534	12603	50200	19771	68714	18390	22044	27566	12699	12694	85680	25057	29198	20799	11813	18015.5000	28981	74076	30282	105781	22504	82403	49569	14880	20023	29622	21279	40869	15754	60216	18746.5000	76638	15044	32459	40808	32293	37353
hexitol	Sorbitol	265	1875	1017	905	8902	4638	681	1354	3005	1106	2946	3678	780	2457	574	1685	1563	2664	836	18592	1869	1919	8017	974	3267	2718	1705	773	103	1518	3295	9312	4707	2186	968	2688	730	3417	4151	2372	2641	1127	978	1160	1155	2675	463	2059	3594	8789	1905.5000	6285	2266	1633	1242	5150	3542
hexose-6-phosphate	Hexose 6-phosphate	984	1227	1316	1385	1396	1341	2153	1983	1280	478	757	893.5000	406	1003	456	1040	792	1177	791	1588	544	799	1940	2136	1182	839	938	1522	457	558	1091	1455	1474	1016	1674	1167	1515	2486	1299	1804	1528	1562	1908	958	527	1911	693	1762	1508	1690	1331	1176	1008	1254	2151	2328	2378
hexuronic acid	Hexuronic acid	1692	673	744	1189	838	549	744	1505	704	456	832	32471	414	899	1152	505	884	1034	459	969	457	907	1755	1006	574	510	791	1221	335	694	963	747	463	1186	760	846.5000	1467	1066	878	1071	1079	836	1545	843	489	988	669	1202	863	1363	739	788	395	817	1310	1009	1007
histidine	Histidine	216117	321414	190480	257399	159710	214247	270953	257529	229252	293906	121870	197117	334194	265128	274618	301269	265112	138516	271610	255228	269967	291499	141975	264305	201072	277460	160356	90577	332207	102548	327473	233210	90630	258694	244286	228999.5000	147574	271678	209516	157122	303430	449785	256676	240982	120472	168039	290913	175593	592629	153937	195186	163088	455749	244376	209651	183348	178504
homocystine	DL-Homocystine	750	938	512	1247	1492	2114	1408	1209	1330	592	1447	1029	618	1685	620	982	809	1609	1039	1233	617	919	2096	2357	1165	712	1570	1277	675	841	1382	1022	875	690	934	1048	1910	2670	1219	1433	1060	1462	1841	1361	936	3700	690	1091	1360	3606	1271.5000	1121	967	1409	1199	1513	5626
homoserine	Homoserine	1025	948	527	999	945	465	1137	1255	891	457	1057	711	331	1829	490	623	443	796	521	4204	748	720	2869	1479	927	611	908	746	396	555	1127	552	1348	759	992	920	1107	1039	685	1322	924	1407	1576	502	120	1279	463	1172	992	943	1007.5000	875	1045	1281	1146	412	1413
hydroxycarbamate NIST	Hydroxycarbamic acid	9725	19199	16556	19681	25174	20282	16074	14777	27121	7986	10662	12269.5000	7324	31299	7369	7553	10750	21840	6758	12999	5564	14457	37785	16487	13222	11810	8681	17309	5687	6382	12288	14282	23110	7764	7613	15843.5000	19291	19636	8989	17394	10147	21811	29117	12404	5703	23930	8120	23806	19764	19434	9923	14866	17528	35288	14505	26487	31077
hydroxylamine	Hydroxylamine	161520	170130	163206	196104	240414	149272	176579	198714	212340	65639	100861	90013	74707	190313	63542	77561	94641	150093	64992	154818	80992	92507	377411	165930	121382	78525	101422	152915	40207	73043	89366	130423	287959	122010	59275	143174.5000	166910	169109	125335	119453	111336	195798	327093	89587	76612	219653	82941	237936	182126	157537	134570	179024	135008	193171	155420	296970	234600
hypoxanthine	Hypoxanthine	43997	23579	23643	36855	45625	29752	39361	39180	36004	13030	22896	14843	12676	23665	11338	11684	15669	40865	9379	27680	7675	8187	44658	18820	17350	13267	15636	24845	10391	10019	19587	24817	33671	20820	19714	23659	40482	24964	17048	25637	19700	19472	43683	21145	8762	30252	9476	32500	43622	40990	32060	15526	20641	23993	29578	34528	28922
inosine	Inosine	65372	61161	47819	61386	62645	61977	87138	77383	64091	29106	45617	29637.5000	18190	63519	15493	33747	27922	45463	20906	45715	23830	18271	150480	95828	65071	32635	34608	49164	15447	23714	41990	42053	79194	33981	85146	42936	63271	80461	41504	60241	67108	68370	77496	46668	24416	66516	25518	48792	56317	42384	34859	38396	40943	33741	33881	80610	53134
inositol-4-monophosphate	Inositol 4-phosphate	374	400	472	515	401	476	476	568	344	233	194	215.5000	194	342	142	311	160	498	333	531	222	294	967	438	361	172	404	582	128	215	404	448	415	424	324	533	402	458	388	622	440	523	401	627	197	1067	283	522	411	740	424	466	483	412	678	620	726
isoleucine	Isoleucine	187836	390742	499895	227938	294573	348398	294991	303249	368243	1394746	222273	1336782.5000	1566247	1313085	2205394	1112373	1370771	428776	1599309	516096	2504604	1949849	240308	471550	848620	1511788	488412	628767	2165944	1812164	681901	753787	148977	674852	352539	794949	236059	231409	289791	594066	316984	389545	315887	767416	1455113	540957	1518236	209926	257559	219853	602433.5000	323162	1006335	648514	315638	304249	199580
isomaltose	Isomaltose	2174	2135	1925	2160	1838	4186	5258	5765	2419	932	1371	1356.5000	990	1059	1304	677	1157	1071	437	3308	2023	368	2137	2988	3062	1576	2331	2576	693	1602	1469	3600	784	1590	2179	1370.5000	2001	2111	1493	2843	1923	2296	1185	4559	877	4300	1440	1809	937	1993	1793	1069	1839	1412	1431	3118	1399
isothreonic acid	D-Threonic acid	1646	1336	1045	1483	1198	1122	1161	1595	1516	931	1345	1125	801	1354	594	833	930	1350	954	1326	745	958	2037	1442	1363	984	1489	1302	532	692	1235	1290	958	1215	1111	1106.5000	1653	1858	968	1741	1522	1086	1249	921	576	1635	919	2425	2512	1871	1410.5000	1152	963	1525	1546	1313	2108
isoxanthopterin	Isoxanthopterin	657	552	512	695	570	675	707	686	859	471	429	367	267	540	283	283	397	352	396	543	292	360	735	1064	545	326	279	867	197	430	343	695	607	631	448	360	577	581	681	615	706	710	861	451	234	674	303	1411	704	912	629.5000	731	585	565	766	515	733
lactic acid	Lactic acid	5721	7470	8017	7357	6907	9119	10725	9146	8190	3031	8612	7169.5000	3778	6661	2816	4191	3749	9138	2918	7311	3266	5192	14650	6084	5221	7594	8672	11244	2399	4406	6191	5702	20902	18994	5156	6538	31566	34748	8446	8149	9533	10993	10503	10361	2498	14943	3459	11371	7801	14607	6520	8261	7876	8868	12197	15995	12059
lactitol	Lactitol	526	659	856	563	506	792	722	1886	792	505	233	332.5000	511	531	124	392	473	344	401	707	503	493	741	1251	747	335	475	335	19	100	407	883	405	444	528	279.5000	548	1514	920	868	619	676	432	173	321	664	573	465	513	588	899.5000	945	1162	1225	797	496	561
lactose	Lactose	747	3688	1460	677	362	240	1406	892	714	407	972	588.5000	345	595	163	550	473	769	416	521	685	177	1105	495	391	1263	540	1212	620	301	1348	571	716	470	406	3778	521	3882	951	504	595	1168	730	858	229	617	773	859	429	800	1123.5000	3414	1016	436	657	1049	888
lauric acid	Lauric acid	2229	1373	2105	2533	1229	2094	2142	859	2164	746	1635	786.5000	886	1540	631	1484	866	2191	854	1729	1437	1667	4004	1380	826	1255	1768	2077	356	737	1109	1853	2706	1676	1167	1810	1700	2442	2049	3461	1191	1199	2135	1241	643	2538	1452	2698	1969	1716	1191.5000	1766	1793	2649	731	2271	2583
leucine	Leucine	638423	1057918	1227457	930644	1049106	993175	1273180	808919	836748	2278979	737293	2086959	2493900	2728607	3349029	1740598	2484437	1078984	2589487	1222670	3971343	3001748	790425	1092162	1883787	2504389	1093717	1380808	2417201	2651398	1433990	1718653	396785	1772215	942389	1509733	903737	818895	999480	1383321	905276	1011437	1068159	1632750	2394243	1313743	2497509	765333	1035507	703361	1276017	630767	1659824	1086492	838278	939071	708390
lysine	Lysine	463690	655248	863841	837633	772268	747273	1278964	429339	228142	642854	332338	983068.5000	377781	1082398	1055592	571626	622767	892058	1332916	647079	422126	690479	244947	603188	504065	7008	692500	944528	1724952	1860766	603754	997378	302890	1472821	495612	642198.5000	928042	687260	1157792	410235	659735	744957	966687	1074457	2300396	774351	1120003	436769	23626	577727	584057	347748	382126	585110	771188	832003	621423
maleic acid	Maleic acid	5636	3594	6037	6701	8427	7143	2546	3119	7511	3008	3190	5291.5000	6653	7136	4291	3076	3809	7532	2399	4760	2692	1835	7318	3143	2941	4069	3155	3075	6595	3022	4698	5909	5736	3041	3020	3080	9591	5483	3689	6672	3262	7454	3764	4939	3925	4968	2602	4234	5017	5298	4340.5000	8332	4199	5875	3883	3778	7185
maleimide	Maleimide	27770	24352	22942	26352	20725	13777	41353	28103	16993	14450	21306	12564.5000	11629	12638	15352	9656	13354	17658	11974	22523	12372	20336	21191	14488	29547	14937	14316	21293	10951	8398	16455	32593	7370	36659	15417	18893.5000	21621	17121	20097	18395	22325	21016	28941	21809	13475	29820	11597	24481	32973	16609	15352.5000	18251	14850	13014	26508	30061	16729
malic acid	Malic acid	22634	30124	19595	23104	13317	24255	22067	36490	14836	18446	20994	17289.5000	17436	15336	19179	17345	16718	24178	14453	21491	14889	16861	16505	14139	17140	17113	29410	26203	12292	15374	18262	26113	22496	25516	17797	25100	34677	25706	17337	19899	27840	21203	17153	15179	13934	40992	13028	19674	21145	28770	22435.5000	15933	20107	22634	26065	27712	23014
maltose 1	Maltose	125547	245944	253514	105947	98378	179973	215934	326090	81014	79891	148540	83399	86653	70726	79198	102826	190344	57667	184334	124415	91911	172976	105248	430063	141042	132481	106998	311005	148450	109410	218915	209979	65636	56458	208569	172779	174006	445458	247843	185384	186386	222992	40948	255629	99982	128235	233194	123248	43549	59963	180608.5000	318201	168889	275329	203532	104806	113696
maltotriitol		237	197	586	263	383	469	867	671	299	51	355	235.5000	169	238	158	158	288	186	127	357	274	163	426	543	401	136	387	568	151	238	318	400	306	239	417	269	296	662	403	398	259	449	304	307	121	282	331	486	94	281	364.5000	531	312	345	498	145	408
maltotriose	Maltotriose	16477	62045	71236	21636	14945	23186	34518	61892	19488	18297	18322	19957.5000	16322	11820	12512	23197	54012	12471	58635	23803	17546	28405	18660	51194	29287	22760	18518	48048	46326	21182	52767	38288	15510	7333	42377	43114	25089	119375	35534	52204	35611	38192	8820	37205	10279	19465	35480	28115	6447	11623	49312	116273	34089	76085	48668	15428	26759
mannose	Mannose	1829	2340	467	2678	817	2072	4613	10984	2543	1307	2224	1441	2141	1973	1420	1460	1333	868	734	3107	2247	1236	1070	3506	2300	2067	1141	2860	524	2997	1757	1955	3070	1598	2332	2294.5000	2736	3273	3807	2057	2704	4036	2066	1149	556	1511	2057	2664	2065	1649	1308	738	2036	2271	2544	2778	2010
melezitose	Melezitose	386	642	404	444	422	283	205	373	283	177	160	205	94	208	129	116	497	163	404	316	219	261	497	439	274	174	94	528	335	164	668	358	453	129	347	421.5000	405	225	347	547	249	341	273	269	144	368	323	407	154	223	329.5000	860	259	681	295	242	327
methanolphosphate	Methanolphosphate	94083	104500	94290	131766	133547	63099	108920	113692	85175	47826	78906	82022	36918	89028	28343	39575	32769	58311	38059	75230	32033	31277	183834	48727	53109	53132	32423	76758	30076	32919	46512	57114	113520	47424	60616	68922.5000	158572	94180	68577	54859	46393	104514	97136	44739	15510	39266	24728	159499	93415	55184	64041.5000	93779	56272	140865	129279	87792	80358
methionine	Methionine	523105	1532723	1184084	1961967	243617	984867	687113	1684999	1464496	1771694	1423309	2123326	1468975	2063413	1943101	3197660	2161042	1783850	3059502	2309754	1501581	2515146	2924741	4263585	2434192	2270864	2759281	1717742	2251018	2304779	3150657	2135496	1141444	1967910	3232773	3201473.5000	2701440	3735253	2587074	3808219	2240502	4136795	1109357	1315537	1739581	896563	2606962	892174	3516709	641362	1967764	2235267	2595118	3035469	2801770	834401	426684
methionine sulfoxide	Methionine sulfoxide	331745	69525	137622	125738	127813	257203	146782	486480	359630	165508	195701	244851.5000	186321	238195	153508	156671	168370	168010	209788	263473	241158	221029	482118	218110	359167	176085	173530	182500	96386	154187	197336	218838	134473	216434	141056	217428.5000	208690	211204	226370	281312	190501	120332	210899	98388	145233	228255	200659	235483	661552	210229	183932.5000	155224	169155	221328	237743	202205	191296
methyl O-D-galactopyranoside	Methyl beta-D-galactoside	3053	1515	2005	1632	2295	1625	2341	2310	1436	1398	1765	1489	1053	1597	504	976	1220	2273	814	1399	1338	1024	2972	1697	1926	763	1570	2140	687	767	1561	2067	1272	1939	1005	1828.5000	1715	1846	2012	1842	1842	1729	2395	2589	752	1682	1340	2681	1663	2659	1826	3152	1780	1806	2076	1515	3110
myo-inositol	Myo-inositol	68912	68417	40539	65592	59757	63268	85454	56875	49556	21236	37780	31424	15648	42449	15763	21327	26232	41206	13676	52794	13896	23669	94491	45899	40750	21614	35464	43472	14277	18985	37249	53255	80016	45202	34538	48849.5000	77673	53442	47915	48871	53987	47354	78941	35929	22980	87719	19087	85993	63292	78399	49342	33987	32236	49812	65420	67433	90042
myristic acid	Myristic acid	1283	930	772	1168	1428	1076	1236	1260	1314	523	1027	702.5000	521	1268	421	644	752	1271	538	1338	453	740	2428	1486	967	543	753	1175	314	421	1029	988	2142	1039	848	890.5000	1276	1643	1297	1272	1190	1075	1956	703	618	1178	548	1924	1152	1569	923.5000	802	951	1401	1117	1629	1490
N-acetylaspartic acid	N-Acetylaspartic acid	199	274	672	1002	1354	1150	1476	2040	945	755	1150	1352.5000	994	3811	1164	2002	1828	1531	1836	2402	1471	2144	2011	2027	2111	409	480	2943	1197	2155	2551	720	946	2970	1611	2146	1643	2878	1056	3809	2100	2406	2518	2796	1944	3028	152	1837	1038	2544	689	184	2584	514	1412	1908	1962
N-acetyl-D-galactosamine	N-Acetyl-D-galactosamine	1154	1830	472	562	939	1548	968	353	1534	236	2611	275.5000	312	674	391	236	73	290	180	410	1250	288	5098	483	482	244	40	3046	104	238	2405	148	592	567	136	326.5000	365	608	463	4248	351	708	605	341	192	3094	1934	420	421	5775	976.5000	549	2070	891	1073	1185	919
N-carbamoylaspartate	N-Carbamoylaspartic acid	3169	3560	1624	2881	3032	2812	5034	3839	3163	1548	2720	3394	1150	3445	1075	2149	2548	2318	1731	3523	1711	2801	5901	4149	2941	1925	3175	1644	976	2398	2446	2861	4861	6824	2153	3291	2153	3520	3887	3006	5743	3980	4855	1626	1968	5075	1790	3226	5893	3026	3356.5000	1848	1909	2991	2943	6751	6438
n-epsilon-trimethyllysine	N-6-Trimethyllysine	830	1161	891	1661	1692	1045	864	1440	857	1583	1166	1105	884	1671	1239	823	1276	1085	1208	1348	1319	1322	1047	1432	1064	350	1086	1293	1616	796	637	1786	1290	1892	606	1133	1274	1304	1323	1155	1215	1152	1338	1095	1018	1729	1358	1713	1013	3176	1206	973	831	1794	1731	1280	1351
nicotinamide	Niacinamide	2195	2375	5219	1497	5559	3802	2416	1700	1467	910	1571	2604	865	872	525	2958	2830	2236	2211	2055	487	1086	8582	1382	824	896	1327	5005	606	727	3183	3386	3412	1681	1841	3353.5000	3303	7296	1959	5381	4456	1604	2901	2049	672	2233	1845	5400	2778	3618	3537	1135	4230	4277	7504	6178	2101
nicotinic acid	Nicotinic acid	35659	22439	38683	27572	30406	56908	30202	34872	33741	19493	28441	32888	14287	45595	12750	24038	21624	32852	21691	21618	11628	8206	83398	35366	24355	12865	26281	32743	12815	19371	46078	29232	39761	22372	27519	53174.5000	31071	42558	27034	47460	29545	23705	32544	21011	6342	51154	20808	41954	39219	50655	42157	38323	29111	42782	37605	40505	33899
O-acetylserine	O-Acetylserine	2766	4745	5643	4661	3423	1733	4118	3231	4191	2080	3011	2174.5000	1385	3657	1709	2352	4324	3888	2682	3237	1519	2025	4924	3340	2600	1798	4608	4220	1556	2986	4040	3855	6146	3276	2462	2639	5745	2106	3634	6735	4981	3040	5638	3037	1472	4211	2382	7390	4031	7281	3654	2593	3688	4049	3348	4957	5698
oleic acid	Oleic acid	1690	1638	1430	1728	2322	1566	1857	1720	1826	741	1376	922.5000	712	1770	575	791	887	1656	665	1009	767	981	3113	1717	1249	818	1124	1307	456	733	1170	1276	2704	1196	1023	1400	1632	2053	1360	1486	1323	1634	2597	1451	699	1882	756	2306	1660	1707	1234.5000	991	1317	1827	1500	2194	2399
ornithine 3TMS	Ornithine	5605942	2359045	1945821	2629596	2209192	3137272	3386635	3387136	2130512	1496259	2415505	1592248.5000	1110791	1602465	838425	1302710	997479	2848268	1581930	1625171	843777	687330	2469964	1492928	1932122	605948	2563724	2035803	623393	1132038	1696316	1737543	2351247	2377557	1871175	1988472	2611298	2384813	3148281	2103137	1999855	1265030	2867087	2051279	1063051	3405432	1061905	2626154	2545783	3637053	2600362	1671202	1541836	2032515	3927697	2138424	2157540
orotic acid	Orotic acid	17711	25346	7879	8441	3841	1870	20456	27192	6970	6895	4519	4009.5000	4850	3253	10099	5492	4748	3505	10131	8527	4819	17844	3757	9832	11634	5564	6185	10624	3104	6962	7547	11351	1717	8548	10061	8000.5000	5504	7567	3062	4780	14814	4175	12929	8721	4538	22406	7186	15883	6564	12245	4111.5000	1604	12242	5023	12579	6651	2344
oxamic acid	Oxamic acid	3094	4366	2946	2946	2029	1903	3594	5376	3285	1806	1697	1865	1266	2248	1686	2027	1961	1543	2099	2430	1414	2537	3025	3762	3147	1447	1651	3080	1161	1791	2187	2550	2107	1550	2626	3500.5000	2211	3639	1695	2509	3467	2799	3018	2392	1707	5289	2323	4394	3322	2593	2482.5000	1810	3585	3080	2541	3688	2504
oxoproline	Oxoproline	1409032	2420595	1729142	2034326	1828825	1943500	1073088	2413441	1874916	1967872	1497954	1493912	1177726	1557640	1283601	1599555	2214820	2020593	1308358	1795229	947416	1094141	1323493	1051710	1493096	1341765	957314	1412745	1403759	1455724	2201017	2081996	1826952	1423756	1784661	1438385	1905149	1374774	1659556	2285229	1523544	1654314	1186957	1447710	1732719	1509048	2243604	1397226	1364826	1427020	1694384.5000	1790083	1974013	1714422	1523219	2488481	2159058
palatinitol	1,2,3-Butanetriol	789	546	501	539	587	667	899	527	347	268	585	272.5000	183	514	192	225	281	326	224	296	210	398	1170	708	639	279	391	380	176	144	346	345	362	331	235	747	431	513	423	457	348	449	582	426	207	706	317	641	425	468	468.5000	845	633	270	552	563	652
palmitic acid	Palmitic acid	71805	54268	48864	73848	71335	53248	63789	60242	72698	26680	54020	35936	24083	69300	20181	33881	42332	63318	34404	80181	26857	51539	119707	69715	47926	32702	45755	60365	16922	24688	59571	46733	139905	50837	52826	46747.5000	62460	102345	80277	72107	70119	57049	91720	39352	24633	67361	29127	115331	61009	105772	52262.5000	51623	43808	70648	58088	81200	82134
pantothenic acid	Pantothenic acid	2073	2240	2156	2130	1416	1327	2093	957	1656	707	1118	1883	784	1745	972	1536	1650	2025	1400	1265	747	992	2293	1389	921	914	1164	1517	980	945	1841	2740	2198	2139	2016	2093.5000	3969	1822	2345	2297	2049	2580	3412	1741	913	3257	1137	3819	3183	4226	1073.5000	1565	1187	2080	2648	2612	3156
pelargonic acid	Pelargonic acid	4472	4692	4736	6222	4322	4983	5302	4886	5614	2925	3199	2947.5000	1979	5747	2476	3002	3605	3756	2027	4969	2265	2530	11154	4476	3973	2365	3647	4689	2058	2121	5303	3650	8776	4347	3791	4892	6243	5527	6132	6994	3020	5570	9668	2616	2367	6100	2360	7141	4760	7298	4191	4884	3061	7600	5622	7577	12267
phenylalanine	Phenylalanine	250685	394290	485293	310499	291345	417306	329397	298911	338643	1369267	234089	883729.5000	1006164	699532	1754307	1335081	912687	347420	1775180	565774	1100894	1480077	288568	378778	663583	1527894	421066	413981	1504596	1005516	774038	702487	109780	531296	431634	1034047.5000	300031	243186	356602	590403	307388	426075	312539	654794	1535806	467541	1492851	252380	354090	240727	726635	408352	871480	711193	367907	338247	216401
phenylethylamine	Phenylethylamine	108529	72168	84351	75201	60263	38181	110489	102117	47866	47460	86165	37900.5000	33271	46769	35542	25347	48951	72455	34209	47048	44004	24116	123420	52952	109281	27066	72719	104012	31884	33124	72318	59875	58668	84107	41373	66446	59178	55342	44336	95006	57697	40471	92322	93316	25289	66554	75692	107939	32230	75068	85800.5000	116247	69364	71901	96989	44907	82905
phosphate	Phosphoric acid	24924	17041	15171	19725	16100	19096	18977	27105	15003	9592	11391	8900.5000	6194	11693	7018	11750	11503	13375	11638	16648	7286	9908	20001	18399	12046	6315	12453	13515	6461	8959	16429	17327	16957	15576	14481	20595.5000	20146	32091	13837	29240	21303	14177	22036	11774	9748	21875	10789	22617	11625	28191	21676.5000	16321	15896	16736	24084	22807	21161
phosphoethanolamine	Phosphoethanolamine	2659	7949	4248	4956	1770	10645	6332	8713	4816	2894	2226	3698.5000	1382	7437	5245	7590	5709	5121	12340	5272	3954	6156	9552	9826	9639	629	3649	5118	1361	6228	9984	2856	9628	3104	5899	22996	1190	20532	5985	24034	14050	8184	8174	2427	4410	11021	10789	5602	4755	15028	15102.5000	3477	22217	6035	7356	5474	12255
pipecolinic acid	Pipecolic acid	6842	1147	1578	1210	3314	1335	1446	5652	9644	7282	8150	17306.5000	26037	10972	2899	4461	1680	2029	3497	10671	45589	26960	10678	5491	20036	15660	9116	1429	1729	1064	3288	4227	3993	2609	1153	1475.5000	1413	1721	3945	9352	3786	1191	4655	1153	550	1094	2627	9971	13311	6844	2454.5000	2266	8315	4148	2556	1366	2156
piperidone	2-Piperidinone	16618	347	462	537	17853	2021	917	31431	19984	7827	16445	43856	79650	5549	611	258	963	852	160	9884	154396	15996	35362	499	33436	77276	2162	1143	182	235	458	3690	534	712	366	482.5000	382	334	836	6189	528	524	1195	328	213	798	1922	18830	186963	941	3002	1029	2274	1877	1072	889	902
proline	Proline	444067	2918921	4181499	3222889	5302894	3134886	246691	2550601	2998293	2461453	2536355	2643481	5128080	1364314	2081699	2233908	1943267	1129777	2212736	1970281	2962315	1465280	578485	855357	1850817	3699575	3253090	1804078	3866185	2794034	2532550	2554372	1427339	862761	2461080	752786	2671036	1144952	1149331	1195852	3133905	2014291	280302	2471416	2434342	432481	2154203	577754	1015384	467139	1847038	6531388	1099444	1682184	1149459	933406	1901836
propane-1_3-diol NIST	Propane-1,3-diol	1180	1813	1213	1760	1920	1144	1742	1517	1734	628	1457	867	756	1644	531	766	804	1119	583	1340	605	209	4237	1325	782	962	616	1075	277	650	915	1265	2977	1206	790	1298	1674	1675	1105	1274	1129	1521	2513	840	614	2279	655	2078	1639	1669	1291.5000	1604	1226	1559	1600	3108	2461
putrescine	Putrescine	64558	13478	25873	103785	100156	76190	121940	62620	79096	36553	13851	37035.5000	61259	44832	50418	31352	40281	55163	21113	24398	45780	29966	34507	43139	48259	21201	46321	77121	53575	91614	46558	77289	17187	63171	17605	98280.5000	170099	54247	91114	38835	8226	95165	52421	33968	30151	97544	68903	48534	41249	95065	28317	57716	77564	19688	50830	27105	61779
pyrophosphate	Pyrophosphate	38913	38637	48358	51985	54017	40851	42125	39603	47881	10933	26493	20749.5000	15907	32292	11887	19312	20295	34067	15890	32289	9539	13769	52873	26142	22887	11489	22168	33673	9035	9976	28986	31014	18318	23482	14774	26749.5000	38641	39403	28443	43436	26008	38690	45381	23097	12891	64581	14248	81011	27816	54186	39028.5000	57209	29893	45757	52400	45749	61037
pyrrole-2-carboxylic acid	Pyrrole-2-carboxylic acid	4897	11710	30835	21159	30077	24304	7907	19354	27312	16752	5774	19545	16718	16965	13871	12719	15744	20520	12936	19807	9571	5341	14388	10118	14899	9328	7626	11467	17825	8619	17970	14354	11340	3768	14466	7472.5000	33006	17067	8582	13706	9979	18137	7597	21045	10521	17005	9386	17730	7812	20134	12495	38413	15639	18170	12483	8817	16421
pyruvic acid	Pyruvic acid	1311	1902	897	1231	214	968	176	1947	1175	673	598	1019.5000	369	983	1457	1198	952	1381	1110	670	118	545	1232	1514	549	165	957	2318	307	807	1358	1016	1831	2004	784	1503	1618	1517	1091	886	1308	1471	1221	1024	775	1901	482	262	615	1598	1261	965	1121	1133	2266	1740	2241
raffinose	Raffinose	799	428	671	288	325	386	449	359	165	267	790	232	165	245	178	270	259	205	631	215	236	306	367	770	397	408	581	722	441	130	456	112	518	358	556	482.5000	357	1355	1349	588	1026	486	237	431	133	277	185	492	297	269	649.5000	933	458	572	593	485	549
ribose	Ribose	11469	10034	7871	9658	9721	10215	7884	10013	15030	7789	6807	6969	7465	9884	6433	6120	4014	9493	4465	7847	5545	4598	14279	12300	8219	6709	6235	8015	5628	5830	7671	6973	12402	5137	8883	7048	9927	8946	5992	7707	6707	10420	7582	4477	6634	6751	5495	7665	9378	6627	8437	7850	7655	10263	6185	8281	6514
saccharopine	Saccharopine	683	506	502	882	978	1120	421	968	570	471	553	1203.5000	814	559	748	583	857	1072	381	763	521	423	929	618	630	301	662	374	828	317	570	861	964	569	483	744.5000	919	589	1229	461	609	824	794	581	1028	837	591	448	849	964	756.5000	1165	553	870	1258	748	1043
sarcosine	Sarcosine	55194	39616	25217	30365	63310	60285	64140	38602	25802	18514	49773	23443	29938	33401	11749	28912	17651	32640	14244	38992	28708	16124	46825	52406	33253	15005	63265	69166	10965	22276	26892	31036	83713	54411	37127	32290	44273	52923	46562	40634	52899	32102	55478	42361	17537	67479	20245	58190	30301	89083	42438	30542	27901	37877	67618	59519	83437
serine	Serine	447349	401395	326591	381967	250448	523341	665905	380806	351961	396703	260274	401392	290746	232016	430477	205417	243120	225922	199582	364987	213980	180624	780467	407817	255335	202746	162164	186596	272952	182885	244406	258285	646991	244582	374188	500816	489043	633339	360251	285148	404014	458355	822405	277975	354202	681752	189997	482277	646051	416383	284573	218032	463868	357687	339025	520722	664247
shikimic acid	Shikimic acid	10590	6227	13895	11898	8179	8474	14439	10269	9306	3889	11713	5152.5000	3806	5035	4104	3864	3992	5296	4161	6876	2515	3571	6347	3608	7579	2306	4963	5055	1614	3983	5538	9033	3255	6619	3119	3894.5000	3584	4795	3814	4043	2963	3490	4326	3963	1885	4626	3234	14953	11322	9426	9000	13357	9070	9824	11408	12816	7703
spermidine	Spermidine	1028	1666	1360	1127	1593	1710	1776	1908	1859	524	1618	1268	787	1663	1140	1059	477	1795	961	1616	808	726	1370	2344	1290	1061	1242	771	697	1105	1165	1515	1308	2117	852	1627	1479	2350	1698	530	1038	1506	2056	1303	1110	2364	1085	1971	1910	1133	1450.5000	1029	1213	1358	1587	1173	1721
stearic acid	Stearic acid	243384	189636	165526	282325	260093	191706	236576	204211	266670	97860	189575	130077	87565	260655	70795	122011	157731	219497	121430	270685	95120	187600	471282	243139	167507	125426	162095	222938	61241	90961	213335	162508	502194	150752	185632	173550	212965	378590	275026	261037	228235	196007	325486	143906	84769	229986	104673	422291	224752	392718	186958	189078	163260	252331	208031	308170	294391
sucrose	Sucrose	96	1073	96	131	216	22	489	224	124	52	289	75	28	366	22	102	72	263	14	182	122	42	347	35	41	83	29	210	62	23	30	100	316	79	59	136.5000	273	286	46	56	104	210	434	84	83	185	87	160	143	335	67.5000	173	141	161	312	164	134
sulfuric acid	TG 16:0_18:1_18:1	490	1685	457	328	1396	243	1127	1512	462	197	724	353	243	430	729	268	220	127	694	425	345	825	517	504	719	450	635	549	243	822	138	793	488	1240	234	339	299	1054	694	193	1190	356	850	757	659	629	307	938	292	321	315	575	931	296	1043	742	193
taurine	Taurine	5536517	2742595	2551402	3870957	5113442	3403914	6421400	1396956	4199336	1367295	2843147	2169527.5000	1699350	1226512	1397866	1032403	2526857	3239703	1264223	2371600	1896500	2888453	3023936	3856617	2594889	1819793	2982103	5840953	620269	1542620	2211196	3389318	3047334	3304011	1938337	2794869	3554453	3423226	3001824	3450120	3657386	3433353	4337398	3819752	1425446	3776257	1099703	4936835	2319098	6197762	3386142.5000	2458375	2816402	1476780	4491595	4081481	3991048
threonic acid	Threonic acid	4874	2479	2304	4472	8258	7132	3531	4501	5942	2359	3931	2711	3407	4970	1465	1327	2250	4784	1266	4695	2674	2349	8135	2706	3620	2829	4025	2700	1233	2192	1868	5241	2663	1955	2306	3150.5000	4190	4453	3669	5007	2092	4227	5036	2710	2539	5546	3246	5935	5680	5402	4174	3514	3123	4556	3338	4635	5922
threonine	Threonine	80551	165117	85237	81452	122700	249212	94708	103865	102218	578793	99539	461526.5000	396485	461412	707323	459800	533560	165265	563940	172905	803368	336945	96622	164730	366001	261960	207211	169739	687535	673279	290661	229482	77985	208891	65599	416442	116941	99096	137515	337591	150981	127944	91753	150722	394404	100976	485807	91304	204776	76971	253549.5000	97155	238986	213418	68815	97649	109246
thymine	Thymine	1461	1336	1438	953	1686	1375	1166	2365	1395	1131	687	823.5000	516	1103	445	640	882	1077	733	1462	664	940	1129	1611	1015	585	1053	1124	428	737	895	862	1014	1324	1038	663.5000	1983	1044	694	782	1680	1049	1320	1206	799	1304	471	1594	851	1649	1417	867	810	1265	1434	1002	1439
trans-4-hydroxyproline	trans-4-Hydroxyproline	400368	363936	636444	1035793	430989	3541748	529103	1138808	519959	492738	872364	842035	711723	545030	193688	690221	1411745	3535128	751447	3029693	845383	287114	631822	1440489	897627	343362	741428	900174	274721	443046	968202	449261	802472	551759	885783	678743.5000	298257	2897965	1734745	1470006	1061387	427909	406167	642587	508090	1519832	454130	313538	762015	1079279	1270322	349213	507226	1051300	602582	386197	567568
trehalose	Trehalose	31638	39908	30025	54058	20012	44998	27094	60333	17782	20110	11585	12236	22044	13855	22870	24474	22045	12016	37812	10863	23485	35478	26445	86580	37594	31582	27510	62299	11659	27096	25470	51600	8940	6756	171101	38892.5000	41791	91222	25527	30879	80401	41253	9783	52765	21117	33882	47282	26685	11389	5051	16542	43313	36363	51747	25198	33356	18094
trehalose-6-phosphate	Trehalose 6-phosphate	387	485	91	509	500	392	589	735	429	149	407	205.5000	226	297	104	220	258	298	191	464	88	253	491	442	297	247	400	461	115	137	289	239	438	277	360	259	429	337	312	259	358	232	457	291	136	373	133	752	275	784	430	467	194	388	857	462	590
tryptophan	Tryptophan	102975	191562	194471	93859	94247	157290	144231	108703	154533	463699	99964	312971	384763	323105	561962	656390	330175	150437	795954	317331	572073	616555	105325	414677	289665	638131	190023	200139	651802	521250	385137	378496	52684	213190	224869	425102.5000	88740	130789	148990	272144	152690	220283	125553	340131	559451	254004	627145	88154	122434	103688	276174.5000	162227	494240	362890	177878	163392	79267
tyrosine	Tyrosine	781923	1405306	2224259	796519	640995	869870	975400	1159184	1109961	3213504	677041	2250073	2925017	2000252	3113265	4640789	2302764	919098	3058264	1907195	2425827	4384549	547018	1536577	2194989	4695324	1258276	1471356	2198449	3188231	2994702	2209153	293159	1820669	4038931	2186140.5000	608885	652505	1055278	1770355	1494667	1395655	861157	2931328	3171000	1563928	4212168	735516	1294011	693390	2065940	1423895	2908875	2885896	1531880	1515504	526155
UDP GlcNAc	UDP-N-acetylglucosamine	7590	5952	4423	6687	7159	5274	5490	5475	5700	1332	4071	2296.5000	1482	3192	1201	2295	1969	3466	1961	2290	1091	1319	4639	3512	2782	1671	2757	2857	963	1722	2914	2518	3576	2060	3400	3527	5183	5331	3517	4816	3408	4896	2878	2452	749	4238	1577	7111	2879	5276	5425.5000	7109	3132	6217	6339	5526	4851
uracil	Uracil	12749	10413	12602	10098	8727	10877	7060	11731	11303	8253	5793	6376.5000	4643	14085	5095	5065	5583	10493	5150	7486	4128	5031	16964	10548	7611	3782	7762	9165	2889	5216	9231	5295	10169	4474	7454	11522	11786	8786	5468	11753	7418	9830	11257	7357	4554	13020	4873	11286	11818	13513	10491.5000	9795	9212	12437	9154	9050	9045
urea	Urea	534059	352355	267207	484997	332247	209151	349395	407582	295219	174848	189191	177406.5000	119307	207321	112289	118344	84348	402705	134645	207618	82125	109138	496527	259545	185896	102985	218646	247052	36272	54445	174116	178130	343489	176377	215088	295863.5000	103421	200334	264874	259428	167011	172402	385280	245436	112657	531539	119464	387381	307059	386667	207601	192956	204065	265171	292452	376987	303658
uric acid	Uric acid	54000	29642	33018	44019	61116	29646	48089	40210	49291	21314	38943	21993.5000	23618	31135	17733	29005	28081	37089	32003	35306	19485	21407	40354	23813	31651	25143	28053	38610	28655	27905	32964	41818	35538	28977	22030	34474.5000	45695	38269	33567	38117	38551	30485	36502	35530	23373	65761	24308	39980	51331	60668	42920	25590	27557	44898	59068	44835	41475
uridine	Uridine	23719	20505	13864	18765	17380	12659	19942	19549	16812	4364	11323	5266	2680	9510	2883	7428	5296	9732	4402	7451	3397	8333	19854	16504	6061	6450	8637	12605	3133	4112	8550	10397	10144	9741	9880	10479.5000	11258	17487	10043	21410	11923	12198	13486	9245	3810	14034	5125	22842	14723	14572	13218	18205	9472	12697	12141	22072	13143
valine	Valine	402023	714056	665716	441027	572426	570272	583551	569286	610003	1229436	490665	1168080	1547767	1071591	1731326	1049047	1253323	716095	1203622	668182	1606209	1312550	449393	702447	938727	1163189	772987	910208	1618455	1313424	804791	957659	336116	955982	618962	727777.5000	480688	507848	599703	714641	712318	696872	677618	926920	1328212	811611	1238041	511170	633018	443247	689954.5000	470538	1202315	771519	760040	542756	467185
xanthine	Xanthine	21511	12770	11268	17271	16458	11132	21983	20476	19125	6923	9646	8839	6375	13043	6560	6635	7712	15773	6073	12732	6190	5884	20386	11941	10170	9762	7017	11322	4978	5966	8151	11402	14886	12566	10469	10639	12613	14575	8607	11440	13819	10838	16157	8816	5833	13254	6915	14529	16209	18645	11893.5000	6218	10668	9594	10590	15577	10229
xanthosine	Xanthosine	209	282	180	479	280	223	290	269	296	127	240	61	85	205	76	120	71	153	76	191	154	139	632	388	139	135	156	240	70	122	112	142	448	178	103	208.5000	270	504	160	125	189	285	368	349	146	202	92	371	222	207	165	205	228	217	191	349	391
xanthurenic acid	Xanthurenic acid	1549	1806	943	831	722	467	1617	1414	878	512	568	1013.5000	395	830	370	644	1051	689	1104	545	323	756	2408	7952	1056	315	606	703	211	495	980	1073	3864	929	741	1103.5000	795	5653	936	798	1101	1790	947	651	519	3064	701	1153	749	976	592.5000	538	945	565	1054	1437	654
xylitol	Xylitol	1180	1862	1316	3711	1715	1251	1606	1627	1236	438	1430	1497.5000	638	1102	415	1021	592	1333	600	954	1526	553	1893	1854	1583	619	1198	1178	446	3105	1059	1828	1393	2657	769	1151	1966	1757	1306	1735	2222	1256	1680	5542	555	1517	1327	1455	1744	2849	1199.5000	1736	755	1501	2098	1198	2645