Metabolite_name	RefMet_name	Hughes_Schuler_20200818_7200_20to1_Yeast_6A	Hughes_Schuler_20200818_7200_20to1_Yeast_6B	Hughes_Schuler_20200818_7200_20to1_Yeast_6C	Hughes_Schuler_20200818_7200_20to1_Yeast_6D	Hughes_Schuler_20200818_7200_20to1_Yeast_2A	Hughes_Schuler_20200818_7200_20to1_Yeast_2B	Hughes_Schuler_20200818_7200_20to1_Yeast_2C	Hughes_Schuler_20200818_7200_20to1_Yeast_2D	Hughes_Schuler_20200818_7200_20to1_Yeast_4D	Hughes_Schuler_20200818_7200_20to1_Yeast_8A	Hughes_Schuler_20200818_7200_20to1_Yeast_8B	Hughes_Schuler_20200818_7200_20to1_Yeast_8C	Hughes_Schuler_20200818_7200_20to1_Yeast_8D	Hughes_Schuler_20200818_7200_20to1_Yeast_4A	Hughes_Schuler_20200818_7200_20to1_Yeast_4B	Hughes_Schuler_20200818_7200_20to1_Yeast_4C	Hughes_Schuler_20200818_7200_20to1_Yeast_QC1	Hughes_Schuler_20200818_7200_20to1_Yeast_QC2	Hughes_Schuler_20200818_7200_20to1_Yeast_QC3	Hughes_Schuler_20200818_7200_20to1_Yeast_QC4	Hughes_Schuler_20200818_7200_20to1_Yeast_PB1	Hughes_Schuler_20200818_7200_20to1_Yeast_PB2	Hughes_Schuler_20200818_7200_20to1_Yeast_PB3	Hughes_Schuler_20200818_7200_20to1_Yeast_PB4	Hughes_Schuler_20200818_7200_20to1_Yeast_7A	Hughes_Schuler_20200818_7200_20to1_Yeast_7B	Hughes_Schuler_20200818_7200_20to1_Yeast_7C	Hughes_Schuler_20200818_7200_20to1_Yeast_7D	Hughes_Schuler_20200818_7200_20to1_Yeast_3A	Hughes_Schuler_20200818_7200_20to1_Yeast_3B	Hughes_Schuler_20200818_7200_20to1_Yeast_3C	Hughes_Schuler_20200818_7200_20to1_Yeast_3D	Hughes_Schuler_20200818_7200_20to1_Yeast_5A	Hughes_Schuler_20200818_7200_20to1_Yeast_5B	Hughes_Schuler_20200818_7200_20to1_Yeast_5C	Hughes_Schuler_20200818_7200_20to1_Yeast_5D	Hughes_Schuler_20200818_7200_20to1_Yeast_1A	Hughes_Schuler_20200818_7200_20to1_Yeast_1B	Hughes_Schuler_20200818_7200_20to1_Yeast_1C	Hughes_Schuler_20200818_7200_20to1_Yeast_1D
Factors	-	Genotype:gem1 knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:gem1 knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:gem1 knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:gem1 knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:gem1 knockout | Media:SD+Leucine | Treatment:DMSO	Genotype:gem1 knockout | Media:SD+Leucine | Treatment:DMSO	Genotype:gem1 knockout | Media:SD+Leucine | Treatment:DMSO	Genotype:gem1 knockout | Media:SD+Leucine | Treatment:DMSO	Genotype:gem1 vps27 double knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:gem1 vps27 double knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:gem1 vps27 double knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:gem1 vps27 double knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:gem1 vps27 double knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:gem1 vps27 double knockout | Media:SD+Leucine | Treatment:DMSO	Genotype:gem1 vps27 double knockout | Media:SD+Leucine | Treatment:DMSO	Genotype:gem1 vps27 double knockout | Media:SD+Leucine | Treatment:DMSO	Genotype:Pooled QC sample | Media:N/A | Treatment:N/A	Genotype:Pooled QC sample | Media:N/A | Treatment:N/A	Genotype:Pooled QC sample | Media:N/A | Treatment:N/A	Genotype:Pooled QC sample | Media:N/A | Treatment:N/A	Genotype:Process blank | Media:N/A | Treatment:N/A	Genotype:Process blank | Media:N/A | Treatment:N/A	Genotype:Process blank | Media:N/A | Treatment:N/A	Genotype:Process blank | Media:N/A | Treatment:N/A	Genotype:vps27 knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:vps27 knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:vps27 knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:vps27 knockout | Media:SD+Leucine | Treatment:ConcA	Genotype:vps27 knockout | Media:SD+Leucine | Treatment:DMSO	Genotype:vps27 knockout | Media:SD+Leucine | Treatment:DMSO	Genotype:vps27 knockout | Media:SD+Leucine | Treatment:DMSO	Genotype:vps27 knockout | Media:SD+Leucine | Treatment:DMSO	Genotype:wild-type | Media:SD+Leucine | Treatment:ConcA	Genotype:wild-type | Media:SD+Leucine | Treatment:ConcA	Genotype:wild-type | Media:SD+Leucine | Treatment:ConcA	Genotype:wild-type | Media:SD+Leucine | Treatment:ConcA	Genotype:wild-type | Media:SD+Leucine | Treatment:DMSO	Genotype:wild-type | Media:SD+Leucine | Treatment:DMSO	Genotype:wild-type | Media:SD+Leucine | Treatment:DMSO	Genotype:wild-type | Media:SD+Leucine | Treatment:DMSO
1-Palmitoylglycerol	MG 16:0/0:0/0:0	18286	14116	20582	11260	22345	26029	17557	60850	16539	20963	15968	19470	48697	14698	13354	21949	16327	11489	13097	38744	20613	6459	6969	23783	34037	16697	25276	38459	22316	21118	17260	37662	18094	13290	21824	31421	23285	30987	21385	
1-Steroylglycerol	MG 18:0/0:0/0:0	7032	5493	9942	4970	8778	10631	8609	30069	7031	8560	7063	8994	22990	5725	5315	9331	7174	5505	6211	16615	5389	2342	3149	9350	14307	6850	10867	15551	9893	9411	7637	19000	8795	4945	8670	13229	10475	13954	10475	
2^3^-Bisphosphoglycerate																																									
2-Aminoadipic acid	alpha-Aminoadipic acid															592				73				93							1003										
2-Hydroxybenzoic acid	Salicylic acid		1362	1259				2553	1706				1308	963	1231	1648	1541			1149				775	845	1571			2332		1603	1814	2393			1235	221	918		1026	
2-Hydroxybutyric acid	2-Hydroxybutyric acid		1389	2286				3503				1284	2289	3094	1872	1890	1799	721		1209	207			2257		2312			5731	718	1790	1862	774			2070	891			258	
2-Hydroxyglutaric acid	2-Hydroxyglutaric acid														13																										
2-Ketoglutarate	2-Oxoglutaric acid	5008	10396	13792	8464	13983	14005	24109	46930	24071	5888	7633	10746	10693	18308	17450	18467	9988	5576	5975	9136					10858	8742	10944	21006	27784	33340	30534	66553	6581	9478	10253	29793	15100	20831	37286	
2-Monopalmitoylglycerol	MG 0:0/16:0/0:0	908																				1322	116	452																	
2-Steroylglycerol																																									
3-Hydroxybutyrate	3-Hydroxybutyric acid			5795		3195	2039	1561			560	6874	187		4818		6848	7945			7942		3780	6759		4146	3036	4151	18325	4736	8333	6607		85				2762	3364		88
3-Phosphoglyceric acid	3-Phosphoglyceric acid	511	854	1832	788	1709	1726	2569	6331	2931	890	1047	1741	2174	2166	1768	2525	1881	1489	1520	2856					762	619	1034	2628	2539	2841	2539	6583	422	604	1255	2289	1858	2161	4120	
4-Hydroxyproline 1	cis-4-Hydroxyproline																																								
4-Hydroxyproline 2	cis-4-Hydroxyproline																																								
5-Hydroxytryptophan	5-Hydroxy-tryptophan																																								
Adenine	Adenine					28																								620							315				
Adenosine	Adenosine	746	3264	3037	2157	1780	1782	2486	11073	4526	1331	1610	2100	4193	2375	2437	3258	2012	1317	2702	3395	232				2340	2462	3109	7789	1454	2845	2980	9146	1210	1606	3201	4229	1697	2329	3204	
Adenosine 3^-monophosphate	3'-AMP							35	120922					51													82						75565								
Adenosine 5^-monophosphate	AMP							35						51													82														
Adipic acid	Adipic acid		678	844	995	496	207	531	14569	1182	559	747	1338	10801	505	679	436	1072	787	883	6532	6135	1276	3365	36820	483	295		21032	634	1365	951	9514		311	637	12202	374	498	860	
Allantoin	Allantoin								232																							284									
Arachidic acid	Arachidic acid	1581		1681	134	4511	5671	2063		2369	2420	1171				701	1080	1672	784	1695					273		1198	1969				1288		2464	183	1176		6266	5736		
Arachidonic acid	Arachidonic acid																																								
Ascorbic acid	Vitamin C								469			220		525	460						509									182			997				271			139	
Benzoic acid	Benzoic acid	12416	25653	17117	23795	10754	22555	27216	24338	29366	19645	27185	33492	23153	15863	22386	34989	37962	21882	32934	28086	71437	21072	26956	21379	27106	28743	28750	22030	25596	32227	31000	21514	12963	22713	23990	23978	12279	24279	25181	
Beta-Alanine	beta-Alanine	172		349			137	101	402	96	453	202	220	343	250	80	219	425	346	310	785	329						286		231		103	404			347					
Beta-Amino Isobutyric acid	beta-Aminoisobutyric acid																																								
Beta-Lactate	Hydroxypropionic acid								3626												2678								874				3768								
Beta-Sitosterol	Sitosterol																																								
C20:3 A	CAR 20:3																																								
C20:3 B	CAR 20:3																																								
Campesterol	Campesterol																																								
Capric acid	Capric acid		2338		2664	2448	3939	3867	3127	3169	2526		1944	3392			2345	3869		3463	4083	12117		2147	3563	3061	2831	2482	2582	2882	2744	3206	3792	3319		1806	2849	3157	2596	2810	
Cholesterol	Cholesterol																																								
cis-Aconitic acid	cis-Aconitic acid																																								
Citric acid	Citric acid	8821	11873	17396	8580	14251	12908	16442	30110	17176	11388	13301	18894	20707	14313	12156	15922	12739	7029	7039	14689					4107	2909	5021	10237	6660	6725	7193	14031	2252	2065	4528	7304	4731	5639	6828	
Creatinine	Creatinine																																								
Cystathionine	Cystathionine	1722	4381	8945	2509	3856	3131	7294	40597	13967	9072	14395	41731	42735	14704	19272	23747	3765	3469	4510	11715	5740	405	1342	3531	12786	3549	5522	16103	5284	15530	8083	106837	3113	3736	7533	7903	2966	3556	7021	
d4-succinate		17979	25503	33898	18142	33887	29632	37768	61086	39632	31572	28173	34962	39171	33356	30514	32320	27481	14580	27976	31239	44740	9749	25052	42185	36080	18288	24296	48710	34408	33376	29198	60894	24237	21165	32737	62749	30081	35496	38491	479
Dehydroascorbic acid	Dehydroascorbic acid				1665		395	2994		2079		677		3496	2663	3007	3707		2032	2556	3879										3914				2966	5598					
D-Fructose 1	Fructose	4004	7258	11036	7117	4988	9080	9272	15933	7034	8312	7766	11687	15319	6664	7432	7850	11711	6820	6784	14880	6551	2068	6018	6340	6319	5736	8041	14941	7972	10562	7199	19507	3085	5525	7282	18140	4442	9097	6814	
D-Fructose 2	Fructose	3176	5132	9469	5252	4834	3648	4606	11223	5481	3651	4353	6690	8734	1999	4402	2519	5894	3267	2468	8179	4728	1182	5039	4448	3519	3790	4009	12022	5998	7801	5277	10912	3159	5175	7370	10377	1702	4549	2535	
D-Glucose 1	Glucose	3474910	7200973	7807880	3726399	7367384	7198325	7450948	5013248	7698885	7362229	7725716	4062341	9565559	3414993	7118319	3490073	3174052	7030869	3448689	4120084	2794800	3309158	3858333	3526291	3201846	7155175	7603148	3676640	3485661	3599998	3570561	4770885	5572850	3367129	7209178	3619073	4803836	7397500	5697794	514171
D-Glucose 2	Glucose	1206320	2757037	3295884	3478975	3041709	3098783	2903114	4744972	3144705	3193683	3503946	3705462	4429155	768671	2459474	2616613	4755054	3038308	2795827	4437086	2604004	1500187	4147496	4897642	2148947	3170625	3277563	3468706	4181771	3169756	2108615	4144861	855288	2778384	2825500	5024590	671465	3187680	963503	75680
DHAP	Dihydroxyacetone phosphate																																							267	
Diethyl Phthalate	Diethyl phthalate																																								
Disaccharide 1			2616	3516	1618	1658		2230	4340	3138	4253	4660	5629	8147	2839	2376	3345	3273			4133					5111	2531	3806	9156	3441	3261	3233	6362	2047		2753	4804		1416	2121	
Disaccharide 2			2616	3516	1618	1658		2230	4340	3138	4253	4660	5629	8147	2839	2376	3345	3273			4133					5111	2531	3806	9156	3441	3261	3233	6362	2047		2753	4804		1416	2121	
D-Malic acid	D-Malic acid	3456	3930	6845	2563	5506	4734	7191	11352	3812	3354	3474	3748	4613	3504	2723	3505	8273	4832	4689	10447					7592	5145	7456	10217	4455	3931	3915	7586	10431	7041	11266	16963	4349	7001	8194	
D-Mannose	Mannose	3474910	7200973	7807880	3723772	7367384	7198325	7450948	5591178	7698885	7362229	7725716	4315162	9565559	788535	7118319	3986566	3549244	7030869	3609793	4279524	3309584	3676177	3723308	4820124	3947431	7155175	7603148	5303779	4098408	4203225	3482106	5083855	5572850	3640354	7209178	5150273	4803836	7397500	5697794	
D-Threitol	Threitol	16675	22512	29004	14170	13702	12427	15919	31789	19282	29606	24421	34742	41534	19019	17069	20915	23598	14979	19628	32441	6256	1373	2985	4565	41864	28097	35776	64177	19398	17444	16229	36320	28089	21674	35302	62672	10946	12159	13718	45
Elaidic acid	Elaidic acid	9661	7351	9364	6248	9064	14209	12436	6511	12839	11196	11985	9991	5526	9087	7018	9533	7595	7196	9483	6622	32017	3414	2840	9881	15193	12047	14479	5734	9462	10728	9105	6561	13114	5382	9487	11110	14374	13574	14641	
Ergosterol	Ergosterol	901		3050		3059									1706		3255			111							1365					3536		2951	602	2856		2174	3536	4783	
Ethanolamine 1	Ethanolamine	148743	139219	84183	112043	180269	146741	100470	18571	98304	128461	127866	96189	25327	146563	95789	101571	220367	138499	111430	20668	293323	203670	209789	38599	104268	124182	103102	37308	201889	112058	92331	21926	120535	120770	77154	38275	146874	150042	114926	
Ethanolamine 2	Ethanolamine	170330	168686	226138	195352	209630	205287	251579	351849	238249	178479	194267	215901	368557	207701	187483	232862	252195	172879	215650	369213	311269	146157	152494	318462	184939	162700	211688	158752	185062	193243	198403	324314	159009	143947	171349	233192	184690	200208	209067	8977
Fructose-6-phosphate	Fructose 6-phosphate			575					1052																				481				456		168						
Fumaric acid	Fumaric acid	18185	20625	29780	15384	28755	30112	36112	56057	24875	21477	18022	23594	30533	19061	15278	18463	40510	23617	24474	46803	12804	3455	4524	3889	36146	27449	41390	57529	23592	21671	20799	34553	39999	29292	46510	77458	30065	36676	39802	
GABA	gamma-Aminobutyric acid	1731	2269	2662	1686	2224	2055	1961	1638	2249	2819	2561	2640	2078	2255	2483	2635	3688	2192	2189	3328	213	101			3100	2175	2894		2372	2244	2666	2330	2167	1582	2067	806	1920	2035	1791	
Galactosamine	Galactosamine																																								
Gluconic acid	Gluconic acid									81									42																						
Glucose 6-phosphate	Glucose 6-phosphate	30389	27782	59717	29702	52911	42537	61679	191340	55915	39439	39994	55306	89868	38152	30709	47816	64765	39351	41160	97310					36003	25336	45751	79338	66500	48413	48481	136792	27933	22851	31805	81164	34657	48947	69697	331
Glutamic acid	Glutamic acid																		17			1738	815	389	2554																195
Glutamine	Glutamine	6523	2803	5287	471	923	5678	5490		602	26623	8548	11334		15608	22865	18554	3441	5754	3547						60343	16104	5028		1604	11625	8386		6447	3024	3525		5893	3505	4632	
Glycerol	Glycerol	35728	210213	206380	126522	163619	97055	246392	158633	144740	94325	120171	161370	132897	272115	201943	205072	65259	33960	182769	61826	3878	862	1926	1065	256777	35438	43420	233248	254420	256851	250186	212446	100403	232555	312224	347934	159027	156902	150969	7587
Glycerol 3-phosphate	sn-Glycero-3-phosphate	543	1176	2612	1091	2018	1424	2737	6661	2630	1120	1327	2142	2392	1707	1620	2702	2652	1357	2081	3404					1699	704	1177	4751	2720	3396	3490	7524	1332	1570	2740	3971	2271	2812	5275	
Glycine	Glycine	83262	83445	119045	69848	102995	84342	107508	183249	132277	161463	132370	157261	196632	130566	102904	122526	171595	93206	85614	170761	59341	14041	28117	39660	116760	93442	117804	118548	122966	93162	88449	158710	54140	49528	67818	111948	64148	76570	92370	3427
Glycolic acid	Glycolic acid																																								
Glyoxylic acid	Glyoxylic acid	1657	1662	1099		1424	1559	1550	344	1231	1480	222	1486	137	1442		1026	2477		1025	456	3900	1572	1585		423	1051	2216		1438	1102	1435	404	1469	1020	1089		1137	1022	1231	110
Heptadecanoic acid	Margaric acid	10193	1064	5424	1713	26960	30698	4113	32865	9061	12022	4504	8	6931	2356	976	2075	2384	3620	4374	6838	1547		257	767	36760	3086	5530	10322	24162	3126	1841	27558	9983	1307	5386	8083	27725	37080	8312	
Hypotaurine	Hypotaurine																																								
Hypoxanthine	Hypoxanthine		421	1716		3017	2087	3305	7688	985	1264	1459	2442	2245	1140	1020	1508	836	1206	1005	1891					944	324	935	198	68	2051	1385	3814			134	518	3498	5472	5883	
Inosine	Inosine	1444	2124	3909	1462	4336	3203	6539	15235	9101	2124	1853	3402	4828	8468	7895	13850	2499	2369	3237	7850	50				874	548	1203	2381	7524	6529	9878	26343		602		1557	2734	4417	6129	
Inositol phosphate	Inositol phosphate	31920	20219	69656	29119	62926	53712	75190	364468	81708	54339	56858	69485	185580	35409	34156	70744	49176	38570	47395	176134		964	1225	1792	51252	47139	93310	166565	64745	60487	39269	305331	43882	33718	61787	181284	48377	69247	100593	985
Isocitric acid	Isocitric acid	2659	3041	5743	2439	4449	3806	5987	12759	6177	4545	4155	6214	9916	5089	4427	5143	5043	2696	3429	7926					2803	2071	2752	207	2919	3351	3138		968	959	2321	3262	4638	2802	5478	
L-Alanine 1	Alanine	3425891	4181920	5844648	3179325	3350784	3138859	4214784	4899517	6085053	6554714	7140325	9096158	6293865	5856372	5671003	7091194	4924040	3849874	3936956	3269150	755405	238373	510860	201256	5915611	4703956	5723315	6462517	3757911	4899591	4410566	6631630	1766307	1964198	3394736	2358157	2169315	2908480	3735546	82343
L-Alanine 2	Alanine				455								345			76		557								528		595						314		427				730	
Lanthionine	Lanthionine																																								
L-Asparagine	Asparagine	6806	5132	12249	1804	8473	9514	13628		12381	18002	7500	10535	12324	19900	20557	18934	10841	8299	5495	11352					10524	5783	3956		12008	12745	12130	37633	4380	2359	4393		8328	8507	11948	
L-Aspartic acid 1	Aspartic acid	1430541	1763351	2507991	1201928	1828540	1505942	2395392	3662560	2833746	2672197	2370004	2729734	3627092	2147943	1590755	2402278	3097812	1706557	1741890	3292018	66174	15858	55375	84281	1934511	1495069	2380434	3565252	1802480	1555633	1662525	2665244	1169968	1002208	1480636	3200697	926138	1151887	1806387	
L-Aspartic acid 2	Aspartic acid	902671	1335415	2536176	715121	1271191	974011	2406040	4318614	2816614	3745545	3008859	4254226	4560430	3237891	3139228	3147192	1819295	1283373	1186040	2519482	74203	15296	8049	81410	3099940	1352796	1754714	3980510	1620903	2042526	1782565	4244212	926043	638857	1521097	1323224	383797	800198	1306058	
Lauric Acid	Lauric acid	932	427	837	729	274	305	847		350	570	447	306	994		238	221	492	226	785	812	691	863		819	464	711	1038	571	703	355	730	284	1607	881	618	620	417	125	310	
L-Glutamic acid	Glutamic acid	3492473	2756564	4500202	1154886	2519674	2292873	3485711	1328408	3328740	6997596	4099115	4833679	1256006	6692964	5518034	5243758	4165381	3498998	1869652	833344	18616	3480			8222343	4911437	3581442	108928	3950966	4620104	4596160	3220058	3646471	1918603	3185518	60539	1925369	1993895	3524550	
Linoleic acid	Linoleic acid																																								
L-Isoleucine 1	Isoleucine	61253	177124	204795	257671	149659	176113	225819	800152	212709	115646	201526	260377	451341	130354	174375	214962	245586	140026	210884	325838	454787	164434	270719	527680	155565	120514	164573	563566	166782	253208	181493	456470	46522	156012	200761	455742	72257	159969	86831	6060
L-Isoleucine 2	Isoleucine	143314	379273	460451	416445	319632	345715	423070	1096488	379494	302850	478674	680411	794172	321700	471054	443427	436026	325161	344347	420861	1375830	390324	445749	726802	281184	279108	284575	630738	310340	541311	328449	873785	109602	327852	430262	388453	115965	288398	161569	20902
L-Kynurenine	Kynurenine																																								
L-Lactic acid	Lactic acid								48737					43476															53173				58666				45586				983
L-Leucine 1	Leucine	5366644	11159626	12099977	12800418	10130479	10587158	12290828	8805440	12309291	9513452	12565708	13890651	8512800	10599337	11667724	12558403	13323706	10248153	12252397	13484583	7538586	11560539	13498236	8009799	11502585	8776226	10297735	8494026	10339509	13379370	11874861	7765720	4038508	10294226	11976971	7156069	6733636	9816820	7734006	514391
L-Leucine 2	Leucine	10128028	10752410	10927122	11865036	10968109	11740560	10537744	7950328	11081417	11858747	4422146	11846262	3829487	10103535	11183330	11174517	6870991	7830641	10916940	11578166	6090296	6371644	7648967	7910173	10391307	11986367	11815213	6125190	9506330	10787336	10499333	6566284	8650060	10505171	10042889	8099899	8958155	10745888	10083042	1882508
L-Lysine 1	Lysine	12010	15270	21581	14266	69195	15571	21415	139532	93642	16427	15798	20356	36415	29864	9956	24223	50623	16064	17751	33395	955			1752	8285	7064	12334	160301	201976	19742	26537	95969	8488	5280	7479	122449	20027	18666	40550	
L-Lysine 2	Lysine	1267400	903331	1545090	778301	1685331	1500174	1855397	1747760	1226098	1348834	970894	1112157	1148830	2063814	1295778	1529237	2316310	1443066	1215855	1697438	9490	537			809668	524346	657083	152873	1213873	1383337	1755772	1748846	526518	323236	523429	231998	2211565	1604601	2951755	
L-Methionine 1	Methionine	7642	15438	25314	20105	24018	20943	29945	123360	40362	18572	28885	29243	69006	34824	32441	45013	25044	17036	17498	31193	45997	13836	13813	47616	13736	10320	14295	76752	19964	36654	32910	83822	6353	13225	16359	42936	19192	20797	22833	110
L-Methionine 2	Methionine	22651	50145	71559	45781	35263	47677	84549	251925	115133	83372	108200	172994	224484	177392	177637	158873	61368	37269	39828	63211	84587	24686	2630	71310	68647	33097	27406	156264	66496	142865	94873	356563	18795	35269	51341	54563	24733	43989	55901	
L-Phenylalanine 1	Phenylalanine	39549	98092	113645	113543	120275	117006	118703	189141	127085	82347	109688	113319	142351	80932	82540	106302	131072	82397	101490	150130	94452	10945	66744	133515	62111	85446	103152	146293	145542	120621	108749	136828	28394	73653	88009	204002	57830	124333	82808	240
L-Phenylalanine 2	Phenylalanine	13848	36291	57150	23904	20529	32563	62329	178074	52514	64186	75356	122597	141196	75403	90299	95811	44920	28022	34201	70793	49962	6885		35424	54548	40758	35169	72658	58222	103173	64851	190092	14897	24525	41924	22791	14255	31138	24028	
L-Proline 1	Proline	144069	300370	487866	212681	332323	295386	508225	240852	531003	532303	499743	492936	458826	532865	452420	501516	390774	230732	339251	538448					525602	295562	526244	305431	455624	430588	354875	46565	52876	100398	222187	400398	107097	220719	168638	207
L-Proline 2	Proline	339762	575429	882891	398853	617707	508250	691232	1546661	811519	1075893	874837	1191303	1154027	975345	900994	929853	614757	439314	411145	677255	180509	45219	121746	163105	778438	614332	497419	1384337	668470	736536	551595	1265969	199986	299594	457695	872228	187358	353034	293983	7651
L-Serine 1	Serine	199191	259609	424321	235261	399798	243637	385141	879283	481327	402524	331173	439603	633392	418232	279734	420487	463265	266419	295123	613538	98456	19920	104406	95037	344942	217902	341057	570233	482095	388079	409977	819441	196765	182563	266350	536895	263270	322575	464248	
L-Serine 2	Serine	230623	287406	495111	215127	253772	287039	497591	806352	502154	526880	529710	824201	780000	545936	547064	638712	531437	335554	344517	525769	167269	30635	36452	135578	464732	281495	333183	627958	563813	677029	551056	1070777	219945	215376	342596	412178	244888	347368	410117	
L-Threonine 1	Threonine	363691	380514	523994	338585	529725	424791	516126	1009478	858143	826302	677598	773125	1122547	726356	506544	700165	874630	468606	507687	1142089	116218	34682	95475	100756	661761	480212	698341	744532	738060	536146	549454	1068015	284414	266366	343208	780983	445208	483349	596270	
L-Threonine 2	Threonine	73390	78938	128914	58247	84533	77136	108446	218383	157093	191717	172120	243031	253618	175762	151215	177392	134822	91725	84812	143550	30252	6441	8742	25285	147342	103914	111983	313508	136214	149620	127891	299355	59166	53117	85675	140104	59866	80566	105801	
L-Tryptophan	Tryptophan	3125	4919	7495	3249	7286	5168	10503	46535	6990	4384	8166	23934	16705	11109	12030	17338	2592	2546	3453	7027	350			947	6164	2518	4361	1509	8980	23279	9847	57940	483	1817	4211	2508	3067	9915	13346	
L-Tyrosine 1	Tyrosine	8061	21622	26250	27804	25269	19475	23731	124593	70174	35983	36573	49874	64462	45591	24814	57328	38323	18462	24347	43103	22241	42546	60483	90044	20757	19768	27279	244102	76044	45248	49086	134445	5875	15520	19592	144038	9723	20147	17548	
L-Tyrosine 2	Tyrosine	7322	16050	19430	14681	16290	17677	21492	30392	25153	22596	24334	32393	32561	21411	26448	30467	26073	16212	18515	28025	9829			50	16491	16307	18928	10945	22820	28333	23975	37706	5716	11780	16611	11822	10692	19733	15391	
L-Valine	Valine	396427	716230	1033350	672470	817602	817115	1140431	1972998	1190807	901618	1249024	1686806	1784278	1282077	1299424	1493687	1233643	899520	1046254	1392960	732629	250682	399076	454211	1379926	1026169	1238540	2438032	1436329	2153705	1755185	3703994	524565	800535	1016256	1219380	1037327	1341502	1589890	66682
L-Valine 1	Valine	94547	167530	226252	136759	189443	188819	255386	1041822	264760	202617	224518	289220	622810	257339	190921	316691	325515	154807	250650	585480	189323	42324	125524	307118	424762	249377	335298	1214322	368069	408261	455660	1056351	117519	159659	229140	622003	316474	343872	411369	11920
Malonic acid	Malonic acid																																								
Mannitol	Mannitol	61055	150557	75188	36705	47372	55730	45178	41584	73703	112483	86516	105706	87395	109371	123632	75665	139406	87439	85510	120101	104628	83374	145075	9661	175934	172752	127036	169064	88849	84867	63972	83613	100290	95384	124450	145593	60196	48321	73892	
myo-Inositol	Myo-inositol	309062	336225	433941	273343	357471	239105	358669	584363	585370	684211	574334	770716	866223	600315	483071	599102	688743	405357	396790	617297	266768	56122	148284	198260	764330	424683	479815	1086855	703029	525960	494102	851436	272183	237915	327767	482647	257223	270792	327950	12846
Myristic acid	Myristic acid	29462	20901	28904	24890	57617	56470	25720	98846	35173	31673	28095	27456	55760	25169	14925	24227	30720	21481	23155	48243	68119		18175	41132	50981	26463	39841	61356	56098	29855	22194	92941	30358	17640	23652	50933	54775	66968	40324	
Myristic Acid d27	Myristic acid																				278																				
N-acetyl-L-aspartic acid	N-Acetylaspartic acid																98																								
Nicotinamide	Niacinamide	544						393								125												298													81
Nitrous Oxide		376001	272812	312712	289225	550243	649769	306232	662370	317790	427652	274339	287391	380610	259372	227391	272857	322150	192430	194666	244001	428076	230530	233960	265908	603791	285939	327624	331317	536989	293341	289121	418227	350223	266831	291499	375547	464435	725703	274733	14662
Nonanoic acid	Pelargonic acid	36932	25825	23362	18387	39840	38021	27215	54966	24815	34592	19036	20718	42309	33703	21521	20672	33064	20375	38013	52710	48855	16724	20215	41142	41877	25496	31208	29861	49184	43996	22775	53773	37494	28329	23111	48774	49018	37172	30646	
Oleic acid	Oleic acid	9661	7351	9364	6248	9064	14209	12436	20222	12839	11196	11985	9991	15782	9087	7018	9533	7595	7196	9483	15395	32017	3414	2840	9881	15193	12047	14479	16733	9462	10728	9105	17235	13114	5382	9487	11110	14374	13574	14641	
O-Phosphoethanolamine	Phosphoethanolamine					234	197	216	415					459	224		174																584							249	
Ornithine	Ornithine	26434	18801	41548	17954	34274	52956	79319	25238	47082	69589	41390	58842	37783	104853	92078	96359	35347	40631	38985	39748	2152				29657	16368	19883		33013	77228	79848	41950	8535	5479	11286		87423	56824	77542	211
Oxalic acid	Oxalic acid	20007	45890	30072	52568	17485	45125	54384	30153	63663	27549	55231	65585	33535	24367	46979	76821	61719	46892	64497	47208	124336	43400	65344	45926	55677	69742	67214	27967	44137	60137	65681	33898	29452	54647	50041	47248	45196	46144	47432	1284
Palmitic acid	Palmitic acid	699591	437643	1966503	426358	3278778	2846544	1554423	3328608	993525	921325	1361694	1012141	1214383	1712388	546974	802459	802542	539541	1057112	1372537	1261520	190087	217422	543159	2301214	1244636	1725874	2842198	2963357	1971333	983623	3524997	902680	659148	1794360	1732225	3539560	3069147	4365441	
Palmitoleic acid	Palmitoleic acid	37198	22145	25417	30415	30815	43070	35289	52929	33427	30453	35336	24086	44267	24884	21776	28925	23047	20345	23874	54958	122318	15015	15126	42433	36959	39054	40239	48531	27911	32915	29536	45861	43210	22039	30079	29567	42070	35680	38373	303
Pantothenic acid	Pantothenic acid										184			210															403												
Phosphate	Phosphoric acid	540556	1255378	1687165	1172350	1369297	1023666	1486015	2666654	1929281	1131110	1228959	1667061	2033920	1332505	1213435	1461856	2003463	1112730	1208965	2334886	934849	206650	680256	933578	894610	886212	1234216	2359925	1928376	1533414	1294889	2452725	520979	1077795	1618939	3071109	736708	1152038	1320684	
Phosphoenolpyruvate	Phosphoenolpyruvic acid																																								
Putrescine	Putrescine	532552	178198	544588	164822	151902	38105	53498	70743	27935	885837	431661	450180	806279	158688	31392	52855	858472	520546	408837	728172	2231	1201	678	808	2153504	1270917	1669907	878917	318535	84633	145101	89343	1119174	353281	613193	200843	270283	243260	342372	8747
Pyroglutamic acid	Pyroglutamic acid	9036022	10816980	13241842	9524331	11321874	8808074	12243082	9370197	7262124	14247434	14700518	7596372	10332917	15100528	13855377	15399021	7564903	12604975	13676566	7795729	699950	182162	341117	696661	15390103	13316969	8062983	11764136	7551098	15274705	14594939	11701354	10280697	8783031	12054981	8502830	7991402	9331420	12143418	
Pyrophosphate	Pyrophosphate	2103	5801	8934	5979	21280	6190	5325	29528	23017	8518	7980	9151	9176	10206	5064	7350	5833	6735	2067	3217	2536		23938	12575	3182	5146	5329	49117	30237	5568	7174	26563	1861	2329	4131	32771	4760	9353	19142	
Pyrrolidonecarboxylic acid	Pyroglutamic acid	1733	1441	1748	549	1601	1486	288			584	846	727	236		395	517	1735	1338	1585	1481		70	45		4724	2063	2032	3803	1353	1455	659	1330	5005	3580	3727	3552	2329	2595	3717	
Pyruvic acid	Pyruvic acid	82456	145196	249120	104854	210906	124561	252832	619146	332549	181729	168046	207707	320742	321376	202026	279310	84850	59814	81903	142615	6287	3344	5744	20278	154284	85078	132872	406262	311452	284502	329866	625222	104521	100139	161770	321563	151435	173679	276801	11306
Ribitol	Ribitol	5955	7767	9343	4830	6604	6179	7979	12480	7099	9342	6796	8337	9386	7564	6529	6548	10002	7467	7481	14656	3900	883	1693	2589	13240	9418	11996	16842	9921	9064	8023	15579	14227	10178	15739	23420	8687	10362	10090	427
Sarcosine	Sarcosine	3995	9156	8372	11241	3942	9503	11753	10926	15167	7010	12422	18034	13627	6082	10390	15122	11526	8572	14390	12025	21785	7376	12964	6317	9623	11671	15667	17227	7321	11116	14091	13878	5140	10280	11175	12407	7160	8981	10084	348
Sedoheptulose 7-phosphate	Sedoheptulose 7-phosphate	2577	3612	7369	2688	5757	3994	8361	19836	6166	5253	4919	6579	10192	4795	4184	6187	6728	4025	4657	9286					4642	2359	5256	11135	5824	6513	7261	14768	3710	3022	4687	9749	4080	4289	8734	
Serotonin	Serotonin			29																																					
Sorbitol	Sorbitol	61055	150557	75188	36705	47372	55730	45178	41584	73703	112483	86516	105706	87395	109371	123632	75665	139406	87439	85510	120101	104628	83374	145075	9661	175934	172752	127036	169064	88849	84867	63972	83613	100290	95384	124450	145593	60196	48321	73892	
Spermidine	Spermidine	2368	158	7245	318	2837	280		2482	1131	382	841	419	4016	1111			4080	3235	2595	923				141	125	2279	7809		49	400	702	903	9337	1077	3645	996	1320	535	919	
Stearic acid	Stearic acid	585844	173712	996180	227187	2086888	2560466	900505	3151444	882936	917348	761034	565108	1106522	551588	284095	508599	498152	404108	663484	1213922	354758	74569	102151	242859	2763948	780333	1377364	1395256	2070388	903997	466302	3455705	698998	347614	1012493	1249255	2549000	2786033	2089218	31
Succinic acid	Succinic acid	13089	16915	21631	14924	25122	17414	22859	33671	22122	18641	13750	16149	17266	19870	16623	21710	39058	16851	26475	35039	36250	4406	13816	12639	20505	13522	18479	25856	32196	20465	20452	33895	27761	24014	36748	68964	24663	27655	31323	
Succinylacetone	Succinylacetone		771			173	48	334		19	403	3534	1044	605		1074				1056	469	1384		1031	659	560	403			1069	577		399		243	801	553		922	558	
Sugar Alcohol-phosphate		536	585	1095	743	793	854	323	858	723	1390	1583	2030	3191	470		326			385					529	90	840	672	2209	721	141		537	973	64		394	956	63	1454	274
Taurine	Taurine																																								
Threonic acid	Threonic acid	676	1686	2108	1056	939	1125	2507	1107	3632	1526	1902	3064	713	2894	3387	3896	2086	1326	2134	870	1122		572	753	1886	434	1504	787	2249	3845	2812	1470	1046	1260	2394	993	1197	1220	1125	
Thymine	Thymine									491		190																													
Uracil	Uracil	58962	162725	189125	177087	164787	165912	188564	437548	198296	168180	194946	266380	327985	120559	169909	197517	189403	124344	151337	298676	345797	47622	169011	233223	119230	145393	177844	255112	230700	220973	149209	355251	48809	136965	185294	338510	54328	185181	74882	
Urea	Urea	12424	15579	23160	11506	7455	10592	15235	17364	14482	27988	38399	47586	66866	22671	22178	27112	22384	11221	27345	21487	24182	661	578	15205	113649	35527	36332	124223	18824	30242	29718	47276	18854	19668	32620	37702	12472	12807	15628	
Uric acid	Uric acid																																								
Uridine	Uridine			523	99			2525	1855	127		186	334	403							86										589	1002		146	111	792			109		
Xanthine	Xanthine																																								
Xanthurenic acid	Xanthurenic acid																																								
Zymosterol	Zymosterol