Metabolite_name	RefMet_name	NACH-00276	NACH-00277	NACH-00278	NACH-00279	NACH-00280	NACH-00281	NACH-00271	NACH-00272	NACH-00273	NACH-00274	NACH-00275
Factors	-	GROUP_ID:CON	GROUP_ID:CON	GROUP_ID:CON	GROUP_ID:CON	GROUP_ID:CON	GROUP_ID:CON	GROUP_ID:GOS	GROUP_ID:GOS	GROUP_ID:GOS	GROUP_ID:GOS	GROUP_ID:GOS
2_3-dihydroxyisovalerate	2,3-Dihydroxyisovaleric acid	0.9297	1.0640	0.9403	1.0347	1.1605	1.3819	0.3524	1	0.8854	0.9658	1.2558
2_6-dihydroxybenzoic acid	2,6-Dihydroxybenzoic acid	1.1370	0.9763	1	1.0077	1.2007	1.0398	0.5780	0.8196	0.8195	0.8451	1.0090
2-aminoadipate	alpha-Aminoadipic acid	1.2555	0.9889	0.7893	1.0177	0.9755	1.0258	1	1.1816	1.3073	0.9325	0.6694
2-hydroxy-4-(methylthio)butanoic acid	2-Hydroxy-4-(methylthio)butanoic acid	1.1890	1.1444	1.5166	0.9706	1	0.9619	1.2152	0.9590	0.7173	0.8123	1.8163
2-hydroxyadipate	2-Hydroxyadipic acid	1	1.0602	1.0157	0.6656	0.8495	0.9195	1.9462	1.2701	0.8417	0.7715	1.1181
2-hydroxybutyrate/2-hydroxyisobutyrate	2-Hydroxybutyric acid/2-Hydroxyisobutyric acid	1.3549	1.1869	0.8181	1.0022	0.8744	0.8004	0.8221	1.1547	1	0.9365	1.0983
2-hydroxyphenylacetate	2-Hydroxyphenylacetic acid	1.0804	0.9530	0.8084	0.9035	1	1.5297	0.7211	0.7922	1.4082	1.1942	1.0168
2-isopropylmalate	2-Isopropylmalic acid	1.1752	2.1994	0.9138	0.9041	1.1716	0.6540	0.6264	1.4726	1.3279	0.4417	1
2-keto-3-deoxy-gluconate	2-Dehydro-3-deoxy-D-gluconic acid	0.9661	1.0003	0.7888	0.7888	0.9441	1.0146	0.9997	1.5409	1.4440	1.1354	0.8705
2-oxoadipate	Oxoadipic acid	1.2763	0.8820	1	0.9351	0.8547	0.9951	1.5110	1.4418	1.3026	0.8688	1.4581
2R_3R-dihydroxybutyrate	4-Deoxyerythronic acid	1.1437	1.0758	1	0.9699	1.0303	1.0156	0.7218	0.8760	0.9595	0.9765	1.0210
2S_3R-dihydroxybutyrate	4-Deoxythreonic acid	1.1513	1.2804	0.9089	0.9714	1	1.0564	0.7503	0.9594	0.9136	1.0940	1.5280
3_4-dihydroxybutyrate	3,4-Dihydroxybutyric acid	1.0916	1.2266	1.3706	0.9035	1	0.9654	0.7414	1.1689	0.9140	1.0039	0.8666
3-hydroxy-3-methylglutarate	3-Hydroxymethylglutaric acid	1.3329	1.2964	0.8076	1.0233	0.9682	0.8504	1	1.5294	0.9526	0.9812	1.4517
3-hydroxyadipate*	3-Hydroxy-adipic acid	1.0293	1.8278	1	0.8611	1.0974	0.4374	0.1945	1.0034	0.4601	0.7576	1.0809
3-hydroxybutyrate (BHBA)	3-Hydroxybutyric acid	1.3643	1.0195	0.9406	1	0.9648	0.6396	1.4852	0.9433	1.1661	0.8514	1.0600
3-hydroxyisobutyrate	3-Hydroxyisobutyric acid	1.3826	0.6440	1	0.6125	0.7041	0.9607	1.3798	1.4095	1.0314	0.6037	1.6522
3-methylglutaconate	3E-Methylglutaconic acid	1.0201	0.8732	0.8322	0.7646	0.7302	1.2419	0.9168	1.2282	1.0261	1	1.2116
acetylphosphate	Acetylphosphate	0.8669	0.5634	1	1.8588	1.3075	4.7926	0.5711	0.7521	1.5194	1.4486	0.6085
adipate (C6-DC)	Adipic acid	1.2206	1.4937	1	0.8818	0.9224	0.8119	1.0100	1.1546	0.5231	0.9643	1.6038
allantoin	Allantoin	1.1241	1.2443	1.0161	0.9462	1.0451	1.3187	0.8788	0.9335	0.9544	1	0.9806
alpha-ketoglutaramate*	2-Keto-glutaramic acid	0.9890	1.0429	0.9135	0.9740	1	1.4097	1.4855	1.0383	0.9929	0.9549	1.2106
alpha-ketoglutarate	2-Oxoglutaric acid	1.3517	0.9934	0.6618	1	0.9455	0.2252	1.4652	1.4573	0.8308	1.2387	1.6083
arabinose	Arabinose	0.8981	1.2577	1.1292	0.1317	0.1317	0.8830	0.1317	1.1231	1.0840	0.1317	0.9160
arabitol/xylitol	Arabitol	1	1.5304	0.9519	0.8621	1.0593	1.0744	0.9455	1.2658	0.9015	0.8179	1.1740
arabonate/xylonate	Arabinonic acid/Xylonic acid	1.1719	1.4114	0.7319	0.9779	1.1156	1.0374	0.6573	1.4379	1	0.9666	0.9755
ascorbic acid 2-sulfate		1.1532	1.4478	0.9998	0.9497	1.0733	1.1711	0.4635	1.0625	1	0.9239	0.8721
ascorbic acid 3-sulfate*		1.5549	1.8823	0.9861	1.2124	1.3315	0.9005	0.5139	1.4068	1	0.9483	0.8932
caffeic acid sulfate		0.6861	1.1429	0.8618	0.3703	0.9716	0.2321	1.0729	3.0253	14.3167	1	1.9150
creatine phosphate	Phosphocreatine	1.0773	1.0165	0.5137	1.0710	0.9835	0.4444	1.0359	0.8030	0.4444	1.0799	0.6250
cysteine s-sulfate	Cysteine-S-sulfate	1.0101	0.9568	0.9884	0.8713	0.8589	1	7.1239	1.0583	0.7807	1.2348	1.1608
dihydrocaffeate sulfate (2)		0.3799	0.6574	0.4463	1	1.7406	0.6120	1.2811	1.2306	0.3148	1.1790	1.7307
dihydroorotate	4,5-Dihydroorotic acid	1.1384	0.9698	0.5168	1	0.9629	0.1965	2.3704	1.5889	0.4288	1.0894	1.6666
erythritol	Erythritol	1.0271	1.0065	1.0939	0.9350	1.2148	1.6459	0.7142	0.7260	1	0.7942	0.5654
erythronate*	Erythronic acid	1.0201	1.0749	0.7984	0.8188	1.0188	1	0.6131	1.0239	0.9441	0.9449	1.0220
ethylmalonate	Ethylmalonic acid	1.2020	1.0229	0.6231	0.8852	0.8858	0.7912	0.5148	1.7837	1.0118	1.0239	1
fructose	Fructose	1.0551	1.0071	0.6765	0.7602	0.7578	0.9720	1.6023	1.4383	1	0.7541	1.9562
fumarate	Fumaric acid	0.9987	1	0.8568	0.8877	0.8930	1.2370	1.5560	1.7160	1.3837	0.7134	1.2600
galactitol (dulcitol)	Galactitol	0.6822	0.9734	1.0772	0.3004	0.5433	2.2888	3.1912	1	1.6817	1.2770	0.7923
galactonate	Galactonic acid	0.8879	1.2636	1	0.5720	0.8884	1.3118	1.2313	1.1532	1.4405	0.8308	0.9484
gluconate	Gluconic acid	0.9228	1	0.8797	0.7562	1.0032	1.2403	2.1287	1.2965	1.0613	0.7339	0.9863
glucose	Glucose	1.2181	1.4113	0.8903	1	1.0955	0.6246	0.4963	1.2129	0.7931	1.0547	0.9231
glucuronate	Glucuronic acid	0.8725	1.0325	1.0272	0.9324	0.9633	1.2201	2.0401	0.8493	0.9162	1	1.0118
glutarate (C5-DC)	Glutaric acid	1.7839	1	0.5950	1.5097	0.8744	0.6256	1.2597	1.6802	0.8452	0.7746	1.4234
glycerate	Glyceric acid	1.0847	1.0721	0.9276	1.0271	0.7942	1.2286	0.7954	0.9515	0.9474	1	1.0626
glycerophosphoethanolamine	sn-Glycero-3-phosphoethanolamine	1	1.0186	0.8088	1.0984	0.9925	2.0250	0.7401	1.0065	1.1050	0.8857	0.9755
glycerophosphoglycerol	sn-Glycero-3-phosphoglycerol	0.9296	1	0.7973	1.0239	0.8412	1.3181	1.2305	1.0395	1.8444	0.5754	0.9465
glycerophosphoinositol*	sn-Glycero-3-phosphoinositol	0.8417	1.1137	0.8293	1.1876	1	1.7667	0.9144	1.0873	0.8366	1.3638	0.9824
glycolate (hydroxyacetate)	Glycolic acid	1.0376	0.9103	0.8276	0.3959	0.9624	0.3771	2.0611	1.2041	1.5324	0.3771	1.0617
gulonate*	Gulonic acid	1	1.3780	0.9043	0.8429	1.2411	0.5976	0.6986	1.4936	1.0727	0.8043	1.8243
hydantoin-5-propionate	Hydantoin-5-propionic acid	1	0.8166	1.0010	1.2335	0.8306	2.1538	0.4859	1.9597	0.5834	0.9072	2.4082
hypotaurine	Hypotaurine	0.6914	1.0845	0.9721	0.7309	1	1.3283	2.5542	1.0168	1.0181	0.9199	0.8052
isocitric lactone	Isocitric acid lactone	1.0623	0.9946	0.8376	0.7459	0.8527	1.5146	1.0205	1.5672	1.1328	0.9535	1
lactate	Lactic acid	0.9789	1.0069	0.7955	1.0261	0.9823	0.8984	0.8514	1.2576	1	1.0441	1.0328
malate	Malic acid	1.1005	0.8914	0.7502	1	0.9058	1.4472	1.3517	1.5953	1.4631	0.7944	0.9463
maleate	Maleic acid	1.1788	0.8546	0.6459	0.8497	1	0.9567	1.4897	1.9382	1.0045	0.9689	1.2250
malonate	Malonic acid	0.9477	0.8821	0.8306	1.0681	0.7839	1.0449	1	1.0658	0.8955	1.2293	1.0180
mannitol/sorbitol	Sorbitol	1.0642	1.3409	0.8731	0.9210	1.2153	0.8422	0.8706	1.2859	0.9852	1.1348	1
mannonate*	Mannonic acid	0.9318	1.4023	1	0.8458	1.2075	1.1434	0.7852	1.1244	1.0457	0.8941	0.9367
mannose	Mannose	1.3230	1.7268	1.3480	0.9617	1.1871	0.5685	0.6586	1	0.6402	1.1919	0.7917
methylmalonate (MMA)	Methylmalonic acid	1.0357	1.2646	0.8347	1	0.9786	1.0069	0.8892	1.4549	0.9913	0.9173	1.1390
methylsuccinate	Methylsuccinic acid	1.1399	1.4543	0.8386	1.0652	1.1174	0.6948	0.9400	1.2648	0.9259	0.7999	1
mevalonate	Mevalonic acid	1.1698	1.0163	1.0668	1	0.8490	1.2481	0.9253	0.8270	0.8573	0.8813	1.2093
myo-inositol	Myo-inositol	0.8931	0.9822	0.8099	1.0659	1	1.8224	0.7705	1.0278	1.0064	1.2287	0.9791
N2-acetyllysine	N(2)-Acetyllysine	1.5033	1.3141	0.9271	1	1.3920	0.8390	0.4990	1.4246	1.2056	0.8750	0.9435
N2_N5-diacetylornithine	N2,N5-Diacetylornithine	0.9006	0.9864	0.7902	0.5466	0.5466	1.1168	1.0136	1.0247	0.8684	1.1829	1.1445
N6-acetyllysine	N6-Acetyllysine	1.2079	0.9974	1.0794	0.9141	1.0352	1	0.7603	0.9763	1.0394	0.7839	1.0113
N-acetylalanine	N-Acetylalanine	1.1374	1.1654	1.0551	0.9265	0.9257	1.0676	1.0372	0.9326	0.9614	1	0.9518
N-acetylaspartate (NAA)	N-Acetylaspartic acid	1.1977	0.9601	1	1.3008	0.9548	2.5979	0.8453	0.9977	1.5422	1.2270	0.7333
N-acetylglucosamine 6-phosphate	N-Acetyl-glucosamine 6-phosphate	0.7222	0.8978	1.0137	1.2786	0.9730	2.6943	2.1018	1	2.3027	0.8573	0.8537
N-acetylglycine	N-Acetylglycine	1.0202	1.0450	0.9381	0.8473	1	1.1794	0.5333	1.0818	0.9441	0.9927	1.1042
N-acetylneuraminate	N-Acetylneuraminic acid	1.1102	1	0.9864	1.1206	1.1869	1.8118	0.8721	0.9522	1.1330	0.9642	0.9016
N-acetylserine	N-Acetylserine	0.9517	1.0990	1.0251	0.9820	0.9750	1.2404	0.8514	1	0.8966	1.0099	1.1184
N-formylanthranilic acid	Formylanthranilic acid	0.8896	0.5404	0.8028	0.7974	1	2.7305	2.0542	0.8359	1.5464	1.1509	1.1864
orotate	Orotic acid	1.1103	0.7895	0.8122	1	0.8500	1.5385	1.6725	0.9977	1.3682	1.0994	0.7404
orotidine	Orotidine	1.0570	0.9877	0.7126	1.0111	0.9855	1.4486	0.9007	1.0826	1	1.0654	0.7260
pentose acid*	Valeric acid	0.6848	1.1300	0.6848	0.6848	0.6848	0.7009	0.6848	1.2211	1.0086	0.6848	0.9914
perfluorooctanesulfonate (PFOS)	Perfluorooctanesulfonic acid	1.1853	1	0.7663	1.0352	0.9649	0.7740	1.4219	1.1989	1.0154	0.8340	0.8664
pimelate (C7-DC)	Pimelic acid	1.1445	1.5082	0.9120	1.0880	1.1266	0.4106	0.3783	0.3761	0.5395	0.3761	1.2026
pyruvate	Pyruvic acid	1.0720	1.0538	0.7881	0.9734	1.0117	0.5950	1.3509	1.3060	0.7708	1	0.9822
ribitol	Ribitol	0.9740	1.2754	0.8954	0.8950	0.9592	1.0930	1.0257	1.4196	0.9170	1	1.1079
ribonate	Ribonic acid	1.5607	1.6840	1.0459	0.9937	1.1375	0.8842	0.6724	1.2790	0.9821	0.7795	1
ribose	Ribose	0.3368	0.2468	1.4899	1	1.1057	0.2468	2.8238	0.2468	0.4636	2.5476	0.6316
ribulonate/xylulonate/lyxonate*		1.1581	1.2940	0.8673	1.0353	1.0847	0.7148	0.5650	1.1807	0.8087	1	0.8978
ribulose/xylulose		0.7080	0.7080	1.1127	0.9910	1.1492	0.7080	0.7080	0.7998	1	1.1558	0.7080
salicylate	Salicylic acid	0.9357	0.7439	0.6683	0.4110	0.4110	1.7571	1.5522	0.9340	1.1883	1.1174	1.0643
sedoheptulose	Glucoheptulose	0.6096	1.0048	0.7350	0.5925	1.0167	1.1822	0.9952	1.0773	0.8526	0.5925	1.8136
S-methylcysteine	Methylcysteine	1.1669	0.8360	1.2822	0.6860	1.1153	0.8847	1.1221	0.6976	0.6860	0.7748	1.1553
sphingosine 1-phosphate	Sphingosine 1-phosphate	0.9438	1.0512	0.9337	1.1180	1.0868	0.7913	1.4439	0.8902	0.8282	1.0862	1
succinate	Succinic acid	1.1377	1.1361	0.7878	1.0770	1	0.8001	0.8431	1.1858	0.8619	0.8425	1.0161
sucrose	Sucrose	0.9832	1.5164	0.9398	0.8933	1	2.5381	0.8221	2.4538	1.6200	0.9201	3.7637
taurine	Taurine	0.9444	1.0232	0.8529	1.0007	0.9068	1.4653	0.9042	1	1.0503	1.0044	0.8177
threonate	Threonic acid	1.1140	1.1924	0.7690	0.8307	1.0143	0.7907	0.5704	1.1033	1.0811	0.7084	1
tricarballylate	1,2,3-Propanetricarboxylic acid	0.6248	1	0.4856	0.7330	1.0063	0.5161	0.0733	3.0085	2.6125	1.1375	3.5927
xylose	Xylose	1.2889	0.9887	1.0640	0.6976	0.6976	1.1408	0.6976	0.9141	0.9142	0.6976	1.0113