Data for (Study ST001940)

(Analysis AN003155)

Values for each metabolite have been scaled by dividing by the mean across all factors

Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

Metabolite	F1	F2	F3	F4	F5	F6	F7	F8
10-heptadecenoate (17:1n7)	0.4695	0.8085	0.8322	1.3848	0.3640	0.9938	3.8864	0.7569
10-hydroxystearate	0.6776	1.0277	0.8602	1.2979	1.0332	0.8054	1.1722	0.7821
1-(1-enyl-oleoyl)-GPE (P-18:1)*	1.2994	0.7989	0.8827	0.9500	3.4288	0.6401	0.7917	0.9488
1-(1-enyl-palmitoyl)-GPE (P-16:0)*	1.3330	0.4737	1.2226	0.6937	1.6938	1.5222	0.4493	2.8470
1-(1-enyl-stearoyl)-GPE (P-18:0)*	1.2117	0.5246	1.1663	0.8765	3.8165	0.8073	1.2167	1.3948
11-ketoetiocholanolone sulfate	1.1691	0.5076	1.6676	0.6853	0.2913	1.0735	0.3195	3.0761
12,13-DiHOME	0.8560	0.9581	0.4729	1.3408	1.7132	0.6306	1.4465	1.0319
1,2,3-benzenetriol sulfate (1)	0.0507	1.9268	0.0210	2.2131	NA	0.0636	0.5118	NA
1,2,3-benzenetriol sulfate (2)	0.0496	6.1218	0.0578	3.5082	0.0667	0.1807	0.1871	0.0556
12-dehydrocholate	0.5003	0.2279	0.1257	0.7544	4.0470	2.9514	5.5267	0.9481
1,2-dilinolenoyl-digalactosylglycerol (18:3/18:3)	1.0780	0.2084	0.1381	0.9218	0.2002	0.0462	0.3939	5.3482
1,2-dilinolenoyl-galactosylglycerol (18:3/18:3)*	0.7654	0.1107	0.1017	0.9672	0.2029	0.0506	0.1549	6.4514
1,2-dilinoleoyl-digalactosylglycerol (18:2/18:2)*	0.7630	0.6799	1.0005	0.5819	3.8841	0.5467	4.4906	1.7161
1,2-dilinoleoyl-galactosylglycerol (18:2/18:2)*	0.7796	0.7057	1.1441	0.5610	2.1723	0.5949	1.1127	3.4270
1,2-dilinoleoyl-GPC (18:2/18:2)	1.5862	0.6861	1.7358	0.7367	1.9460	0.2671	0.9644	0.3248
1,2-dipalmitoyl-GPC (16:0/16:0)	0.7477	0.4745	2.6743	0.5084	2.6914	0.8718	1.7201	0.5588
1,3,7-trimethylurate	2.4137	0.6293	1.8963	0.7141	0.0143	0.1484	0.1855	0.1556
1,3-dimethylurate	0.8086	1.2599	0.9789	1.0585	NA	0.4721	0.9048	0.8542
13-HODE + 9-HODE	0.4038	0.8061	0.9939	0.8548	4.3586	0.4028	9.6724	0.5115
13-HOTrE	0.9893	1.1153	1.9386	0.7782	NA	0.2350	0.5386	0.6158
(15:0)-anacardic acid	NA	0.7142	1.2725	0.4553	NA	2.5084	NA	0.8801
(15:2)-anacardic acid	0.0834	0.1713	1.7821	0.3256	NA	5.0477	NA	7.4654
15-methylpalmitate (i17:0)	1.3312	0.8604	1.5142	1.0138	0.3633	0.2685	1.5159	0.5019
16a-hydroxy DHEA 3-sulfate	1.1259	1.3073	0.7375	1.0153	NA	0.9842	0.1992	0.8458
1,7-dimethylurate	0.9323	1.1661	0.4583	1.2174	0.0879	0.7285	1.3841	1.1841
17-methylstearate (i19:0)	0.8202	0.8538	0.9393	1.2679	0.3256	0.3607	3.6032	0.7286
1-linolenoyl-2-hexadecatrienoyl-galactosylglycerol (18:3/16:3)	0.2698	0.3230	NA	2.4084	NA	0.0195	0.1885	0.0261
1-linolenoylglycerol (18:3)	1.3671	0.7774	1.7466	0.9861	0.1762	0.2371	0.7137	0.6262
1-linoleoyl-2-linolenoyl-digalactosylglycerol (18:2/18:3)*	0.8714	0.6174	1.1464	0.5499	2.4660	0.4826	3.2932	2.7314
1-linoleoyl-2-linolenoyl-galactosylglycerol (18:2/18:3)*	0.8048	0.4297	1.0346	0.3481	1.7006	0.3378	0.4782	5.0041
1-linoleoylglycerol (18:2)	0.7865	0.5666	0.8945	0.9135	4.3743	0.2700	6.5036	0.3749
1-linoleoyl-GPC (18:2)	1.6069	0.5004	1.8908	0.4273	3.9466	0.2983	1.0561	0.9444
1-linoleoyl-GPE (18:2)*	1.2356	0.6304	2.3983	0.4907	5.6635	0.3374	0.5558	0.7563
1-methyladenine	0.7735	0.6076	0.6632	0.9338	2.9864	0.4947	6.6876	0.7547
1-methyl-beta-carboline-3-carboxylic acid	2.3839	0.9558	0.4901	1.4156	0.0542	0.0432	0.0948	0.0454
1-methylguanidine	0.9678	1.3320	0.5571	1.2156	0.2839	0.6421	0.5920	0.6013
1-methylhistamine	1.3577	0.6250	1.1777	NA	NA	NA	0.4993	NA
1-methylimidazoleacetate	1.3963	0.9704	0.6938	1.1361	0.3754	0.8207	0.5704	1.0283
1-methylnicotinamide	1.9122	0.6900	1.5290	0.7806	0.5164	0.7683	0.3009	0.4941
1-methylurate	1.0171	0.9431	0.6097	1.4058	0.1403	0.6976	2.0277	0.5481
1-methylxanthine	0.9666	1.2383	0.7008	1.1296	0.1580	0.7424	1.5949	0.9193
1-oleoyl-2-linoleoyl-GPC (18:1/18:2)*	1.8367	0.6101	1.2020	0.5593	4.7008	0.4657	2.3769	0.2481
1-oleoylglycerol (18:1)	0.9227	0.5323	0.8521	0.9182	2.1420	0.3583	7.6852	0.7438
1-oleoyl-GPC (18:1)	1.1641	0.6823	1.0369	0.8807	5.6186	0.2868	2.2360	0.2610
1-oleoyl-GPE (18:1)	1.4009	0.6154	0.9767	1.0130	3.4844	0.6766	1.3564	0.6310
1-oleoyl-GPG (18:1)*	0.4519	0.3113	1.5064	1.1483	1.1653	1.6757	1.9220	0.3777
1-oleoyl-GPI (18:1)*	1.8308	0.4126	0.8263	1.0090	NA	0.5796	NA	0.4388
1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6)	0.1920	0.2667	0.8429	0.1905	11.1586	0.1425	7.6570	0.0451
1-palmitoyl-2-linolenoyl-digalactosylglycerol (16:0/18:3)	1.2385	0.3234	0.3690	0.9157	0.5229	0.1627	2.0652	3.5941
1-palmitoyl-2-linoleoyl-digalactosylglycerol (16:0/18:2)*	0.7753	0.8498	0.8735	0.8658	2.3651	0.6203	2.4731	2.0811
1-palmitoyl-2-linoleoyl-galactosylglycerol (16:0/18:2)*	0.7852	0.8485	0.7073	0.9987	0.7074	0.7599	0.9038	2.9093
1-palmitoyl-2-linoleoyl-GPC (16:0/18:2)	0.7614	0.4680	1.7146	0.4036	6.4421	0.4902	5.5491	0.4022
1-palmitoyl-2-linoleoyl-GPE (16:0/18:2)	1.5080	0.5213	0.8893	0.6680	1.7636	1.5066	2.7785	2.0461
1-palmitoyl-2-linoleoyl-GPI (16:0/18:2)	NA	NA	NA	NA	NA	NA	NA	NA
1-palmitoyl-2-oleoyl-GPC (16:0/18:1)	0.9718	0.4946	1.4052	0.5432	6.0642	0.4539	5.3463	0.2283
1-palmitoyl-2-oleoyl-GPE (16:0/18:1)	0.8568	0.5963	0.7858	0.5927	6.7386	1.5838	5.1133	1.1805
1-palmitoyl-GPC (16:0)	0.9746	0.7179	1.5700	0.8521	2.9001	0.4495	1.7038	0.8221
1-palmitoyl-GPE (16:0)	0.8074	0.9203	0.7997	1.1050	1.7549	1.2157	1.4679	1.0175
1-palmitoyl-GPG (16:0)*	0.9071	0.7324	1.5719	0.9735	0.3580	0.6750	2.7215	0.8466
1-palmitoyl-GPI (16:0)	1.5889	0.6428	1.0197	0.6582	0.1244	1.2120	3.1896	1.6931
1-palmitoyl-GPS (16:0)*	1.0500	0.3730	0.4437	1.0058	NA	1.3249	0.6263	3.7801
1-stearoyl-2-linoleoyl-GPC (18:0/18:2)*	1.1768	0.5835	1.0516	0.7207	5.6475	0.4861	3.6091	0.2372
1-stearoyl-2-oleoyl-GPC (18:0/18:1)	1.0759	0.7879	0.9189	0.8862	4.0662	0.6885	2.4570	0.3324
1-stearoyl-GPC (18:0)	1.1523	0.4023	1.3917	0.7272	8.0107	0.4045	1.4198	0.4376
1-stearoyl-GPE (18:0)	1.3318	0.5731	1.0482	0.9443	4.5196	0.5663	1.4367	0.6774
1-stearoyl-GPG (18:0)	1.0548	0.9147	0.8967	1.0296	0.2510	0.9055	1.8032	1.1283
1-stearoyl-GPI (18:0)	2.0270	0.5896	0.9326	0.6158	0.4999	1.7943	2.5170	1.6586
1-stearoyl-GPS (18:0)*	0.9675	0.5473	0.9936	1.0148	0.2055	1.0171	7.4049	1.1209
20-hydroxyecdysone	NA	0.0948	NA	1.3805	NA	NA	1.1443	NA
21-hydroxypregnenolone disulfate	0.6949	0.5707	0.6000	0.6798	0.8130	1.8819	NA	3.1849
2,3-dihydroxy-2-methylbutyrate	0.8714	0.5126	0.8440	0.2446	0.0927	1.5632	2.0126	4.6676
2,3-dihydroxyisovalerate	1.2676	0.6288	1.9923	0.9199	0.7515	0.5427	0.5323	0.6105
2,3-dimethylsuccinate	1.0961	1.0345	1.2239	0.9489	NA	0.5239	0.6054	0.8220
2,4,6-trihydroxybenzoate	1.5714	0.8699	0.8531	0.7716	2.4833	0.8416	0.8161	1.5030
2,4-dihydroxyhydrocinnamate	1.3242	0.7526	0.5678	1.1762	NA	0.5803	NA	1.9910
2-(4-hydroxyphenyl)propionate	0.3124	1.2518	0.2433	0.3600	NA	2.0948	NA	3.4752
2,8-quinolinediol	0.5657	1.2632	1.1138	0.6298	3.2339	0.9326	0.3533	1.1104
2,8-quinolinediol sulfate	NA	NA	2.5083	NA	0.8011	0.4670	NA	0.2235
2-acetamidobutanoate	0.9685	1.0637	0.7417	0.8781	1.0629	1.1833	1.6462	1.3996
2-aminoadipate	1.0433	1.1131	0.7530	1.1126	0.2580	1.1494	0.5309	0.8877
2-aminoheptanoate	NA	1.2891	0.8822	NA	NA	NA	0.8287	NA
2-aminophenol	1.3025	0.6198	1.1246	1.0416	0.2358	1.2703	0.3228	1.9063
2-aminophenol sulfate	1.0735	0.5114	0.8582	1.2860	NA	0.8517	0.1419	2.9350
2^-deoxyadenosine	2.9050	0.5782	0.7525	0.4558	1.0361	1.2943	1.0625	0.8282
2^-deoxyadenosine 5^-monophosphate	1.3221	0.7862	0.9055	1.4743	1.9116	0.1423	0.5835	0.2126
2^-deoxycytidine	1.3987	0.5186	1.7023	0.4997	0.4960	2.2234	0.9193	1.8337
2^-deoxycytidine 5^-monophosphate	1.2083	0.8285	0.8559	1.4295	2.2550	0.1512	0.8046	0.3720
2^-deoxyguanosine	0.7232	0.7208	1.2477	0.4819	0.8849	2.8486	2.0030	2.3683
2^-deoxyinosine	0.8214	0.8715	1.3492	0.6385	0.8567	1.9251	1.4725	1.6886
2^-deoxyuridine	0.6333	1.0691	1.0920	0.6563	1.2372	1.6715	1.8869	1.6891
2-hydroxy-3-methylvalerate	0.2436	2.9843	0.1775	0.3849	0.5093	0.1891	1.7081	1.3539
2-hydroxyacetaminophen sulfate*	NA	NA	2.7870	0.1709	NA	0.0422	NA	NA
2-hydroxybehenate	0.9937	1.1426	1.0766	1.2164	0.4930	0.2675	0.8498	0.2702
2-hydroxybutyrate/2-hydroxyisobutyrate	0.7889	0.6745	0.8903	0.6827	1.8397	1.1340	1.9216	3.6272
2-hydroxydecanoate	0.5641	1.0468	0.7518	0.7555	2.8613	1.3446	3.3606	1.0350
2-hydroxyglutarate	0.9742	0.7653	1.2220	1.0093	0.0149	1.5852	2.1138	1.4997
2-hydroxyhippurate (salicylurate)	0.5333	0.3760	0.1573	1.9898	0.9210	NA	0.4501	0.0700
2-hydroxyibuprofen	0.6715	1.5197	2.8798	0.2887	1.3224	NA	0.4722	0.3738
2-hydroxylaurate	0.9897	1.1034	1.0294	1.0537	0.5822	0.5055	1.4896	0.7089
2-hydroxypalmitate	1.0562	1.1308	1.0593	1.1469	0.5654	0.1760	1.7026	0.3732
2-hydroxyphenylacetate	0.8179	1.0243	0.8923	0.9889	2.2574	0.6020	1.4815	0.7216
2-isopropylmalate	1.2786	0.2185	2.8477	0.4740	0.3432	1.5935	0.4230	1.6628
2-keto-3-deoxy-gluconate	1.1343	0.5993	1.4098	0.8249	0.3998	1.1127	0.6030	2.6527
2-linoleoylglycerol (18:2)	0.6912	0.9602	1.0141	0.9921	2.0953	0.3151	3.9733	0.5130
2-methoxyacetaminophen sulfate*	NA	NA	1.0000	NA	NA	NA	NA	NA
2-methylcitrate/homocitrate	1.0934	0.8339	1.2496	0.8561	0.1175	1.7683	0.1685	1.2560
2-methylserine	0.5638	0.8021	1.5284	0.7281	0.9923	1.5202	1.5591	1.6844
2-oleoylglycerol (18:1)	1.0392	0.5951	0.7542	0.8742	0.8578	0.3333	8.5595	0.7299
2^-O-methyluridine	0.7604	1.1256	0.9260	0.9653	1.0216	0.9354	1.1536	1.1112
2-oxindole-3-acetate	1.4248	1.1459	1.7342	0.6473	0.0657	0.4038	0.0274	1.0515
2-oxo-1-pyrrolidinepropionate	1.2089	0.8436	1.7964	0.9663	0.5890	0.6484	0.6254	0.4409
2-oxoarginine*	0.4001	0.6463	3.2476	0.5378	1.2480	0.6068	1.1186	0.3451
2-palmitoylglycerol (16:0)	0.6727	0.9440	0.6583	0.7838	0.3191	2.4741	3.0076	0.6726
2-piperidinone	1.2008	0.6561	0.6776	0.5766	0.2640	5.3396	0.1190	1.9470
3-(2-hydroxyphenyl)propionate	1.7120	1.1126	0.5235	0.8833	0.6884	1.4917	0.8555	0.6914
3-(3-hydroxyphenyl)propionate	1.3843	1.0332	0.8531	0.8885	0.0441	1.2577	0.9563	0.7251
3-(3-hydroxyphenyl)propionate sulfate	0.4670	3.1710	0.4256	0.5692	NA	0.3179	1.1820	0.1772
3,4-dihydroxybenzoate	0.9176	1.6230	0.7800	0.8493	0.5140	0.4233	0.8881	0.5460
3,4-dihydroxyphenylacetate	0.8836	1.0671	1.1211	1.2034	1.4939	0.5282	NA	0.2328
3-(4-hydroxyphenyl)lactate	1.1624	0.6228	0.7701	0.8696	0.3811	0.7851	0.8479	3.9882
3-(4-hydroxyphenyl)propionate	2.3322	0.3921	1.3860	0.5650	2.4001	0.4759	1.9374	0.6441
3,5-dihydroxybenzoic acid	1.4517	0.7981	1.0772	1.0860	0.5626	0.9446	NA	0.9284
3,7-dimethylurate	1.1712	0.9981	0.8238	1.0436	0.0729	1.3733	0.7766	0.7948
3-aminoisobutyrate	1.5766	0.9868	0.9012	1.1746	0.5190	0.5597	0.4852	0.4983
3beta-hydroxy-5-cholestenoate	0.4007	1.4371	0.3599	1.4830	1.7456	0.5248	1.8633	0.2566
3b-hydroxy-5-cholenoic acid	0.9786	1.4587	0.5738	0.9306	1.5378	0.4730	0.9039	0.5410
3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF)	0.5551	1.6865	0.3020	0.8773	1.0652	0.4800	NA	1.3475
3-carboxyadipate	0.9818	1.2968	1.1793	1.0804	0.0545	0.3226	0.0678	0.2998
3-(cystein-S-yl)acetaminophen*	0.0165	NA	1.9829	0.0182	NA	NA	NA	NA
3-dehydrocholate	1.3118	0.4528	0.2435	0.4097	0.5034	2.4048	2.8866	0.9424
3-hydroxy-2-ethylpropionate	1.6140	1.5573	NA	0.7910	0.8712	NA	0.9570	0.6712
3-hydroxy-3-methylglutarate	0.9633	0.3654	0.8981	1.5113	0.6893	0.7600	0.8362	2.3786
3-hydroxybutyrate (BHBA)	0.9897	0.5420	0.4155	1.4765	2.3896	1.0870	1.0767	1.7630
3-hydroxycinnamate	0.8316	1.2555	NA	1.1599	NA	0.8536	0.3245	0.7697
3-hydroxydecanoate	0.8632	0.8091	0.9970	0.8916	1.2116	1.6638	1.7043	1.3770
3-hydroxyhexanoate	0.7302	1.2357	0.4866	0.8260	NA	1.4333	1.0192	2.2002
3-hydroxyhippurate	1.5898	0.0461	1.1971	2.2595	0.0404	0.0302	NA	NA
3-hydroxyisobutyrate	0.8429	0.7342	0.9825	0.5455	0.5930	2.7482	1.3297	1.7656
3-hydroxylaurate	0.8596	0.7304	1.2244	0.7602	1.2357	1.7562	1.9954	1.7108
3-hydroxyoctanoate	0.5303	0.5437	0.4357	0.4596	0.4093	4.1239	0.7556	1.1684
3-hydroxypalmitate	0.6962	1.3970	0.4204	1.4005	0.0100	1.0084	1.9872	0.2312
3-hydroxyphenylacetate	0.6914	1.0388	0.7785	0.7655	NA	2.1460	2.1185	1.3438
3-hydroxypyridine	1.3586	0.7815	0.7178	1.3075	0.8556	0.5683	1.9351	0.5309
3-hydroxyquinine	NA	0.0810	NA	NA	NA	1.9616	NA	0.9575
3-hydroxysebacate	1.3538	0.9951	0.9587	1.0126	0.0995	0.9635	0.7978	0.5677
3-hydroxysuberate	0.9400	0.9480	0.8403	1.0651	NA	1.3120	0.5189	1.2588
3-hydroxyvalerate	0.7777	0.6821	NA	0.5405	NA	0.4522	4.0054	0.4002
3-indoxyl sulfate	2.6177	NA	0.4164	1.1490	NA	0.1030	0.0513	0.0326
3-ketosphinganine	0.4704	1.0648	0.4835	1.2152	0.2988	1.4454	0.1699	2.5622
3-methyl-2-oxobutyrate	0.8240	0.6439	1.3591	1.5751	1.2177	0.4227	3.8263	0.3917
3-methyl-2-oxovalerate	0.8012	0.6889	1.3937	1.5968	0.4043	0.5116	1.7303	0.5466
3-methyladipate	1.2912	1.2456	0.6083	1.0486	NA	0.4640	0.0702	0.4999
3-methylglutaconate	1.6666	NA	1.2714	0.4523	NA	1.2631	NA	0.8900
3-methylglutarate/2-methylglutarate	1.0620	1.0905	1.0831	1.0143	0.0519	0.9185	0.2696	0.8494
3-methylhistidine	0.7848	0.8068	0.1286	1.2283	0.3507	2.5593	3.3453	0.6440
3-methylurate*	1.7014	0.5386	2.0325	0.6758	NA	1.0973	0.4840	0.3000
3-methylxanthine	1.6473	0.6597	1.6313	0.6874	NA	0.9176	1.7788	0.4397
3-(N-acetyl-L-cystein-S-yl) acetaminophen	0.6308	0.1320	3.0016	0.8634	NA	0.1136	NA	NA
3-phenylpropionate (hydrocinnamate)	0.8366	1.0162	0.6865	0.9556	1.1752	1.1477	2.1657	1.5634
3-sulfo-L-alanine	0.5755	1.0557	0.7410	1.1162	0.3842	1.1729	1.6012	1.5647
3-ureidopropionate	1.1602	1.1522	0.5930	0.8865	0.5979	1.1378	0.0959	2.0364
4-acetamidobenzoate	0.3819	3.3936	0.2787	0.2851	0.2413	0.1729	0.1111	0.2666
4-acetamidobutanoate	1.3867	0.5594	1.7954	0.5979	0.4729	1.9988	0.6599	1.3486
4-acetamidophenol	1.3039	0.3168	5.7110	0.7408	0.0207	0.2458	NA	0.1406
4-acetamidophenylglucuronide	NA	NA	1.0000	NA	NA	NA	NA	NA
4-acetaminophen sulfate	0.1112	0.0196	3.1619	0.5063	NA	NA	NA	NA
4-cholesten-3-one	1.3749	0.9802	0.8401	1.2700	0.2259	0.6256	0.2387	0.4785
4-ethylphenylsulfate	NA	0.8849	NA	0.4137	0.5845	1.1185	NA	1.9984
4-guanidinobutanoate	1.4348	0.5798	1.0981	0.8505	1.5002	1.5372	1.7252	1.0818
4-hydroxybenzoate	0.8871	0.8664	1.8297	0.7681	1.9649	0.4718	1.3668	0.9470
4-hydroxybenzyl alcohol	1.1598	0.8996	0.7815	1.0137	NA	1.2600	NA	0.8993
4-hydroxychlorothalonil	NA	0.9209	NA	1.1126	1.2820	NA	0.6509	NA
4-hydroxycinnamate	0.3942	0.7348	0.9228	1.7729	4.0528	0.4363	1.4734	0.5277
4-hydroxycyclohexylcarboxylic acid	0.7498	1.3268	1.4515	0.7152	2.0663	0.4715	0.7914	0.2685
4-hydroxyglutamate	1.4521	0.8930	0.9073	0.8892	NA	1.0336	0.4292	1.2443
4-hydroxyhippurate	1.0570	0.1198	1.9526	1.3644	0.5938	0.3661	NA	1.6499
4-hydroxyphenylacetate	2.6616	0.8802	1.1367	0.5075	0.6349	1.1117	0.6124	0.4940
4-hydroxyphenylpyruvate	0.7311	0.8250	1.0730	1.4110	0.8677	0.7211	2.1351	0.8178
4-imidazoleacetate	1.1985	1.0293	0.6666	0.9446	0.3961	1.5815	0.5606	1.3112
4-methyl-2-oxopentanoate	0.7262	0.8990	1.1529	1.4456	0.4407	0.8094	1.0103	0.7615
4-methylcatechol sulfate	0.3577	0.8478	0.5291	1.8298	NA	1.0376	NA	0.8314
4-methylthio-2-oxobutanoate	0.5261	0.7958	4.0502	1.3819	0.2436	0.2451	1.5774	0.7378
4-oxo-retinoic acid	0.8837	1.1815	1.1279	0.9386	NA	0.4543	NA	0.5925
4-ureidobutyrate	0.8101	1.2202	0.8274	0.8509	0.7700	1.0192	2.4408	0.9619
5-(2-Hydroxyethyl)-4-methylthiazole	0.7133	1.0171	3.4143	0.5208	0.2989	0.2433	0.3827	1.8342
5-acetylamino-6-amino-3-methyluracil	0.8814	1.2248	0.7207	1.3102	NA	0.2169	0.4310	0.4465
5-acetylamino-6-formylamino-3-methyluracil	1.2182	1.4202	0.6034	1.1067	0.1173	0.2229	1.2888	0.4658
5alpha-androstan-3alpha,17alpha-diol disulfate	0.6822	1.0953	0.4818	1.1144	0.7111	1.6940	0.8980	0.9767
5alpha-androstan-3alpha,17alpha-diol monosulfate	0.5883	0.8837	0.3784	1.3296	0.5155	1.6933	0.5914	1.3902
5alpha-androstan-3alpha,17beta-diol disulfate	2.2314	0.6866	0.9216	0.6437	1.1705	1.8866	1.4572	0.8053
5alpha-androstan-3alpha,17beta-diol monosulfate (1)	0.5974	0.6438	0.4562	1.0264	0.3733	2.6917	0.3892	1.5265
5alpha-androstan-3beta,17alpha-diol disulfate	1.2815	1.0393	0.3527	1.3856	NA	1.0039	NA	0.6321
5alpha-androstan-3beta,17alpha-diol monosulfate (1)	0.8609	1.3000	1.2584	0.9387	NA	0.4456	NA	0.6666
5alpha-androstan-3beta,17alpha-diol monosulfate (2)	1.5005	1.3677	0.3873	1.0284	NA	0.3668	NA	1.1021
5alpha-androstan-3beta,17beta-diol disulfate	1.3090	1.1643	0.6849	0.8289	0.6699	1.2698	0.7820	1.1742
5alpha-androstan-3beta,17beta-diol monosulfate (1)	1.0805	1.1436	0.6035	1.0601	NA	0.6120	NA	1.0567
5alpha-androstan-3beta,17beta-diol monosulfate (2)	0.5720	0.9406	0.4132	1.2823	0.7167	1.7288	0.4754	1.0355
5alpha-pregnan-3(alpha or beta),20beta-diol disulfate	0.1965	2.0765	1.5636	0.5336	0.0132	0.1636	0.0247	0.0927
5alpha-pregnan-3beta,20alpha-diol disulfate	1.4225	1.6210	1.2486	0.6168	0.0913	0.3106	0.1033	0.2217
5alpha-pregnan-3beta,20alpha-diol monosulfate (1)	1.8684	1.1191	1.1421	0.5295	NA	0.1783	NA	0.2877
5alpha-pregnan-3beta,20alpha-diol monosulfate (2)	0.8097	2.0933	0.5569	1.1686	NA	0.1607	NA	0.1099
5alpha-pregnan-3beta,20beta-diol monosulfate (1)	0.2255	1.9741	0.3769	1.5027	0.0497	0.5790	0.0814	0.3131
5alpha-pregnan-3beta-ol,20-one sulfate	0.7651	1.9581	0.7428	0.5856	NA	0.8165	NA	0.8276
5-aminovalerate	0.9648	0.4636	0.6762	0.7550	4.8144	1.9201	0.4189	2.8771
5-dodecenoate (12:1n7)	0.3555	0.7602	1.4600	0.9140	0.5710	1.6980	2.5269	1.3727
5-hydroxy-2-indolecarboxylic acid	NA	1.2800	0.0409	1.6791	NA	NA	NA	NA
5-hydroxyhexanoate	1.1169	1.0488	1.4544	0.9195	0.1437	0.3651	0.7280	1.2665
5-hydroxylysine	4.3660	0.4412	0.4404	0.7887	0.4063	0.5815	1.0712	1.0260
5-hydroxymethylfurfural	0.9413	1.5754	0.8802	0.8060	NA	0.3062	0.4834	0.7811
5-methylthioadenosine (MTA)	0.8932	0.6736	0.9712	0.8895	1.2723	1.6758	1.2748	1.4865
5-methyluridine (ribothymidine)	0.6811	1.1318	1.1946	0.7541	0.9022	1.1891	2.0609	0.9324
5-oxoproline	0.7930	1.0594	1.3655	0.9178	1.0368	0.7598	1.1068	0.8750
6-hydroxynicotinate	3.5031	0.3103	0.4450	0.6345	0.3166	0.8645	0.4095	0.9102
6-oxolithocholate	0.7178	1.2330	1.0102	1.1041	0.4722	0.5510	1.4973	0.6015
6-oxopiperidine-2-carboxylate	0.9856	1.1305	1.0010	0.8449	1.1380	0.8844	1.1545	1.0652
7-ketocholesterol	1.0788	1.0557	0.7091	1.1892	0.7106	0.7224	1.1373	0.7817
7-ketodeoxycholate	1.1754	0.1926	0.2911	0.2323	0.6586	6.3707	0.6019	2.5644
7-ketolithocholate	1.7549	0.3201	1.0891	0.4141	1.3058	4.6190	1.2450	0.8360
7-methylguanine	0.7319	0.9185	1.0231	0.9299	0.4590	1.9232	0.8210	1.6646
7-methylurate	1.7498	0.5431	1.1177	0.4114	NA	1.5822	1.9773	1.7798
7-methylxanthine	1.5380	0.5825	1.1218	0.9097	NA	0.8632	1.6119	1.0954
8-hydroxyguanine	1.1615	0.6262	0.6137	1.2178	0.6816	0.8666	3.7660	0.7762
8-hydroxyoctanoate	0.8684	0.9431	0.9347	1.0629	2.0441	0.7173	0.8837	1.1118
9,10-DiHOME	0.6943	1.0303	0.4752	1.2722	1.6346	0.9992	1.0827	0.8860
acesulfame	0.2066	1.9111	0.1410	1.4175	0.1461	0.0593	1.4829	0.0745
acetylcarnitine (C2)	0.1308	0.0810	4.2001	0.1667	0.3784	0.9000	0.0939	2.1054
acisoga	1.2985	0.7449	1.1026	0.9848	1.0147	1.0684	1.2962	0.9895
adenine	2.1052	0.7947	0.6780	0.8210	1.1373	1.1902	0.6705	0.6776
adenosine	0.7626	0.8908	0.9922	0.6339	1.0095	3.0784	1.6975	1.3184
adenosine-2^,3^-cyclic monophosphate	NA	1.7433	0.0621	1.4032	NA	NA	NA	0.0480
adenosine 5^-monophosphate (AMP)	0.6901	1.0201	0.8372	1.4676	1.3728	0.4409	0.7558	0.4620
adipate (C6-DC)	0.6476	0.9762	0.4701	1.2002	0.0259	3.3705	0.3426	0.6139
agmatine	0.6203	0.2815	0.2792	1.0133	7.8930	0.3836	1.0340	1.4421
alanine	0.7777	0.9446	0.9356	0.8138	1.9099	1.2582	1.8478	1.6672
alanylleucine	1.0747	0.9391	0.5545	1.1952	2.0465	0.6209	1.2056	1.0754
allantoin	0.1384	0.4195	2.7847	0.3175	1.0715	0.4111	0.8503	3.7145
allo-threonine	1.8765	0.9561	0.6878	0.9774	0.9233	0.4050	0.5718	1.2774
alpha-CEHC sulfate	0.7262	0.6555	1.1541	0.9891	NA	1.4748	NA	1.2616
alpha-hydroxyisocaproate	0.0938	3.3423	0.1014	0.2251	0.6710	0.0800	0.7980	2.4649
alpha-hydroxyisovalerate	0.2803	2.1622	0.3548	0.3847	0.7245	0.3140	2.8170	1.8663
alpha-ketoglutarate	1.0199	0.7613	1.1895	1.2321	0.4815	0.9207	1.1760	0.7569
alpha-methylornithine	0.7086	1.1642	0.7545	0.9771	2.3236	0.7636	1.5157	0.8952
alpha-tocopherol	1.4619	0.9671	1.2291	0.8891	0.2158	0.8603	0.4261	0.7386
alpha-tocopherol acetate	3.3630	0.0103	2.2496	0.0467	NA	0.0295	0.0010	0.0020
alpha-tocotrienol	1.1937	1.2008	1.0119	0.8896	0.3736	0.6737	0.6592	0.9374
androstenediol (3alpha, 17alpha) monosulfate (2)	2.2003	1.3764	0.5248	1.0313	NA	0.2551	0.1229	0.2213
androstenediol (3beta,17beta) disulfate (1)	1.0519	0.7112	0.5237	0.7321	0.3963	2.0863	0.3944	2.6684
androstenediol (3beta,17beta) disulfate (2)	0.7764	0.9920	0.4583	1.1347	0.4549	1.7918	0.5832	1.8680
androstenediol (3beta,17beta) monosulfate (1)	0.5382	1.4965	0.2665	1.4212	0.1092	1.9166	0.1764	1.1699
androstenediol (3beta,17beta) monosulfate (2)	3.1708	1.2818	0.2930	0.5279	NA	NA	NA	0.0835
androsterone sulfate	0.9788	1.0605	0.3046	1.2872	0.8475	1.6825	0.9328	1.0827
anserine	1.3457	0.9590	0.2858	0.7903	0.3808	2.1739	3.5535	0.6671
anthranilate	0.5880	1.0959	0.9591	1.0749	NA	0.8101	NA	NA
apigenin	0.8647	0.1727	0.1626	0.2436	1.0173	0.5842	0.2943	5.8130
arabinose	1.1522	0.5447	1.2025	1.2659	0.9278	0.4813	0.7492	1.7789
arabitol/xylitol	0.6644	0.4147	2.2939	1.0133	0.8834	0.3993	0.4350	1.3303
arabonate/xylonate	0.2441	0.1290	4.8284	0.1549	0.8046	0.2795	0.2991	2.2098
arachidate (20:0)	0.8657	0.9342	0.9468	1.1062	0.9377	0.2650	4.7024	0.2020
arachidonate (20:4n6)	0.5502	0.9786	0.9943	0.9893	1.0181	1.3963	3.4389	0.6583
arachidoylcarnitine (C20)*	1.0738	1.0220	0.9414	1.0458	0.1979	1.4849	0.7207	0.7638
arachidoyl ethanolamide (20:0)*	0.8629	1.1049	0.9275	1.2439	0.7880	0.6216	0.8813	0.5588
argininate*	0.6205	0.6830	0.8065	0.6637	3.0982	1.0528	4.3719	2.5004
arginine	0.8700	0.2883	1.7957	0.6566	6.4761	0.5245	2.5704	1.0359
argininosuccinate	1.3139	0.4338	1.1144	0.6209	3.1652	0.4137	1.4425	0.3427
asparagine	0.9542	0.8382	1.4851	0.4825	0.4893	1.9106	2.5473	1.5296
aspartate	0.8420	0.9416	1.1638	0.9225	1.0123	1.3224	0.9198	1.3086
atenolol	NA	NA	NA	NA	NA	0.9407	NA	1.0593
azelate (C9-DC)	1.2117	1.0457	1.1441	1.0674	0.2469	0.5566	0.2552	0.7937
azithromycin	NA	0.4441	NA	1.8053	NA	NA	NA	0.0023
behenate (22:0)*	0.8177	0.8528	0.6167	1.2041	5.0674	0.2790	1.7674	0.1908
behenoylcarnitine (C22)*	1.1187	1.0695	1.0271	1.0195	0.3953	1.1582	0.4375	0.6676
behenoyl ethanolamide (22:0)*	1.0474	1.0275	0.9303	1.2302	0.8979	0.4734	0.8745	0.5974
benzoate	0.7582	0.9722	0.7874	1.2222	1.0736	1.0503	0.9142	1.0431
benzoylecgonine	NA	0.5186	0.0148	2.4666	NA	NA	NA	NA
berberine	3.9118	0.0422	NA	0.0039	NA	NA	NA	NA
beta-alanine	1.8315	1.0446	0.6389	0.7611	0.6634	0.9872	0.6693	1.0447
beta-cryptoxanthin	0.5739	1.5948	1.0055	0.8304	0.1047	0.5426	0.1553	1.4257
beta-guanidinopropanoate	1.3638	1.1932	0.7178	0.8669	0.6361	0.8448	0.9855	0.8916
beta-hydroxyisovalerate	1.2210	0.8974	1.2179	0.7219	0.6476	1.6144	0.6403	1.3321
betaine	0.3494	0.4264	2.5764	0.4492	4.0667	0.3442	0.6371	3.0493
beta-muricholate	1.1379	1.1260	0.9709	1.1269	0.1456	0.4804	0.0497	0.5580
beta-sitosterol	1.3423	0.9343	0.8656	1.0357	0.6835	0.8576	1.2050	0.8135
bilirubin (E,E)*	0.8644	1.0343	0.6634	1.1153	0.8471	1.7571	NA	0.8184
bilirubin (E,Z or Z,E)*	0.7747	0.8162	1.3949	0.8706	0.7804	1.3518	0.2900	1.4183
bilirubin (Z,Z)	1.2009	0.9655	0.7145	1.1322	1.2007	1.1060	0.0450	1.0430
biliverdin	1.3310	0.9668	0.9661	0.9339	1.1169	1.0806	0.1344	0.7526
biochanin A	1.1074	NA	0.1172	1.3224	0.5691	NA	1.1326	NA
biotin	0.9229	1.3139	0.6380	1.1416	0.5620	0.4527	0.8445	0.5168
bufotenine	NA	0.3803	NA	2.4551	NA	0.1673	NA	0.8895
butyrylglutamine/isobutyrylglutamine	0.8915	0.8982	0.6088	1.0135	1.3921	1.3403	1.2889	1.8021
butyrylglycine	3.0901	0.4375	NA	1.0975	1.0023	NA	NA	1.1649
cadaverine	3.2597	0.2738	1.8887	0.1858	0.4993	0.3196	2.0369	0.4733
caffeate	0.7342	1.4728	1.1481	0.8081	0.1917	1.0123	NA	0.2066
caffeic acid sulfate	0.1267	1.5692	1.2600	1.0510	NA	NA	NA	0.1130
caffeine	0.6643	0.9665	1.0215	1.3308	0.0763	0.8881	0.5158	1.4989
campesterol	1.1969	1.0078	0.7874	1.0721	0.5701	0.8823	1.3855	0.8197
caprate (10:0)	1.4280	0.5949	1.8160	0.5948	0.3597	1.4222	1.8815	0.9932
caproate (6:0)	0.5984	0.6562	0.4799	1.4712	0.4718	0.6735	2.1139	2.6963
caprylate (8:0)	2.4004	0.4721	2.2773	0.3320	NA	0.7756	0.5802	0.2492
capsaicin	0.2578	0.3036	NA	1.4795	NA	NA	NA	NA
carboxyethyl-GABA	0.7162	0.9918	0.7608	1.1844	0.6775	1.4131	0.7067	1.4093
carboxyibuprofen	0.8574	0.9113	1.9808	1.1647	0.8659	NA	0.1648	0.2994
carnitine	0.6477	0.6509	2.6412	0.7468	0.3505	0.9528	0.6606	1.0298
carnosine	0.4102	0.4038	0.1732	0.3665	NA	4.7905	1.2428	3.3155
carotene diol (1)	1.1775	1.2790	0.6202	1.0504	0.2745	0.4892	0.5004	1.1469
carotene diol (2)	1.1876	1.2343	0.8904	1.0105	0.3202	0.4808	0.3671	0.8789
carotene diol (3)	1.1748	1.2816	0.8401	1.0466	0.1478	0.4808	0.2226	0.8354
catechol sulfate	0.5529	1.0496	1.8274	1.3721	NA	0.3575	0.2177	0.2300
ceramide (d16:1/24:1, d18:1/22:1)*	0.7577	0.7479	0.5703	1.1206	1.4982	1.2035	1.7554	1.7967
ceramide (d18:1/14:0, d16:1/16:0)*	0.5337	0.9790	0.7169	1.2345	0.9755	1.0484	1.5739	1.5896
ceramide (d18:1/17:0, d17:1/18:0)*	0.7427	1.0651	0.6224	1.1835	0.7881	0.8436	1.5848	1.1670
ceramide (d18:1/20:0, d16:1/22:0, d20:1/18:0)*	0.8993	0.9166	0.6652	1.1072	0.4710	0.8934	3.2010	1.1242
ceramide (d18:2/24:1, d18:1/24:2)*	0.9155	0.7823	0.6153	0.9753	1.9870	0.7538	4.0478	1.1494
cerotoylcarnitine (C26)*	1.0037	1.1338	0.8465	1.1164	0.5650	0.6766	0.7499	0.9709
cetirizine	NA	1.5167	0.7320	0.8757	NA	NA	NA	NA
chenodeoxycholate	0.4024	NA	0.2010	0.7045	1.0185	2.2319	1.6184	1.9879
chiro-inositol	0.4614	2.1737	0.9216	0.1662	0.7927	0.1919	0.1045	2.3012
cholate	0.5304	0.1497	0.0923	0.4911	1.9618	4.8182	6.2784	4.2391
cholate sulfate	1.3077	1.5882	0.4717	1.1966	0.0480	0.8621	0.3860	0.3714
cholesterol	1.0034	0.9813	0.9783	1.2472	0.4969	0.6828	0.9033	0.6345
choline	0.9949	0.6858	1.0393	0.9691	2.3048	1.1561	2.2185	1.0496
choline phosphate	0.7275	0.3039	1.2258	1.2320	6.7927	0.2635	0.9050	0.8745
chrysoeriol	0.1310	0.0693	NA	0.4184	1.4237	NA	0.1413	4.5559
ciliatine (2-aminoethylphosphonate)	0.8476	0.5641	0.9124	0.9323	0.4255	7.8279	0.3041	NA
cinnamate	1.3259	0.4892	1.6448	1.9676	0.5195	0.6445	0.3613	1.0380
cis-4-hydroxycyclohexylacetic acid	0.6468	1.1614	0.7903	1.0460	1.0434	1.1229	1.0552	1.5035
cis-urocanate	0.8438	0.9747	1.3325	0.9173	1.0627	1.1302	1.0877	0.8780
citrate	0.3581	0.1733	4.4491	0.2727	0.0762	0.5069	0.0841	0.3104
citrulline	0.7497	1.0677	0.7380	0.9387	1.4818	1.3944	1.6174	1.3080
coprostanol	0.7172	1.5960	0.8663	0.9558	NA	0.5066	0.1097	0.4693
creatine	0.2934	0.0751	2.5074	0.5675	4.1924	0.7125	2.0638	3.2655
creatinine	1.7098	0.1999	1.0430	0.9021	1.7531	0.2938	4.1064	1.9353
curcumin	0.0074	0.1421	NA	3.7083	NA	NA	NA	NA
cysteine	0.9868	0.7779	1.5020	0.8166	0.3761	1.2223	0.7384	1.8232
cysteine s-sulfate	0.8952	0.9324	1.1445	0.8938	0.4444	1.3445	1.3115	1.4790
cysteine sulfinic acid	1.0090	0.8133	1.0950	0.8251	1.1870	1.2310	1.4240	1.5449
cysteinylglycine	1.2857	0.6432	0.8540	0.7525	1.4145	1.3414	0.3484	1.9546
cystine	0.3451	0.2050	5.0136	0.2795	0.4254	0.3632	1.0917	0.3792
cytidine	0.9958	0.5787	1.5735	0.5083	0.4050	2.9255	1.6544	1.7304
cytidine 2^,3^-cyclic monophosphate	0.9606	0.7621	0.9882	0.8122	3.9317	0.9107	2.3459	1.0454
cytosine	1.2040	0.7014	0.9886	0.9373	0.8283	1.5737	0.5779	1.8088
daidzein	0.6725	0.5238	0.9178	0.6784	1.0362	2.9822	0.2030	4.2531
dehydroisoandrosterone sulfate (DHEA-S)	0.7593	1.2109	0.3837	0.9570	0.7337	1.8194	0.9333	1.9399
dehydrolithocholate	0.9388	0.5973	0.6731	1.2943	3.1611	0.7914	5.0197	0.9836
delta-tocopherol	0.7662	1.2729	0.9276	1.1530	0.1742	0.8147	0.4488	0.7226
deoxycarnitine	1.1633	0.7725	1.1949	0.9046	1.0686	1.5601	0.6308	1.1478
deoxycholate	0.6726	1.0595	0.7836	0.9960	2.6586	1.0671	2.6853	1.2259
deoxycholic acid sulfate	0.5213	0.9309	0.3731	2.0113	NA	0.5174	0.0002	0.3835
deoxymugineic acid	1.6728	1.2649	1.2082	0.7102	0.6319	0.4754	0.5120	0.4844
dexlansoprazole	NA	0.0796	NA	0.3425	NA	2.2147	NA	2.2836
dexpanthenol	NA	NA	NA	NA	NA	NA	NA	NA
dextromethorphan	0.3576	NA	NA	1.0585	NA	NA	1.5255	NA
diacetylchitobiose	0.2925	0.9377	0.2776	1.4466	NA	NA	NA	2.2602
diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1])*	0.7494	0.6335	1.8749	1.3000	0.7721	0.5539	0.4140	0.7436
diaminopimelate	0.8024	0.9362	0.7377	0.7066	0.6035	1.3977	1.4009	2.9728
diethanolamine	NA	NA	NA	1.0000	NA	NA	NA	NA
digalacturonic acid	2.2253	0.7741	0.9745	0.6753	NA	0.5030	0.0884	1.1048
diglycerol	0.6325	1.0667	0.4991	1.7057	0.4006	0.6368	0.5121	0.6020
dihomo-linoleate (20:2n6)	0.3873	0.9900	0.6213	1.0386	0.6963	2.3366	4.3998	0.4653
dihomo-linolenate (20:3n3 or n6)	0.7423	1.3962	0.5211	1.0242	1.0693	1.4261	1.3789	0.4333
dihomo-linolenoylcarnitine (20:3n3 or 6)*	0.7829	1.0243	0.8157	0.9392	2.1720	1.1729	2.3812	1.4901
dihydoxyphenylalanine (L-DOPA)	0.9262	0.8977	2.0919	0.9654	0.1726	0.5366	0.3339	0.8737
dihydrocaffeate	0.9971	0.9769	0.9984	0.9987	1.7790	1.3566	0.5875	0.5803
dihydroferulic acid	0.8271	0.8702	0.7836	1.0251	0.5262	0.7144	0.6374	3.0612
dihydroorotate	1.1126	1.1301	0.4444	1.5229	0.1245	0.2214	0.3270	0.4556
dimethylarginine (SDMA + ADMA)	0.9048	0.6322	1.0535	0.8361	2.1008	1.2838	1.7850	2.0453
dimethylglycine	1.3674	0.9005	0.9014	1.0106	0.9160	0.7430	1.2940	0.8803
dimethylmalonic acid	1.0765	0.9497	1.1087	0.9515	NA	0.9206	NA	1.0443
diosmetin	0.3437	NA	NA	1.4926	0.4030	0.1363	0.1159	2.0812
diosmin	NA	NA	0.9527	1.0473	NA	NA	NA	NA
diphenhydramine	1.6016	0.7141	0.5587	0.4152	0.0344	9.1392	NA	0.1675
dipicolinate	1.3819	1.1769	1.0588	0.9338	NA	0.3753	0.1185	0.4655
docosadienoate (22:2n6)	0.9884	1.2829	0.9971	1.0459	0.3210	0.2696	1.7756	0.2388
docosahexaenoate (DHA; 22:6n3)	0.4453	0.9655	0.6341	0.9381	1.5110	0.6529	6.7106	0.8157
docosapentaenoate (n3 DPA; 22:5n3)	0.4355	0.8501	0.4175	1.4965	0.3463	1.2781	3.5009	0.9755
dodecanedioate (C12-DC)	2.2631	1.1062	0.8218	0.5818	0.2402	0.6673	0.3357	0.7363
dopamine	1.0650	1.0394	1.4289	1.0139	0.2354	0.6127	0.5508	0.5197
dopamine 3-O-sulfate	NA	0.3541	3.6889	0.7182	NA	NA	NA	0.1667
D-urobilin	1.1341	0.9401	0.9081	0.8407	0.5749	1.4026	0.4907	1.9071
ectoine	1.2657	0.6812	0.5020	1.2271	0.7956	0.6003	1.6607	2.2219
eicosanoylsphingosine (d20:1)*	0.7954	0.9940	0.8653	0.9375	0.5500	1.3994	0.2511	2.2544
eicosapentaenoate (EPA; 20:5n3)	0.2006	2.6937	0.3347	0.2905	0.2083	0.4495	1.6088	0.4109
eicosenoate (20:1)	0.6467	0.9384	1.0114	0.9883	1.1768	0.7786	4.7861	0.4243
enterodiol	0.2460	1.7607	0.4077	1.4284	0.3078	0.3795	0.4893	0.1255
enterolactone	0.4113	1.4115	0.7875	1.3778	0.0878	0.8588	0.1637	0.4134
epiandrosterone sulfate	1.0714	1.6452	0.3747	1.1019	0.6355	1.0239	1.0677	0.7635
epicatechin	2.1620	0.4079	0.8428	0.2994	NA	1.1032	0.3221	2.1863
ergosterol	0.4688	0.9200	0.4662	1.9158	0.5834	0.3474	0.1790	1.0871
eriodictyol	0.9428	0.4151	NA	NA	0.3278	2.3714	NA	NA
erucate (22:1n9)	0.4925	1.0237	0.3750	1.4366	0.3908	2.4122	1.8006	0.2520
erucoylcarnitine (C22:1)*	0.9269	0.9937	1.0748	1.0147	0.1691	1.4469	0.9670	0.7403
erythronate*	0.7994	0.7571	1.6163	0.7040	1.5077	0.8200	1.6730	1.9753
erythrose	0.7966	0.7536	2.1247	0.9642	0.7052	0.5005	0.3735	1.0258
escitalopram	1.5134	0.5602	1.1462	0.7802	NA	NA	NA	NA
ethylmalonate	1.8217	0.8045	1.1613	0.8314	0.0524	0.8099	0.2491	1.0322
famotidine	NA	1.0000	NA	NA	NA	NA	NA	NA
fenofibrate	NA	NA	NA	1.0000	NA	NA	NA	NA
ferulate	0.6648	0.9353	0.9359	1.3376	0.4474	0.8462	1.0479	1.1881
ferulic acid 4-sulfate	NA	0.2582	5.4934	0.0438	0.0630	0.0771	NA	0.0646
feruloylputrescine	0.5227	0.9141	0.6006	0.4878	1.0700	4.3713	0.7242	1.1350
fexofenadine	2.9987	NA	0.0007	NA	NA	NA	NA	NA
flavin mononucleotide (FMN)	1.2263	0.9812	0.7592	1.0796	NA	0.6114	NA	0.8193
formiminoglutamate	0.8636	1.1408	0.8116	0.9177	2.4400	0.8074	1.5535	1.1045
fructose	0.6093	0.5397	2.9170	0.4995	0.5090	1.0244	0.5390	1.7467
fucitol	0.7787	3.9572	1.7205	0.5680	0.8010	0.4847	0.4084	1.2229
fucose	0.9321	0.8250	1.0198	1.1331	1.1305	0.9010	1.0893	1.2974
fumarate	1.2212	0.9070	1.2304	0.8883	0.0955	1.0147	0.0896	1.2312
furaneol sulfate	0.4525	1.0064	0.8752	0.9708	0.2660	1.1134	NA	2.8245
gabapentin	0.4146	NA	2.3781	0.0000	NA	NA	NA	NA
galactonate	0.2849	0.1945	2.8478	0.2761	0.3263	1.1240	0.0794	5.7767
galacturonate	1.3481	0.5194	2.2644	0.9328	0.0907	0.4687	0.4338	0.7032
gamma-CEHC	1.3612	0.7498	0.8839	0.8926	1.5762	0.8069	1.8539	1.2343
gamma-glutamylalanine	0.4794	0.5441	0.6208	1.0116	8.0481	0.6750	2.9784	0.8582
gamma-glutamyl-alpha-lysine	0.7157	0.8200	0.7393	1.0337	2.3657	1.4575	1.3980	1.6816
gamma-glutamyl-epsilon-lysine	0.6636	0.8979	1.1030	0.8198	0.9105	2.0081	1.0641	1.8583
gamma-glutamylglutamate	1.0908	0.7474	0.8440	0.9146	3.5874	1.2726	2.9142	1.2859
gamma-glutamylglutamine	0.5858	0.5144	1.6044	0.7742	2.3265	0.9440	1.2039	1.2933
gamma-glutamylglycine	1.2936	0.2539	1.1888	0.7426	0.5850	NA	0.2845	3.3787
gamma-glutamylhistidine	0.6527	0.9860	1.1694	0.4832	3.8684	0.6650	4.4284	1.2892
gamma-glutamylisoleucine*	0.3512	0.3903	3.3320	0.5333	1.2767	0.3782	0.5485	1.5736
gamma-glutamylleucine	0.8799	0.9522	0.8652	0.8881	1.2716	1.4895	2.8596	1.3335
gamma-glutamylmethionine	1.5524	0.6465	0.7758	0.7240	1.2197	1.1863	0.9220	2.2932
gamma-glutamylphenylalanine	0.5323	0.8513	0.9088	0.9059	2.7200	0.6404	3.0807	2.1999
gamma-glutamyltyrosine	0.6745	0.8868	0.9413	0.9444	3.3291	0.9959	0.6462	1.9683
gamma-tocopherol/beta-tocopherol	0.8345	1.2901	0.9116	1.1481	0.2036	0.6472	0.4856	0.6710
gamma-tocotrienol	1.1397	1.2363	0.8694	0.9321	0.5000	0.7136	0.8349	0.8383
genistein	0.9746	0.2090	1.3267	0.4679	0.9972	1.5028	0.2437	3.3848
gentisate	1.3589	0.7670	1.1730	0.6034	0.8665	1.5145	0.7842	1.8247
gentisic acid-5-glucoside	NA	0.6275	1.2129	NA	NA	NA	NA	0.9467
gluconate	0.7464	0.3484	3.8647	0.3882	0.3832	0.6825	0.1685	1.1990
glucose	0.7245	0.8237	1.5214	0.8126	1.4623	1.7904	0.4913	1.2545
glucuronate	0.5539	0.3743	3.6496	0.7303	1.0515	0.6241	0.3198	0.8728
glutamate	0.9224	0.9636	1.1086	0.9651	0.5351	1.3075	0.7461	1.2950
glutamate, gamma-methyl ester	1.0708	0.9138	1.1246	1.0305	0.6301	0.8977	0.5452	1.3116
glutamine	0.8096	0.8560	1.1735	0.7920	1.7248	1.3258	2.2663	1.3052
glutaminylleucine	0.8006	0.9719	0.6565	1.0492	1.9849	1.5454	1.0726	1.1882
glutamyl-meso-diaminopimelate	0.8534	1.1942	0.7357	1.8782	NA	0.6470	1.0107	0.8484
glutarate (C5-DC)	0.6313	1.0190	2.0531	0.8121	0.0854	1.2480	0.3866	0.8285
glycerate	0.8448	0.7493	1.3933	0.8931	1.0781	1.2775	1.8174	1.2886
glycerol	0.9008	0.6754	1.1479	0.8748	4.2820	0.3591	3.2925	0.6743
glycerol 3-phosphate	1.2095	0.8643	1.0299	1.2332	1.5613	0.4519	0.4299	0.5153
glycerophosphoethanolamine	1.0896	0.6252	1.1179	1.0370	1.9041	1.1187	0.6880	1.5864
glycerophosphoglycerol	0.8740	0.9384	1.0018	1.0250	1.2487	1.0621	0.6998	1.4391
glycerophosphoinositol*	0.9520	0.5342	1.0033	1.4162	1.1727	0.9702	1.1400	1.2248
glycerophosphorylcholine (GPC)	1.5568	0.6399	1.2832	0.7730	1.7071	0.4401	0.8609	1.9636
glycerophosphoserine*	0.7056	0.5607	1.1518	0.7074	2.4504	1.3103	1.4564	2.4350
glycine	0.6993	0.8038	1.4681	0.8899	1.3845	1.1313	1.6961	1.2882
glycitein	0.1235	0.5241	NA	NA	0.8041	1.0031	NA	1.8689
glycochenodeoxycholate	0.0357	0.0807	5.8006	0.1762	0.5819	0.1300	0.1374	0.1354
glycocholate	0.0190	0.0472	5.7162	0.1000	0.0139	0.0532	0.0121	0.0533
glycocholenate sulfate*	0.5068	0.0686	4.0328	0.0893	0.2625	1.1406	0.0129	0.7993
glycodeoxycholate	0.1248	0.1627	5.1818	0.3469	0.6303	0.1998	0.1489	0.1278
glycolithocholate sulfate*	0.4456	0.1483	5.0755	0.1181	0.0493	0.2504	0.0515	0.3094
glycosyl ceramide (d18:1/20:0, d16:1/22:0)*	0.9216	1.0528	1.8463	0.9964	NA	0.3306	1.5990	0.2902
glycosyl-N-palmitoyl-sphingosine (d18:1/16:0)	0.9041	1.0051	1.0214	1.2535	0.7604	0.6864	0.8915	0.5567
glycosyl-N-stearoyl-sphingosine (d18:1/18:0)	0.9467	1.4607	0.6942	0.9213	0.1619	0.4849	4.5982	0.2439
glycoursodeoxycholate	0.0513	0.2372	4.8522	0.2743	0.2266	0.2516	0.1100	0.1846
glycylisoleucine	0.9027	0.9754	0.7227	1.0479	1.0701	1.3116	1.7527	1.0840
glycylleucine	0.9150	0.8781	0.6266	1.0999	1.5835	1.3603	1.7428	1.2215
glycylvaline	0.7942	0.9799	0.7514	0.9247	0.9759	1.7578	1.6688	1.4848
glycyrrhetinate	0.3183	0.0759	NA	NA	2.3455	NA	3.5479	NA
guanidinoacetate	0.8899	0.2513	1.4772	0.9306	4.3720	0.1945	0.7662	1.9655
guanine	0.8401	0.7906	1.1998	0.7055	0.7761	2.3932	1.8133	1.4799
guanosine	0.7485	0.7623	1.0700	0.4531	0.5217	3.4884	2.1444	1.7011
guanosine-2^,3^-cyclic monophosphate	0.9359	1.3813	0.5802	0.8560	NA	NA	0.3800	0.4012
harmane	2.2612	1.1158	0.8801	0.5974	NA	0.9090	1.5522	0.7498
heme	1.2021	1.0115	0.6647	1.0789	0.1918	1.6313	0.1506	0.9840
heptadecasphingosine (d17:1)	0.3695	1.1171	0.4219	1.3978	0.2892	1.2333	0.3345	2.0702
heptanoate (7:0)	1.0903	0.9609	0.7113	1.0437	0.1031	0.3086	3.3602	2.3129
hesperetin	0.6393	0.1035	1.0760	0.1480	0.2308	0.6331	0.0946	4.8938
hesperidin	0.2763	NA	1.9601	0.0331	NA	NA	NA	1.7439
hexadecadienoate (16:2n6)	0.5872	1.2635	0.6334	1.0925	0.3690	0.7176	2.8607	1.0138
hexadecanedioate (C16-DC)	0.8021	1.1674	0.6947	1.0484	0.3320	1.3633	0.2663	1.4575
hexadecasphinganine (d16:0)*	0.6038	1.0975	0.5958	1.1617	0.5330	1.6739	0.7157	1.5362
hexadecasphingosine (d16:1)*	0.3347	0.7912	1.0688	1.3036	0.4296	1.5459	0.7560	1.4002
hexadecatrienoate (16:3n3)	0.9084	1.3776	0.2891	1.2123	0.2586	0.3924	1.6769	0.5221
hexanoylglycine	0.4633	NA	0.2970	2.1052	NA	NA	0.7324	NA
hippurate	0.9036	0.0460	0.1960	3.0439	0.1796	0.0082	0.0136	0.0105
histamine	1.1873	0.9001	1.2566	1.0145	0.2346	1.0176	1.1622	0.6035
histidine	0.6893	0.7877	1.2645	0.7260	3.7509	1.1857	1.9650	1.2598
histidylalanine	0.6007	1.1414	0.5660	1.1644	1.8046	1.0148	2.0921	0.3194
homocitrulline	1.2388	1.0380	0.9474	0.9452	0.2549	0.9924	0.4282	1.4787
homovanillate sulfate	0.2895	2.0218	0.8304	0.7869	0.6329	0.2695	NA	0.1257
hydantoin-5-propionic acid	0.8057	0.9144	0.8696	1.2330	0.3069	1.2176	0.7228	1.1062
hydrochlorothiazide	0.1041	1.3466	0.5793	1.6234	NA	NA	NA	NA
hydroxymethylpyrimidine	0.7127	1.5906	0.9691	0.8105	0.4635	0.2893	0.6466	1.1848
hyocholate	0.9605	0.7360	0.7236	0.9789	1.1900	1.5875	4.7104	1.2944
hypoxanthine	0.8783	1.0921	1.0223	0.9562	1.0417	0.9704	0.9009	1.0896
ibuprofen	0.6502	1.2885	1.0961	1.0738	1.7972	NA	0.3169	0.1188
imidazole lactate	0.6281	0.5614	1.3410	0.7621	3.8483	1.0764	0.6092	2.3688
imidazole propionate	1.9745	0.6053	0.6962	0.5270	0.7365	1.1625	1.4826	2.9561
indole	1.1649	1.1455	1.8111	0.7138	NA	0.6483	NA	0.3603
indole-3-acetamide	NA	1.8948	NA	NA	NA	NA	0.1052	NA
indole-3-carboxylic acid	0.9724	1.0933	1.0190	0.8924	0.7581	0.9924	1.8132	1.1149
indoleacetate	2.4708	0.6051	1.6097	0.5031	0.4335	0.5929	0.7855	0.6093
indoleacetylaspartate	0.1834	0.1947	0.1161	1.9082	7.0093	0.3754	0.1066	0.4010
indolelactate	0.7751	0.3376	0.3645	0.4540	2.6745	3.4526	0.4635	5.0432
indolepropionate	0.7220	0.8194	0.8668	0.8427	2.5528	2.0324	3.1557	0.8487
indolin-2-one	1.1496	1.2359	0.8967	1.0630	0.2956	0.3456	0.1319	0.7033
inosine	0.9166	0.8253	1.2072	0.5851	0.7106	2.3763	1.8743	1.6331
isobutyrylglycine	0.9185	1.0546	0.8250	0.9400	1.1079	0.8759	2.3302	0.9541
isocaproate (i6:0)	0.9218	0.9373	0.9079	0.8814	1.5028	1.8367	0.7953	0.6428
isoleucine	0.8697	1.0147	0.9446	0.8635	1.3852	1.2305	1.4350	1.3718
isoleucylglycine	0.7335	1.0753	0.6047	1.0030	1.0142	1.4567	2.4442	1.1161
isoursodeoxycholate	0.9197	0.7895	0.2598	0.6674	1.4671	4.3034	2.1469	1.1995
isovalerate (i5:0)	1.1945	1.1094	0.6475	0.6228	1.0539	2.0527	1.9764	1.0323
isovalerylglycine	0.9735	1.0802	0.9459	0.9638	0.9914	0.7545	1.7330	0.8866
I-urobilinogen	0.7369	0.9576	0.8317	0.6511	0.7170	3.5063	0.1681	1.0153
kynurenate	0.6900	1.0252	0.9345	0.9881	1.1539	1.1705	1.3238	1.6261
kynurenine	1.4286	0.8904	1.0438	0.7649	1.5509	0.8942	0.9117	1.2522
lactate	0.3327	0.3574	1.3066	0.4342	13.5148	0.7980	0.5962	1.4865
lactobionate	1.1074	0.6095	2.2398	0.5498	0.2827	0.9314	0.2389	1.7005
lactosyl-N-behenoyl-sphingosine (d18:1/22:0)*	0.6760	1.3714	0.3819	1.0400	0.9016	1.1999	0.4470	1.3879
lactosyl-N-nervonoyl-sphingosine (d18:1/24:1)*	0.4760	1.1760	0.6274	0.8675	4.5619	0.9591	0.5401	0.8032
lactosyl-N-palmitoyl-sphingosine (d18:1/16:0)	0.4838	0.9978	0.6862	0.8481	5.3426	1.1285	0.9010	1.0770
LAHSA (18:2/OH-18:0)*	0.4777	1.0423	0.4073	1.8459	0.6153	0.3292	0.4780	0.7669
lanosterol	0.9301	1.1244	1.0153	1.0595	0.3666	0.9159	0.6721	0.8738
laurate (12:0)	1.7734	0.7436	1.8613	0.6740	0.1169	0.5732	0.6312	0.5869
laurylcarnitine (C12)	0.4724	0.1621	3.4704	0.1858	0.4300	0.7556	0.7192	2.6186
leucine	0.8129	1.0220	0.8969	0.8230	1.7240	1.3378	1.6248	1.4107
leucylalanine	1.0254	0.9670	0.7145	1.1848	0.8360	0.8073	1.3743	0.9830
leucylglutamine*	0.6632	0.8940	0.6375	1.1358	2.7884	1.2960	1.8722	0.8972
leucylglycine	0.8848	1.0562	0.4411	1.3153	0.8424	0.7547	1.1775	1.2489
levulinate (4-oxovalerate)	0.8355	0.9302	0.9807	1.0094	0.8485	1.3937	1.2877	1.3328
lignoceroylcarnitine (C24)*	1.0839	1.0890	0.8876	1.0372	1.0242	0.7406	0.9016	0.7998
lignoceroyl ethanolamide (24:0)*	1.1007	1.0214	0.9062	1.1518	0.8482	0.5748	0.9697	0.7193
limonin	NA	0.2373	NA	NA	NA	1.3814	NA	NA
linoleate (18:2n6)	0.8236	1.0142	1.0052	1.0688	0.5824	0.5641	2.9095	0.7448
linolenate [alpha or gamma; (18:3n3 or 6)]	0.8213	0.9498	1.8571	1.0810	0.0604	0.2251	0.3901	0.7148
linolenoylcarnitine (C18:3)*	0.7296	0.9416	0.9171	1.0110	2.4313	1.1489	2.8365	1.1060
linolenoyl-linolenoyl-glycerol (18:3/18:3) [1]*	1.0175	0.4744	3.4238	0.4838	0.0247	0.0207	0.0065	0.0932
linolenoyl-linolenoyl-glycerol (18:3/18:3) [2]*	0.8187	0.4427	4.2018	0.3302	0.0138	0.0208	0.0080	0.1433
linoleoyl-arachidonoyl-glycerol (18:2/20:4) [2]*	0.8392	0.4392	1.5647	0.5697	9.6587	0.7266	NA	0.8920
linoleoylcarnitine (C18:2)*	0.9328	1.1986	1.4426	0.7684	0.9292	0.7245	0.7422	0.9679
linoleoyl ethanolamide	1.4356	0.7526	0.8034	1.4858	0.0336	0.8356	0.7906	0.3594
linoleoyl-linolenoyl-glycerol (18:2/18:3) [1]*	0.8203	0.6143	2.6801	1.0607	0.5997	0.1092	0.0474	0.2788
linoleoyl-linolenoyl-glycerol (18:2/18:3) [2]*	0.7395	0.7305	2.7848	0.9019	0.3750	0.1815	0.0246	0.4620
linoleoyl-linoleoyl-glycerol (18:2/18:2) [1]*	1.0242	0.6317	1.1679	1.0102	6.1849	0.3628	0.5781	0.3867
linoleoyl-linoleoyl-glycerol (18:2/18:2) [2]*	0.8059	0.6074	1.1775	0.9600	7.7723	0.5071	0.2700	0.4596
liquiritigenin	0.1257	0.5283	1.1974	0.6447	0.9594	3.4418	0.0399	2.2477
lisinopril	0.0036	1.8258	0.0024	3.1657	NA	NA	NA	NA
lithocholate	0.6618	1.1714	0.8020	1.0009	1.3865	0.7997	2.3061	0.8697
loperamide	NA	0.0916	2.3569	NA	0.0076	NA	0.1870	NA
loratadine	0.8642	NA	1.7427	0.5954	NA	NA	NA	NA
L-urobilin	0.6616	1.0583	0.7844	1.1439	NA	0.7906	0.0162	2.0450
lysine	0.8320	0.9183	0.8578	0.8046	1.6099	1.5309	1.5127	1.9304
lysylleucine	1.4979	0.5931	0.5147	1.2427	1.9515	0.6600	NA	2.1915
malate	1.0723	0.8631	0.9860	0.9371	0.3480	1.3599	0.8069	1.8159
maleate	1.0800	1.1236	1.0126	1.0046	0.7052	0.5747	0.6447	0.9419
malonate	1.3862	0.9066	0.8526	0.8550	1.2579	1.1990	0.4489	1.4233
malonylcarnitine	1.0970	1.0203	1.2101	0.8287	0.4096	1.1246	0.7072	1.2540
maltitol/lactitol/cellobiotol/palatinol	0.0299	2.0324	0.1261	2.1881	NA	NA	NA	0.0876
maltol	1.1910	0.9708	0.8908	0.9386	NA	0.9211	0.4678	1.4682
maltose	0.9957	0.7289	1.9922	0.7900	0.5824	1.6154	0.3230	0.6260
maltotetraose	1.0262	0.7427	1.9872	0.3783	4.0747	0.5196	NA	1.2881
maltotriose	0.1741	0.1731	1.1799	0.1299	0.0380	4.3967	NA	5.8792
mannitol/sorbitol	0.0484	0.0581	6.4876	0.0416	0.0453	0.0688	0.0521	0.0935
mannose	1.6865	0.8209	1.2816	0.9638	0.6174	0.6990	0.9618	0.6207
margarate (17:0)	0.8553	0.8755	1.2510	1.1665	0.3433	0.3521	3.0601	0.4914
margaroylcarnitine (C17)*	0.6049	1.0026	0.5628	1.6110	0.2283	1.0172	1.3462	0.9562
metformin	NA	1.3867	0.6420	0.5846	NA	NA	NA	NA
methionine	0.8043	0.9868	0.8675	0.8487	1.5094	1.4889	1.8173	1.4085
methionine sulfone	0.4557	1.6676	0.5204	0.3353	0.3362	0.6179	3.5501	1.0578
methionine sulfoxide	0.8242	1.0874	0.6457	0.9952	1.1390	1.0652	1.9930	1.3226
methyl glucopyranoside (alpha + beta)	0.9348	0.8274	1.2184	1.2121	0.8030	0.9923	0.6897	0.8465
methyl indole-3-acetate	0.6356	1.0806	1.6705	1.2087	NA	0.6623	NA	1.4387
methylmalonate (MMA)	2.0006	0.8185	0.9051	0.8301	0.1072	1.3237	0.6642	0.9298
methylphosphate	0.9021	0.8746	0.8719	1.1472	1.7328	0.7549	1.2986	1.1720
methylsuccinate	1.2130	1.1523	1.0398	0.9235	0.0400	1.2213	0.0698	0.7507
metoprolol acid metabolite*	0.5347	0.2402	0.4983	0.3188	NA	2.2587	NA	2.1492
mevalonate	1.4521	0.5480	1.3561	0.8166	2.2986	0.8066	1.4375	1.0055
mevalonate 5-diphosphate	1.1990	1.0215	0.9813	1.2703	NA	0.5157	1.0872	0.4738
mevalonolactone	1.3984	0.6802	1.2990	0.8730	0.9201	1.0838	1.2554	0.9686
m-tyramine	0.4266	0.5827	0.6534	2.1200	0.0841	0.1344	0.1669	0.1865
myo-inositol	1.0292	0.6537	1.5325	0.6235	1.7378	0.6994	0.9128	2.4019
myristate (14:0)	0.8688	0.7457	1.5614	1.0604	0.3735	0.5467	1.7495	1.1886
myristoleate (14:1n5)	0.3699	0.7827	1.4021	1.0101	0.4512	1.3508	2.5993	1.6264
myristoylcarnitine (C14)	1.1635	1.0278	1.7158	0.4191	0.4750	1.3621	0.3188	0.9194
N(^1)-acetylspermidine	1.7523	0.5821	0.9803	0.8920	0.7913	0.7125	1.7152	1.5986
N(1)-acetylspermine	0.7807	4.2668	0.4085	1.7423	NA	0.2815	0.6087	0.3093
N1-Methyl-2-pyridone-5-carboxamide	1.6864	0.9199	0.9139	0.8453	1.5575	0.9152	1.0716	0.9109
N1-methyladenosine	1.1329	0.6139	1.6571	0.7261	0.1225	1.2808	1.9924	1.0590
N1,N12-diacetylspermine	1.8810	0.4512	1.4404	0.7687	1.3651	0.6428	2.0088	0.9704
N2-acetyllysine	1.7332	0.8206	0.6745	0.8023	0.8616	1.6554	0.6189	1.2823
N-(2-furoyl)glycine	3.6801	0.0757	0.1321	1.0739	0.0695	0.0571	0.0570	0.0647
N-(2-hydroxypalmitoyl)-sphingosine (d18:1/16:0(2OH))	0.6876	0.8375	0.6049	1.0121	0.6127	1.5480	3.4304	1.7600
N2,N5-diacetylornithine	0.6952	0.6270	0.7667	1.7785	0.2872	1.1170	0.3717	0.6678
N6-acetyllysine	0.9424	0.9816	0.8430	0.7866	2.7015	1.0309	2.4601	0.9678
N6-carboxyethyllysine	0.6522	1.4360	0.6380	1.0906	1.3805	0.9836	0.5679	1.1688
N6-carboxymethyllysine	1.0586	0.8845	0.9135	0.6592	1.0055	2.1025	1.1607	1.9377
N6-formyllysine	0.5889	0.8200	0.9996	0.7504	3.3195	1.2493	4.0031	1.0514
N6-methyladenosine	0.5879	1.0925	0.8673	1.0188	1.1299	1.2851	1.3368	1.1546
N6,N6,N6-trimethyllysine	2.2060	0.4142	1.3548	0.5719	1.6911	0.5019	1.1096	1.7586
N-acetyl-1-methylhistidine*	0.9446	1.4176	0.4066	1.0509	1.4593	0.8423	0.3124	0.5464
N-acetyl-3-methylhistidine*	1.6006	0.8953	0.2667	1.1864	0.2325	1.1809	1.0683	0.5821
N-acetylalanine	0.7906	1.1108	1.0613	0.9894	0.8588	0.8513	1.0082	1.1621
N-acetylarginine	0.9306	1.0467	1.1209	0.8168	1.7002	0.8903	1.8194	0.8358
N-acetylasparagine	0.9214	0.9680	1.1625	0.9451	0.9747	1.0192	1.2336	1.0583
N-acetylaspartate (NAA)	1.4288	0.7522	1.0525	0.9153	0.0079	1.3859	0.0200	1.5336
N-acetyl-aspartyl-glutamate (NAAG)	2.1154	0.1424	0.1164	0.1331	NA	4.6805	0.0906	0.3080
N-acetyl-beta-glucosaminylamine	0.7587	1.0902	0.7230	0.9940	0.9609	1.4913	1.7285	1.0808
N-acetyl-cadaverine	2.6088	0.4162	1.2373	0.4532	0.3194	1.0171	2.3134	1.1387
N-acetylcitrulline	1.3305	0.9432	0.9743	0.9596	0.6862	1.1823	0.8699	0.8066
N-acetylcysteine	0.9167	0.8974	1.0500	1.2856	NA	0.6629	0.2868	1.0119
N-acetylglucosamine 6-sulfate	0.2886	0.3139	1.1069	1.2850	NA	0.1755	NA	5.5683
N-acetylglucosamine/N-acetylgalactosamine	0.8569	0.8413	1.2530	1.1099	1.0617	0.7935	1.0238	1.1087
N-acetylglucosaminylasparagine	0.7381	0.7895	1.3153	1.0543	0.8973	0.8658	1.8384	1.3633
N-acetylglutamate	1.1430	1.1235	0.9402	0.9597	0.2458	1.1543	0.3148	0.9827
N-acetylglutamine	0.8175	1.0681	0.8283	0.9589	1.1377	1.4553	0.8860	1.2969
N-acetylglycine	0.8852	1.0453	1.3358	0.9374	0.8547	0.6458	1.1401	0.7375
N-acetylhistamine	0.9604	0.9872	0.9539	1.0888	0.3466	0.9768	1.2811	1.0693
N-acetylhistidine	0.9882	0.9752	1.0025	0.9442	1.2087	1.2552	0.7089	1.1723
N-acetylisoleucine	0.6498	1.7789	0.5323	0.6045	0.9780	0.4193	2.3791	1.4161
N-acetylleucine	0.5821	1.8067	0.5445	0.5420	1.5325	0.4087	2.9748	0.8382
N-acetylmethionine	1.2968	0.8669	0.7471	0.7430	2.2981	0.9633	1.6674	1.6996
N-acetylmethionine sulfoxide	0.9036	0.8110	0.7633	1.0604	3.4911	0.7822	1.5891	1.0889
N-acetylmuramate	0.9186	1.0449	1.0309	0.9961	1.3977	0.8229	0.9368	0.9513
N-acetylneuraminate	0.8172	0.8387	1.2504	1.0815	0.6784	0.5383	2.1957	1.1695
N-acetylphenylalanine	0.9910	1.0703	0.8176	0.7162	2.5876	0.3993	3.6420	0.9297
N-acetylproline	1.5265	0.8780	0.7157	0.7006	0.6441	1.0972	1.8903	1.9266
N-acetylputrescine	0.6784	1.0853	0.6472	0.5162	0.2676	1.8996	4.0562	2.4177
N-acetylpyrraline	0.9193	1.1604	1.6430	1.2271	0.3403	0.4939	0.4021	0.1624
N-acetylserotonin	0.5270	1.0013	0.7409	1.7505	NA	0.7507	NA	0.2378
N-acetylsphingosine	0.2914	0.3767	0.2205	3.1191	NA	0.2643	0.3810	0.2228
N-acetyltaurine	0.9836	0.8777	0.7073	0.8794	0.0940	3.2390	0.9306	2.0096
N-acetylthreonine	0.3274	0.9937	1.7533	0.8321	0.5792	1.1430	0.7558	1.3887
N-acetyltryptophan	1.3321	0.7766	0.7919	0.7923	2.5197	1.3687	1.8498	1.0765
N-acetyltyrosine	1.3864	1.0561	0.8442	0.6211	1.1981	1.7652	1.4092	0.8212
N-acetylvaline	0.9466	1.7053	0.6428	0.5626	0.6382	0.7161	2.2697	0.9899
N-alpha-acetylornithine	0.8030	1.1689	1.1217	1.0090	1.1243	0.7347	0.7328	0.7246
naringenin	0.6475	0.3267	1.5080	0.2387	1.8012	0.8397	0.4960	5.8371
narirutin	NA	NA	1.2307	NA	NA	NA	NA	0.5386
N-behenoyl-sphingadienine (d18:2/22:0)*	1.0473	0.6616	1.0248	0.9946	1.2424	0.8456	2.7350	1.3224
N-carbamoylalanine	1.1530	1.0710	0.7329	1.0021	2.2049	0.8114	2.5310	0.3920
N-carbamoylaspartate	1.2930	0.8693	0.9399	0.9458	0.0942	1.3477	1.3511	1.0408
N-carbamoylglutamate	1.3613	0.7136	1.1539	1.0141	NA	0.9376	0.2694	0.8149
N-carbamoylsarcosine	2.2520	1.1674	0.5513	0.9019	0.4583	0.4121	0.5681	0.4722
N-delta-acetylornithine	1.3343	0.9746	1.0026	0.9896	1.4762	0.5321	0.9093	0.5855
neoponcirin	NA	NA	1.3375	NA	NA	NA	NA	0.6625
nervonate (24:1n9)*	0.6374	0.8457	0.4581	1.6915	2.7559	0.2149	1.1951	0.0483
nervonoylcarnitine (C24:1)*	1.1949	0.9418	1.2712	1.0103	0.1695	1.3064	0.5225	0.6771
N-formylanthranilic acid	1.0654	1.0354	0.6488	1.2690	0.2142	0.7222	0.9701	0.9230
N-formylmethionine	0.9230	0.8871	0.6316	0.7734	1.3714	1.9137	2.1017	1.9910
N-formylphenylalanine	0.8677	1.0328	0.9231	0.8780	1.3689	0.8651	2.6655	1.0421
N-glycolylneuraminate	2.8103	0.6038	1.4345	0.2603	0.2012	0.7752	0.3079	0.9914
nicotianamine	1.9426	0.5905	1.2390	0.5623	0.6868	1.2032	0.3384	2.5952
nicotinamide	0.7378	1.1563	0.9820	1.1596	0.4388	0.5752	0.6259	1.1715
nicotinamide riboside	0.8864	0.9913	1.0043	1.0779	0.8479	1.1156	0.5291	1.1744
nicotinate	1.0338	0.9459	0.8721	0.9928	1.1411	1.2214	1.0840	1.1775
nicotinate ribonucleoside	1.0275	0.6948	1.4914	0.6926	0.7988	1.8066	0.1962	2.1555
nicotinic acid mononucleotide (NaMN)	1.8872	0.5355	1.4694	1.5416	0.1145	0.0551	NA	0.1137
N-methylalanine	0.9891	1.0466	1.0205	0.9900	0.9169	0.8998	1.2150	0.8508
N-methyl-GABA	0.7238	0.5151	0.7199	0.7754	0.7342	3.6781	4.2589	1.0301
N-methylglutamate	1.2785	0.8332	1.0118	1.1687	0.7817	0.6724	0.6839	0.8518
N-methylhydantoin	1.2315	0.7146	0.4492	0.8343	1.3283	0.2414	4.4924	0.8783
N-methylleucine	0.9667	0.7353	1.1717	1.3117	0.3482	0.7498	1.0871	0.8635
N-methylphenylalanine	0.4521	1.1888	1.2083	1.0214	1.3309	0.2674	2.2396	0.4144
N-methylpipecolate	1.3514	0.9598	1.1300	1.1173	0.4156	0.3494	0.7469	0.5191
N-methylproline	0.6578	1.0264	0.4342	1.5350	0.3264	0.6849	0.2924	1.7494
N-methyltaurine	2.6254	1.1083	1.7235	0.4854	NA	0.8270	NA	0.7683
N-methyltryptophan	2.1740	0.8876	0.3982	0.7935	NA	NA	1.2368	0.5362
N-monomethylarginine	0.6558	0.5793	0.8443	0.9331	2.3398	2.1900	1.0660	1.2540
nonadecanoate (19:0)	0.7164	1.0720	1.0251	1.1701	0.3888	0.4392	2.8233	0.5117
norvaline	0.4361	1.7169	0.4303	0.3639	1.0478	0.5138	6.1891	0.8812
N-palmitoylglycine	0.9211	0.9961	0.9370	1.1930	0.7684	1.1922	1.1977	0.4453
N-palmitoylserine	0.8635	0.9647	0.7523	1.0668	0.1896	1.8390	2.2782	0.7801
N-palmitoyl-sphinganine (d18:0/16:0)	0.7450	1.0963	0.5818	1.2498	0.7214	1.0183	0.8892	1.3016
N-palmitoyl-sphingosine (d18:1/16:0)	0.7750	0.9759	0.6709	1.1169	1.0884	0.9327	2.3619	1.3093
N-palmitoyltaurine	0.3870	1.4745	0.1396	1.5424	NA	0.5909	2.9090	0.3503
N-propionylalanine	1.2395	1.1245	0.6063	0.8847	0.5231	1.1331	1.7774	1.1035
N-propionylmethionine	1.3364	0.9482	0.8866	0.6472	0.6698	0.9174	3.2055	1.9993
N-stearoyl-sphinganine (d18:0/18:0)*	0.5434	1.1548	0.4481	1.3979	0.2168	1.0462	0.4956	1.6316
N-stearoyl-sphingosine (d18:1/18:0)*	0.7333	1.0831	0.5316	1.0739	0.3348	1.2073	2.7825	1.3652
N-stearoyltaurine	0.4324	1.6804	0.2727	0.9829	NA	0.4803	2.4969	NA
N-trimethyl 5-aminovalerate	0.8911	1.1742	0.6888	1.1535	0.5210	0.7259	1.6550	0.7614
O-acetylhomoserine	1.1041	1.3258	0.8303	0.7500	0.8305	0.9406	1.2036	0.8654
OAHSA (18:1/OH-18:0)	0.5627	1.0001	0.5559	1.7034	0.5449	0.3270	0.7077	0.7531
octadecanedioate (C18-DC)	1.3435	1.1344	1.0839	0.8946	0.3302	0.3162	NA	0.5755
o-hydroxyatorvastatin	NA	0.6104	NA	NA	1.6370	NA	0.7526	NA
oleanolate	0.6273	0.6442	1.5884	1.3895	0.0498	0.2472	3.3741	0.0588
oleate/vaccenate (18:1)	0.8115	1.0200	1.0141	1.2609	0.6637	0.7295	0.8458	0.6489
oleoylcarnitine (C18:1)	0.7465	1.2413	0.7826	1.1893	0.6334	1.1097	1.0119	0.7879
oleoylcholine	1.8227	NA	NA	0.5959	0.9696	1.4344	0.1774	NA
oleoyl ethanolamide	1.0114	1.2227	0.9695	1.0438	0.3285	0.9484	0.4789	0.5660
oleoyl-linolenoyl-glycerol (18:1/18:3) [2]*	0.8746	0.6144	2.4485	1.0410	0.0322	0.0487	0.0288	0.8169
oleoyl-linoleoyl-glycerol (18:1/18:2) [1]	0.7860	0.4483	1.0558	1.1489	8.4669	0.3060	0.9004	0.2184
oleoyl-linoleoyl-glycerol (18:1/18:2) [2]	0.8530	0.5709	1.2195	1.1148	6.1701	0.4899	0.6535	0.3310
oleoyl-oleoyl-glycerol (18:1/18:1) [1]*	0.7269	0.3837	1.0393	1.6239	5.8889	0.3056	0.8927	0.1193
oleoyl-oleoyl-glycerol (18:1/18:1) [2]*	0.8383	0.4978	1.1328	1.4239	4.6478	0.5037	0.7685	0.2128
ornithine	0.7027	0.6780	0.9459	0.8015	7.6957	0.6980	1.2601	1.0451
orotate	1.2367	0.9243	0.6494	1.2316	0.1928	0.6461	0.3050	1.6886
orotidine	0.6998	0.7945	0.4604	1.5289	0.1175	1.5550	0.4500	1.9253
O-sulfo-L-tyrosine	0.9425	0.9694	1.0603	0.3293	1.5366	2.1438	5.0360	1.4459
oxalate (ethanedioate)	1.3154	0.8086	2.3785	0.6231	0.1399	0.7938	0.3125	0.3814
PAHSA (16:0/OH-18:0)	0.8913	0.8723	0.4290	1.4629	1.4787	0.1726	1.1328	0.9590
palmitate (16:0)	0.8519	1.0335	1.0630	1.1737	0.7404	0.6447	1.1209	0.7353
palmitoleate (16:1n7)	0.5166	0.8195	0.5711	0.9117	0.3362	1.1620	3.0479	3.6360
palmitoleoylcarnitine (C16:1)*	0.4749	1.4836	1.2268	0.7856	0.4471	0.8465	0.5129	0.7541
palmitoleoyl-linoleoyl-glycerol (16:1/18:2) [1]*	0.4653	0.6109	0.5933	2.0715	4.0124	0.4228	0.6383	0.8722
palmitoylcarnitine (C16)	0.8271	0.8831	1.1443	1.0174	1.0769	1.3923	0.6815	1.1979
palmitoylcholine	0.7280	1.2080	1.0121	1.1878	0.1111	0.3698	0.2725	0.5092
palmitoyl dihydrosphingomyelin (d18:0/16:0)*	0.9100	0.7337	1.0305	1.2302	1.8411	0.8367	1.3608	0.8069
palmitoyl ethanolamide	0.9628	1.1743	0.9754	1.0756	0.3114	0.9951	0.3366	0.7105
palmitoyl-linolenoyl-glycerol (16:0/18:3) [2]*	0.6325	0.6052	2.7367	0.8602	0.2614	0.2378	0.0617	0.4110
palmitoyl-linoleoyl-glycerol (16:0/18:2) [1]*	1.1226	0.6363	1.3264	1.1575	2.3616	0.8320	0.7585	0.4524
palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]*	1.0880	0.7275	1.3810	1.0933	1.5368	0.9456	0.4392	0.7004
palmitoyl-oleoyl-glycerol (16:0/18:1) [2]*	0.8667	0.5426	1.0745	1.4579	1.8567	1.3193	0.5539	0.6204
palmitoyl sphingomyelin (d18:1/16:0)	0.6908	0.6655	0.9719	1.2812	3.9915	0.5242	2.2761	0.4251
pantetheine	0.7829	0.8416	0.7519	1.0246	0.3873	1.5863	0.2991	1.9701
pantothenate	1.0467	0.9882	0.8625	0.9356	1.0588	1.1428	1.1502	1.3231
paraxanthine	0.9661	1.0412	0.4819	1.3128	NA	0.4992	0.5402	0.7270
p-cresol	1.4180	0.9009	1.9135	0.7535	0.5024	0.8046	0.4024	0.6768
p-cresol sulfate	1.0433	1.0809	0.5690	1.4041	0.0960	1.2597	0.1953	0.2735
phenethylamine	0.4169	1.1060	0.3342	0.4157	0.2606	1.5603	0.2422	6.4734
phenol sulfate	0.2499	0.3276	1.8767	1.2353	0.6761	0.1685	8.3924	0.1071
phenylacetate	1.0881	1.2021	0.6734	0.8310	0.4918	1.6352	1.1241	0.9226
phenylacetylglutamate	2.1375	0.8235	1.5812	0.7038	NA	NA	0.9395	NA
phenylacetylglutamine	1.4530	0.0765	0.7279	2.1601	NA	0.1953	0.0189	0.9146
phenylacetylglycine	0.3246	NA	1.1233	0.7062	4.7729	NA	NA	0.3929
phenylalanine	0.7641	0.9386	0.9877	0.8328	1.8404	1.2996	1.8719	1.4934
phenylalanylalanine	1.1148	0.7644	0.6061	0.8373	1.6939	2.2039	3.0763	0.8031
phenylalanylglycine	0.7421	0.9739	0.6391	1.0238	1.2305	2.0343	1.8857	0.9587
phenyllactate (PLA)	0.5671	0.6321	0.5873	0.6248	0.7071	1.4868	4.5672	3.8449
phenylpyruvate	0.7140	0.7531	1.2184	1.3427	2.2943	0.7058	1.7008	0.6701
pheophorbide A	1.2876	1.7704	0.2384	0.6369	0.0810	0.5819	1.2766	0.9008
phosphate	1.0087	0.9030	0.9486	1.5485	0.8698	0.4342	0.2905	0.1978
p-hydroxyatorvastatin	NA	1.2318	NA	NA	1.1745	NA	0.5937	NA
p-hydroxyatorvastatin lactone	NA	1.0975	NA	NA	1.4638	NA	0.4387	NA
phytanate	0.3182	0.7417	0.5423	1.9523	0.2204	0.2288	1.6745	1.6697
phytosphingosine	0.8128	0.7862	1.0115	1.0304	0.6519	2.0410	1.1111	1.3030
picolinate	1.5699	0.8495	0.9248	0.8327	NA	1.4093	0.7038	1.1405
pimelate (C7-DC)	1.2876	0.8315	1.0757	1.0261	0.3136	1.0712	0.4919	0.9544
pipecolate	1.1343	1.1181	0.7106	1.0982	0.7358	0.8092	0.7303	0.8723
piperidine	1.7070	0.8304	1.5094	0.5688	0.1133	0.6445	0.1554	1.9770
piperine	0.2384	0.9648	0.1478	0.8089	0.1445	5.6788	0.8989	0.6255
ponciretin	1.5039	0.0935	1.3509	0.1629	0.2532	2.2131	0.5177	1.4882
pregnanolone/allopregnanolone sulfate	0.3302	2.2572	0.3359	0.8062	NA	0.3639	NA	0.4291
pregnen-diol disulfate C21H34O8S2*	0.8279	1.5370	0.5838	0.9077	0.4620	1.5052	0.4985	0.8005
pregnenolone sulfate	0.6663	1.6091	0.3519	1.2963	0.1813	1.6290	0.4442	0.9306
pregn steroid monosulfate C21H34O5S*	0.5665	1.3357	0.4024	1.2424	0.4918	2.2184	0.5201	0.9315
pristanate	0.5986	0.9926	0.3820	1.2588	0.3686	0.3155	2.2584	1.7216
pro-hydroxy-pro	NA	NA	1.0000	NA	NA	NA	NA	NA
proline	0.7609	0.8617	0.9529	0.7529	1.1545	1.2587	1.6410	2.7934
prolylglycine	1.0327	0.6958	1.8452	0.5858	0.8197	1.3697	1.0728	2.1053
propionylglycine	0.9376	0.7113	0.9699	0.9933	0.9562	0.9113	1.2422	1.8644
protoporphyrin IX	0.9830	0.8344	0.5242	1.5585	0.0347	0.6539	0.1079	1.3683
pseudoephedrine	0.7391	NA	0.1525	1.7390	NA	NA	NA	NA
pseudouridine	0.9485	1.0467	1.1193	0.9626	0.9037	0.8313	1.1284	0.9413
pterin	1.0497	1.2451	0.5847	1.1821	0.7226	0.5065	0.2107	0.5442
putrescine	1.2999	0.9596	1.0774	0.1898	0.4429	0.8565	5.1517	2.0479
pyridoxal	1.1579	0.9280	1.0186	0.8721	0.6924	1.2267	0.6507	1.5602
pyridoxamine	0.9085	1.0362	0.8241	0.9241	1.3981	1.4169	1.1456	1.1142
pyridoxate	1.1898	0.9929	1.0851	0.8688	0.3037	1.1363	0.3855	1.4538
pyridoxine (Vitamin B6)	1.2092	0.8352	0.6135	0.8767	4.1189	1.2735	0.1862	0.6607
pyroglutamine*	0.5944	0.2782	3.7747	0.3340	0.4217	0.3024	0.7146	2.4514
pyrraline	0.8349	0.8598	1.2399	0.9949	1.8954	0.7537	1.8398	0.8456
pyruvate	1.0855	0.8086	1.3990	0.8938	0.2855	1.4721	0.9209	1.0525
quinate	0.9364	1.0884	1.1826	0.9995	0.0952	0.7297	0.9008	1.0793
quinine	NA	NA	NA	0.2352	NA	2.1740	NA	0.5908
quinolinate	1.0549	0.8732	1.0703	1.1308	0.4090	0.8399	0.3097	1.3340
ranitidine	0.2083	0.6363	2.9907	0.1206	NA	0.0047	NA	0.0051
rhoifolin	NA	NA	NA	NA	NA	NA	NA	NA
ribitol	0.5672	0.8269	1.3061	0.8847	1.6309	0.4956	0.8303	2.3860
riboflavin (Vitamin B2)	0.9960	1.0830	0.8158	0.8952	0.9016	1.2496	1.0337	1.3053
ribonate	0.4105	0.2165	2.7065	0.3722	0.3341	0.6489	0.6053	5.4400
ribose	0.5383	1.0876	0.7028	1.1961	1.0463	1.4637	0.5785	2.2420
ribulose/xylulose	1.1519	0.6467	1.0806	1.2034	0.5153	0.5616	0.2386	2.3227
rosmarinate	NA	NA	2.9807	0.0096	NA	NA	NA	NA
(R)-salsolinol	0.3716	0.3339	0.9449	2.1360	NA	1.3587	0.1506	0.5139
S-1-pyrroline-5-carboxylate	1.0247	0.9846	0.8471	0.8638	0.7955	1.1743	1.7012	1.2803
saccharin	0.2858	1.9333	0.0829	1.8722	0.0610	0.0760	0.1527	0.0205
saccharopine	2.2199	0.5033	1.2171	0.9276	0.2158	0.3468	0.1512	0.7562
salicylate	1.2187	0.6375	0.6274	0.6021	2.3423	1.2662	4.2584	2.1683
S-allylcysteine	NA	0.6038	0.2583	1.2042	NA	0.9183	NA	1.6072
sarcosine	0.8737	0.5538	0.6631	0.8785	8.2662	0.3636	4.4018	0.7040
S-carboxymethyl-L-cysteine	0.4700	0.5325	1.3369	0.4716	1.9527	1.1040	4.0030	3.4557
sebacate (C10-DC)	1.1914	1.0378	1.0938	1.0443	0.2273	0.6100	0.3520	0.6627
secoisolariciresinol	0.0841	3.2608	0.5550	1.2252	NA	0.1091	NA	0.5513
secoisolariciresinol diglucoside	NA	0.8672	1.0664	NA	NA	NA	NA	NA
sedoheptulose	1.3540	0.8809	1.0994	0.9743	1.0089	0.6798	0.6944	1.1887
serine	0.8165	0.9097	1.2752	0.8350	1.2501	1.2775	1.5384	1.2479
serotonin	0.4044	0.6693	2.0835	1.4145	0.0776	0.5730	0.0934	0.2605
sertraline	0.5554	1.3823	2.3354	0.4690	NA	NA	NA	NA
silibinin	NA	NA	NA	NA	NA	NA	NA	NA
sitostanol	0.8433	1.4668	0.6951	0.9305	NA	0.5917	0.1320	0.9639
skatol	2.3333	0.3651	2.5344	0.4722	NA	NA	NA	NA
S-methylcysteine	0.5986	1.2203	1.4815	0.7044	0.8148	0.5552	1.6930	1.2061
S-methylmethionine	0.6904	1.4208	1.2811	0.6827	1.2149	1.2381	0.5506	0.2189
solanidine	0.7420	1.3182	0.7334	0.7879	0.2468	2.4191	1.0747	0.4784
spermidine	0.7546	0.4580	0.6504	0.4888	2.9202	3.1867	3.1519	2.5257
sphingadienine	0.5048	0.8600	0.8976	1.1901	0.1683	2.0062	0.6825	1.6200
sphinganine	0.6275	1.0784	0.4975	1.1772	0.4824	1.6254	0.6035	1.8686
sphingosine	0.4701	1.0615	0.5665	1.0889	0.4443	1.8256	1.0187	2.1747
stachydrine	0.6952	1.0130	0.5267	0.6802	0.3289	1.1905	0.8975	4.5219
stearate (18:0)	0.7810	1.0609	1.0408	1.1757	0.5029	0.5115	2.2649	0.4854
stearidonate (18:4n3)	0.0522	1.5740	2.5026	0.7076	NA	0.0324	NA	0.1144
stearoylcarnitine (C18)	0.8662	1.0132	0.6840	1.2560	0.3771	1.2401	1.0692	0.9501
stearoyl ethanolamide	0.8598	1.2322	0.6364	1.2657	0.5047	0.7624	0.7167	0.6458
steviol	0.4427	1.8359	0.1411	0.9442	0.0941	0.6441	NA	0.8136
stigmasterol	1.3056	0.9777	0.8723	1.0924	0.6374	0.8764	0.8166	0.6368
suberate (C8-DC)	0.9835	1.0750	0.9336	1.1526	0.3216	0.6417	0.2896	1.2356
succinate	1.5694	0.5723	1.0363	0.7513	4.5670	0.2692	0.4990	2.6188
succinimide	0.9795	1.0157	1.0091	0.9114	0.8557	1.0300	0.8510	1.4753
succinylcarnitine (C4-DC)	0.4783	0.5545	0.4132	1.1224	0.5015	4.1508	0.1247	2.0656
sucralose	0.1727	1.6687	0.3656	1.7157	0.0110	0.2431	0.0437	0.1906
sucrose	0.4593	0.4351	3.8537	0.4661	0.1987	0.4732	0.1375	1.7413
sulfate*	1.5403	1.0450	0.8285	0.9063	0.4104	1.2904	0.4395	0.7171
syringic acid	0.5906	1.1326	0.4739	0.3957	0.8539	2.7980	0.5128	2.2214
tartarate	0.7064	0.3154	5.4240	0.4816	0.2179	0.5572	0.4371	0.7002
taurine	1.0892	0.8667	0.4206	0.9082	1.2468	2.1649	1.4440	1.7279
taurochenodeoxycholate	0.0788	0.1774	2.8937	0.3612	1.6871	0.8649	0.9946	0.9990
taurocholate	0.0449	0.1812	3.1902	0.3803	0.2257	2.7537	5.1654	0.7524
taurocholenate sulfate	0.5539	0.2832	2.8043	0.3344	1.1683	0.8073	0.1712	1.2471
taurodeoxycholate	0.3512	0.8018	1.6223	1.2066	NA	0.0551	NA	0.7483
taurolithocholate 3-sulfate	0.6423	0.2244	4.7914	0.2719	0.1626	0.0528	NA	0.1948
tauroursodeoxycholate	0.8105	0.5146	2.9083	0.2515	1.0929	1.7263	1.1330	1.0782
tetrahydrocortisone	1.3060	0.7123	1.1504	0.9043	0.4480	1.3839	0.9581	1.3191
theanine	0.9061	0.8282	0.5587	0.9008	4.8444	1.4326	0.9821	0.4053
theobromine	1.9064	0.7171	2.0126	0.5665	0.1021	1.1959	1.0969	0.4379
theophylline	0.7866	0.9944	0.8570	1.3199	NA	0.7367	0.5629	0.9649
thiamin (Vitamin B1)	1.1993	0.8829	2.9187	0.4422	0.0631	0.1543	0.0692	0.5214
thioproline	0.6310	1.0556	0.5416	1.1096	0.9140	0.6148	NA	2.7734
threonate	0.2772	0.2054	4.9606	0.1623	0.4317	0.1876	0.4247	1.2269
threonine	0.8095	0.9132	1.4312	0.7843	1.0297	1.1405	1.4367	1.3857
threonylphenylalanine	0.8494	0.9588	0.4323	1.0064	1.7742	1.6759	2.3710	1.1937
thymidine	0.8724	1.0372	1.1802	0.6816	1.0826	1.4376	1.1474	1.5809
thymidine 5^-monophosphate	2.0243	0.8385	0.9254	1.1086	2.0747	0.1568	0.9559	0.2671
thymine	0.6719	1.2448	1.1157	1.0144	0.6613	0.6902	0.8894	0.8990
tiglylcarnitine (C5:1-DC)	1.5673	0.3451	2.2654	0.4578	NA	0.1048	NA	0.4698
trans-4-hydroxyproline	1.1257	0.6212	1.0052	1.0825	0.7156	1.1496	1.2355	1.8808
trans-nonadecenoate (tr 19:1)*	1.2715	0.7530	0.7068	1.0900	0.8539	0.4298	4.0226	0.6072
trans-urocanate	1.0110	1.1089	0.8108	0.9010	0.7086	1.3824	1.1389	1.0947
trazadone	NA	NA	NA	NA	NA	NA	NA	NA
tribuloside	NA	1.2574	0.4853	NA	NA	NA	NA	NA
tricarballylate	1.0015	1.2477	0.9499	1.0639	0.1571	0.9518	0.0569	0.6637
tridecanedioate (C13-DC)	0.7774	1.3068	0.7642	NA	NA	NA	NA	0.8448
trigonelline (N^-methylnicotinate)	0.9094	0.8310	1.6937	1.2164	0.4280	0.2594	1.0119	0.2774
trimethylamine N-oxide	1.3112	1.0248	0.6401	0.6544	1.3785	1.5208	0.4070	1.9851
tryptamine	1.3492	0.7979	0.2724	0.4605	NA	1.7075	NA	3.5876
tryptophan	0.8779	0.7812	1.2037	0.7340	1.7996	1.4199	1.2221	2.0465
tryptophan betaine	1.6128	0.6170	0.5665	0.8119	4.0885	0.5302	1.8188	0.3041
tryptophylglycine	0.7325	1.0290	0.6335	1.0896	1.0826	1.0779	2.2405	1.0449
tyramine	1.2305	1.1033	0.7881	0.5245	0.9084	1.3771	0.1160	2.6860
tyramine O-sulfate	1.8582	1.1978	0.7873	0.7916	0.6971	0.1987	0.5573	0.1614
tyrosine	0.7413	0.9564	1.0066	0.8507	1.7387	1.3237	1.3461	1.6321
tyrosol	0.9029	0.7286	0.5856	1.4472	2.2059	0.9943	0.9386	0.4945
tyrosylglycine	0.6192	1.0240	0.5844	1.0672	1.6982	2.0467	1.5765	0.4800
undecanedioate (C11-DC)	1.1643	1.3302	0.7761	0.8438	0.1795	0.9294	0.2723	1.2104
uracil	0.7801	1.0882	0.9655	0.9578	1.5241	0.8863	1.7561	0.9028
urate	0.2494	0.2360	4.7133	0.4018	0.6680	0.2084	2.0772	0.1421
uridine	0.6345	0.9368	0.9292	0.6016	1.0210	2.5679	2.1311	2.0239
uridine-2^,3^-cyclic monophosphate	0.5633	0.8387	0.9837	0.9030	5.2816	0.8174	5.1471	0.8303
ursocholate	0.4283	0.4163	0.1330	0.2748	0.2589	7.4872	1.3753	4.1823
ursodeoxycholate	0.8506	0.5993	0.2074	0.5593	1.0725	4.0769	2.0735	2.0910
ursodeoxycholate sulfate (1)	1.0323	1.1246	0.4915	1.3812	NA	1.0340	0.0611	0.4842
ursodeoxycholate sulfate (2)	1.4606	0.9857	0.9630	0.8293	0.4516	0.8928	1.1744	0.8952
valerate (5:0)	1.0612	1.0207	0.7734	0.8137	1.0897	1.4386	1.6363	1.3573
valerylglycine	0.8186	1.0646	0.8776	0.8584	1.2556	0.8888	3.0312	1.0385
valerylphenylalanine	0.5260	0.4347	0.4983	0.8758	0.2866	NA	4.9714	NA
valine	0.7116	1.0253	0.9299	0.7151	2.1132	1.1114	2.0561	1.8685
valine betaine	0.8643	1.0935	1.4399	0.9985	0.6264	0.9650	0.3900	0.6582
valsartan	NA	NA	NA	NA	NA	NA	NA	NA
valylglutamine	0.7112	0.8094	0.6907	0.9677	1.4662	2.9868	2.2830	0.5814
valylglycine	0.6996	1.0533	0.5686	1.0205	1.2175	1.8412	2.2985	0.8982
valylleucine	0.8487	0.8672	0.5651	1.0907	0.8961	1.6211	2.0695	1.4422
vanillactate	0.9062	0.7199	0.6049	0.5592	NA	2.0688	NA	4.1262
vanillate	0.6081	0.8665	0.7845	0.9820	1.6358	1.1136	1.2506	1.7694
vanillin	0.8133	0.9357	1.0938	0.8631	1.1158	0.8818	2.3532	0.6866
xanthine	0.7202	1.1409	0.9980	0.9905	1.0301	0.9356	1.1696	1.0777
xanthosine	0.7120	1.2333	0.9920	1.2333	0.2524	0.6297	0.5159	0.4666
xanthurenate	1.8493	0.8648	0.8580	0.9353	0.1624	1.2701	NA	1.6224
xylose	0.9803	0.7958	1.1457	0.7650	0.5839	0.8534	0.5471	3.8175

Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study

Factors:

F1	Gender:Female | Timepoint:Baseline | CBT_Responder:No
F2	Gender:Female | Timepoint:Baseline | CBT_Responder:Yes
F3	Gender:Female | Timepoint:Post_CBT | CBT_Responder:No
F4	Gender:Female | Timepoint:Post_CBT | CBT_Responder:Yes
F5	Gender:Male | Timepoint:Baseline | CBT_Responder:No
F6	Gender:Male | Timepoint:Baseline | CBT_Responder:Yes
F7	Gender:Male | Timepoint:Post_CBT | CBT_Responder:No
F8	Gender:Male | Timepoint:Post_CBT | CBT_Responder:Yes