Data for (Study ST003089)

(Analysis AN005052)

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
1-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine	1.1687	1.4450	0.7013	2.4147	2.1120	1.5063	0.6253	0.0089
(.+/-.)-1-Amino-2-propanol	1.5546	1.5631	1.4713	1.2637	1.2607	1.4000	1.4109	0.0252
1-carbapenem-3-carboxylic acid	1.1954	1.3820	0.7461	1.3805	1.0421	1.5006	1.4858	0.4225
1-METHYLADENOSINE	1.4403	1.4181	1.4199	1.4632	1.4623	1.3158	1.4543	0.0087
1-Methylguanine	1.3772	1.4663	1.2419	1.4791	1.4724	1.4601	1.4811	0.0073
1-METHYL-L-HISTIDINE	1.0110	1.5612	1.1852	1.6485	1.5913	1.5451	1.4326	0.0084
"1-Pentofuranosyl-2,4(1H,3H)-pyrimidinedione"	0.9473	1.3145	0.3200	1.3856	1.2413	1.3961	1.4855	0.6366
1-(sn-glycero-3-phospho)-1D-myo-inositol	1.2596	1.4923	1.3489	1.8163	1.4415	1.1889	1.2096	0.0810
1-stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion	1.5850	1.5786	0.9566	2.3817	1.1236	1.4569	0.8197	0.0327
"2,3-Dimethoxy-5-methyl-6-(3-methyl-2-buten-1-yl)-1,4-benzenediol"	1.4875	1.1459	0.2782	2.2147	1.0089	2.0040	1.6981	0.0542
"2,4-Diacetamido-2,4,6-trideoxy-alpha-D-mannopyranose"	1.5570	1.1669	1.7692	1.5131	1.2950	1.3989	1.2875	0.0041
"2,4-Diacetamido-2,4,6-trideoxy-alpha-D-mannopyranose (2)"	1.0252	1.3007	0.0517	1.4368	1.2027	1.4289	1.5515	0.6675
"2,4-Dinitrotoluene"	0.5781	0.9797	0.0430	1.8430	1.3899	1.4933	2.7126	0.3201
(2-butyl-1H-imidazol-4-yl)methanol	1.6879	1.2626	0.4027	1.4904	1.4660	0.9959	1.5683	0.3754
"2-Cyclohexyl-4,6-dinitrophenol"	1.2454	1.9645	0.0629	1.1204	1.1770	1.7987	1.2131	0.4727
2-formylphenylformamide	1.4781	1.0701	2.3503	1.4119	1.4458	1.0491	1.1436	0.0170
2-Hydroxycinnamic acid	1.3498	1.3979	2.0870	1.2901	1.2147	1.2049	1.4320	0.0079
2-Methoxy-5-nitrophenol	0.9521	1.3495	0.5140	1.5358	1.2452	1.5091	1.6774	0.4056
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-{[10-(2-hexylcyclopropyl)decanoyl]oxy}propyl palmitate	1.2111	1.4693	1.1933	2.1192	1.9045	1.3254	0.7738	0.0012
"(2S,3R,5S)-3-(2-Aminoethyl)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid"	0.8742	1.3337	0.1151	1.6510	1.5771	1.4633	1.9780	0.3359
"(2S,3Z,5S)-3-(2-Aminoethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid"	0.8448	1.4111	0.0645	1.7274	1.6315	1.4170	2.1080	0.2652
"(2S,3Z,5S)-3-(2-Aminoethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (2)"	0.8310	1.3668	0.1508	1.6152	1.3414	1.4399	2.0130	0.4139
3-Buten-1-amine	1.2285	1.3327	1.8078	1.3524	1.1693	1.1626	1.2599	0.2289
3-Methylinosine	1.1218	1.5041	1.3949	1.3389	1.5287	1.2832	1.6005	0.0760
3-METHYL-L-HISTIDINE	1.1360	1.3946	1.5048	1.4274	1.6751	1.4238	1.4318	0.0022
3-ureidopropionate	1.3607	1.0640	1.2288	2.0188	1.1544	1.4153	1.7122	0.0153
4-guanidinobutanal	1.4407	1.3601	2.0682	1.2967	1.1429	1.3338	1.3253	0.0108
4-Heptylphenol	1.4050	0.9879	2.0208	1.2269	0.7696	1.7187	0.6601	0.4036
4-Hydroxy-3-nitrosobenzamide	0.8977	1.4242	0.1888	1.6312	1.6536	1.4089	2.0268	0.2563
4-Hydroxy-3-nitrosobenzamide (tail)	0.6931	1.0976	0.1722	1.7032	1.4891	1.1915	2.0334	0.5400
4-Hydroxybenzaldehyde	1.3111	1.3940	2.0433	1.2799	1.2444	1.1362	1.5089	0.0275
4-Hydroxyphenylacetylglycine	1.0691	1.5506	1.7924	1.9712	1.2903	0.9742	1.1693	0.0610
4-Methyleneglutamine	1.3341	1.4553	1.7418	1.4166	1.2387	1.3885	1.2284	0.0655
4-(Methylthio)-2-oxobutyric acid	1.2816	2.3489	1.4033	1.1628	1.1661	1.3895	1.2407	0.0023
5-Acetamidopentanoic acid	1.4266	1.9205	1.2436	1.1984	1.2630	1.1239	1.6386	0.0618
5-Methylcytidine	1.3397	1.3922	1.2928	1.4977	1.4354	1.4146	1.4986	0.0430
5-METHYLCYTOSINE	1.5900	1.4538	1.1014	1.3758	1.4054	1.5423	1.3745	0.0522
"6-Methyl[1,2,4]triazolo[4,3-b]pyridazin-8-ol"	1.0175	1.7492	1.2057	1.5214	1.5174	1.4655	1.4758	0.0159
6-methyltetrahydropterin	1.2448	1.5133	1.1845	0.0145	1.8488	2.1231	1.9932	0.0259
7-Methylguanosine	1.3069	1.4738	1.2833	1.5230	1.4646	1.4389	1.4588	0.0169
Aceglutamide	0.9348	1.4881	0.2522	1.5018	1.2686	1.6507	1.7399	0.3880
Acetylarginine	1.0922	1.6859	0.8575	1.9409	0.8894	2.0626	1.4242	0.0158
acetylcarnitine	1.2240	1.3572	2.4940	1.5122	1.1410	0.9454	1.3236	0.0009
afegostat	1.2585	1.4397	1.8294	1.3631	1.5284	1.3567	1.1260	0.0327
ALA-GLU	0.9185	1.4799	0.1459	1.5643	1.1552	1.7286	1.4956	0.5040
Ala-Leu	1.3404	1.4563	1.2408	1.5146	1.5811	1.3771	1.4381	0.0172
alanine	1.2990	1.5881	1.5800	1.5825	1.2779	1.3246	1.2778	0.0234
AMP	1.4048	1.2526	0.9502	1.4137	1.9945	2.0155	0.9401	0.0096
arginine	1.4441	1.3827	2.1181	1.2769	1.1169	1.3186	1.3069	0.0119
argininosuccinate	1.5821	1.3827	1.6716	1.6484	1.0936	1.3610	1.2094	0.0171
Asarone	0.9907	1.2594	0.8455	1.3538	1.8592	1.3089	2.2580	0.0415
asparagine	1.2162	1.4856	2.1621	1.1923	1.3386	1.0994	1.4282	0.0259
Aspartame	1.3036	1.2328	2.8057	1.1569	1.1408	1.0990	1.2353	0.0086
bacimethrin	0.8577	1.3550	0.1346	1.8641	1.3758	1.4072	1.7107	0.4316
b-Ala-Lys	1.5391	1.6686	1.4074	1.4114	1.2964	1.3534	1.1942	0.0432
Benzoxazolone	1.2756	0.8956	1.7119	0.7667	2.0045	1.5781	1.6493	0.0394
beta-Hydroxyasparagine	0.6385	1.1307	0.3388	1.8803	1.4868	1.5495	2.2033	0.2573
betaine	0.8467	1.2704	2.8231	1.3383	1.4677	0.9637	1.1516	0.0462
biotin	1.3191	1.6731	1.3299	1.6069	1.4232	1.1128	1.4776	0.0191
Butyrylcarnitine	1.1890	1.2314	2.1576	1.5196	1.1562	1.2117	1.5003	0.0114
BZ7175000	0.8347	1.3985	0.0459	1.7060	1.5340	1.5505	2.0983	0.2773
C10 H12 N2 O6	0.8046	1.1453	0.0713	1.8786	1.4162	1.4489	2.4313	0.2679
C10 H16 N6 O9	1.7542	1.2779	0.9535	1.3950	1.1719	1.0479	1.4560	0.3145
C10 H16 O5	2.5272	2.5954	0.7449	1.1515	0.4423	0.7742	1.1029	0.2206
C10 H17 N O5	1.5151	1.4285	1.7993	1.7520	1.0417	1.2135	1.1521	0.0326
C10 H19 N O7	2.2884	1.3193	0.9732	1.2804	1.2594	1.3511	1.3742	0.0513
C10 H20 N2 O5	1.2137	1.6465	0.1674	1.5361	1.8409	1.5978	1.9828	0.0049
C10 H20 N4 O5	1.6747	1.6417	0.3405	1.6525	1.3679	1.6070	1.6422	0.0245
C10 H21 N5 O3	1.2497	1.7585	1.4641	1.3712	1.3380	1.2885	1.5099	0.0067
C10 H22 N2 O3	1.2933	1.8477	1.4232	1.3283	1.4405	1.0994	1.5155	0.0174
C10 H22 N2 O4	0.4774	1.0028	4.7006	1.1003	1.2927	0.6009	0.8046	0.0069
C10 H26 N4 O10 S	0.8275	1.1598	0.8794	1.9891	1.4192	1.6907	1.9124	0.0406
C11 H15 N3 O5	0.4799	0.7616	0.0638	1.9198	1.1019	1.6602	3.0424	0.3235
C11 H15 N3 O7	0.7337	1.3605	0.0076	1.7308	1.4319	1.4151	2.0913	0.4097
C11 H15 N O10	1.2927	1.3166	1.7832	1.5750	1.4265	1.2548	1.2758	0.0251
C11 H19 N3 O6	1.0824	1.1965	0.8687	1.5169	1.0520	1.5885	1.9250	0.2567
C11 H20 N2 O5	1.4546	1.3960	2.4284	1.2883	0.9777	1.1742	1.2673	0.0045
C11 H21 N5 O5	1.5400	1.2110	2.6653	1.1557	1.0268	1.2000	1.1936	0.0025
C11 H23 N3 O3	1.5286	1.4260	0.8717	1.4560	1.3559	1.9076	1.4488	0.0018
C11 H30 N7 O2 P	1.5395	1.6602	0.0452	2.2361	1.2660	2.0513	1.1182	0.0279
C12 H11 N7 O2	1.4077	1.2390	0.9114	1.6145	1.1718	1.5184	2.0257	0.0371
C12 H12 O S	1.4815	1.3325	1.1999	1.3934	1.2926	1.6957	1.5510	0.0178
C12 H17 N3 O6	0.5655	0.9052	0.1008	1.4278	1.1227	1.3377	1.9701	0.8567
C12 H18 N2 O8	1.2959	1.4013	1.0991	1.4016	1.1146	1.4105	1.4915	0.2618
C12 H19 O P S	1.3890	1.4212	0.6778	1.4700	1.2388	1.5676	1.2478	0.3293
C12 H21 N3 O2 S2	0.6281	1.2055	0.0550	1.6929	1.0667	1.8442	1.7461	0.5871
C12 H21 N3 O4	0.7949	1.1983	0.0387	1.8687	1.7373	1.4960	2.0731	0.2644
C12 H21 N O6	1.6876	0.9961	1.3496	1.4632	1.1439	1.8682	1.3979	0.0312
C12 H22 N9 O4 P	1.2852	1.0958	0.6256	1.6979	1.2253	1.5433	2.2176	0.1031
C12 H22 N O3 P S	0.8267	1.1982	0.1951	1.7144	1.4259	1.6851	1.6630	0.4305
C12 H27 N O7	1.5967	1.3988	0.9752	1.4124	1.2826	1.7881	1.4814	0.0216
C12 H28 N O11 P	0.7588	0.8614	1.3960	1.3940	2.2331	1.0231	1.3313	0.3341
C13 H23 N3 O8	1.5477	1.3667	0.8462	1.4714	1.3935	1.8175	1.4964	0.0202
C13 H23 N3 O8 (2)	0.6950	1.3083	0.0314	1.8263	1.3684	1.6610	2.1208	0.3296
C13 H28 N2 O3 S2	1.4794	1.5793	0.8932	1.7252	1.2972	1.5322	1.3742	0.0398
C13 H31 N5 O6 S	1.2308	1.2843	3.4058	1.0682	0.7831	1.1168	1.0694	0.0139
C13 H31 N5 O6 S (2)	1.5245	1.3284	2.6434	0.9899	1.0537	1.1463	1.2760	0.0126
C13 H36 Br N9 O6	1.6977	1.2272	2.4962	1.1905	1.1950	0.9345	1.1686	0.0301
C14 H22 O6	0.9295	0.9765	0.6204	1.6438	1.4260	1.3016	2.0121	0.3634
C14 H25 N O6	0.9585	1.0059	0.7886	1.6124	1.3164	1.3449	1.7358	0.4125
C14 H27 N3 O5	1.5834	1.2927	1.1860	1.4786	1.2283	1.6503	1.5116	0.0230
C14 H27 N7 O2 S	1.2823	1.5742	1.9807	1.1002	1.4404	1.3020	1.3077	0.0042
C14 H27 N9 O5 P2	0.7473	1.4129	0.1913	1.9418	1.7537	1.4451	1.8489	0.2197
C14 H28 O13	1.2385	1.2584	2.3039	0.9606	1.4897	1.3690	1.2224	0.0525
C14 H31 O P3	1.3849	1.8836	1.8990	1.0279	1.0641	1.2066	1.4753	0.0196
C14 H35 N10 O3 P S2	1.4676	1.2940	0.8282	1.5589	1.4300	1.6862	1.5586	0.0588
C15 H10 N2 O S	1.5927	1.3965	1.3341	1.3922	1.5517	1.3666	1.3139	0.0174
C15 H21 N O2 P2	1.4115	1.3784	0.9151	1.1550	1.0906	1.8253	1.2664	0.3192
C15 H23 N O10	1.2050	1.5488	1.8655	1.3760	1.4633	1.2789	1.2022	0.0201
C15 H25 N2 O7 P	0.3874	1.7814	0.6881	2.0376	1.4517	1.5374	1.8163	0.1000
C15 H30 N2 O3	0.5069	2.3119	0.9968	0.8091	1.4463	0.8730	2.4560	0.2000
C15 H30 N3 O P S	1.3178	1.3196	1.8412	1.2347	1.4023	1.3584	1.4322	0.0312
C15 H30 N O P S	1.6294	1.3755	1.3734	1.1826	1.2797	1.4466	1.6222	0.0301
C15 H31 N3 O6 P2 S	1.4284	1.3848	2.1809	1.2823	1.2418	1.0799	1.3333	0.0228
C15 H31 N O6	0.9210	1.3242	0.8020	0.4676	3.5247	0.2480	2.1835	0.1763
C15 H36 N9 O P	1.0342	1.7020	1.3936	1.4186	2.5377	0.6020	1.1509	0.0536
C16 H23 N4 O3 P	1.5906	1.1143	1.4710	1.3622	1.2894	1.6756	1.3807	0.0388
C16 H26 N2 P2	1.3855	1.7416	1.4005	1.2271	1.2304	1.3342	1.4830	0.0659
C16 H28 N2 O3	1.1675	1.7311	0.0809	1.7152	1.4775	1.5821	1.3064	0.3131
C16 H29 N O3	1.2306	1.4663	1.5627	1.2780	1.2453	1.3518	0.8928	0.3242
C16 H31 N O2	2.3326	1.4225	1.9083	0.7757	0.9066	2.0307	0.5150	0.0362
C16 H33 N O2	0.9623	2.8974	1.4215	0.4158	0.8198	2.9403	0.4372	0.0352
C16 H33 N O3	1.3345	1.6107	1.5554	1.4896	1.2288	1.4201	0.5751	0.2619
C17 H25 N O10	1.2760	1.6089	1.2752	1.4181	1.5371	1.2335	1.5225	0.0429
C17 H34 N2 O3	0.7273	2.9910	0.9612	1.0866	1.4951	0.4998	1.5694	0.2232
C17 H36 O8	1.5019	1.4962	0.8379	1.3634	1.3156	1.8515	1.5556	0.0259
C17 H47 N9 O2 P2	2.7157	2.5095	1.4443	1.5874	0.6683	0.5825	0.4281	0.0214
C18 H27 N O10 S	1.6451	1.2568	2.5744	1.1811	1.1520	0.9223	1.2148	0.0178
C18 H2 Cl N2 P	1.2310	0.8935	1.4986	1.7611	1.9635	0.5864	1.8565	0.0698
C18 H31 P S	1.0996	1.7166	0.1800	2.2090	1.9496	1.4465	1.2424	0.0521
C19 H22 N10 O6	0.7770	1.2722	0.6872	2.0246	1.3812	1.9455	1.9082	0.0014
C19 H30 N2 O5 S2	1.0136	1.7303	0.6635	2.5817	1.1609	1.2130	1.4665	0.0569
C19 H31 N10 O6 P S2	0.8863	1.3820	2.1313	1.8176	1.2600	0.7765	1.4354	0.1036
C19 H38 N2 O3	1.1770	3.3298	0.8076	1.5059	1.4476	0.4234	0.8997	0.1364
C19 H45 N8 O3 P	1.3855	1.3550	1.3613	1.5449	1.4234	1.6386	1.1077	0.0612
C19 H47 N9 O3 P2	1.6102	1.4241	1.2567	1.6547	1.6242	1.3157	0.9140	0.0668
C20 H15 N7 O S	1.4622	1.4047	1.1100	1.5733	1.4355	1.3601	1.4127	0.0805
C20 H23 N O11	1.3702	1.5077	2.0010	1.2766	1.0963	1.1821	1.2438	0.1074
C20 H31 N4 O4 P S	1.8028	1.3206	1.2564	1.3009	1.3658	1.5541	1.3486	0.0170
C20 H36 N2 O8 P2	1.6826	1.1965	2.5933	1.1776	1.2275	0.9141	1.1861	0.0074
C20 H43 N O2	0.9767	1.3542	0.8941	2.8235	1.8650	1.3908	0.5987	0.0323
C20 H45 N10 O2 P S2	0.8393	1.6465	1.0703	2.1648	1.3065	1.6056	1.1076	0.0865
C21 H33 N3 O3	1.3736	1.3699	1.2509	1.3556	1.5853	1.5778	1.0873	0.1332
C21 H36 N4 O3	1.3730	1.3928	1.2606	1.3381	1.5718	1.6002	1.0784	0.1284
C21 H45 N3 O6 S	1.1862	1.6402	0.8874	2.3499	1.7959	1.4702	0.5685	0.0339
C21 H52 N7 O3 P3	1.0296	1.5029	0.8904	2.5957	2.0292	1.4722	0.4693	0.0035
C22 H39 N4 O2 P	2.0514	2.1908	1.0030	1.5173	1.8093	0.4192	0.7163	0.0976
C22 H41 P3	2.4853	2.2481	1.2542	1.7058	0.7750	0.6825	0.5001	0.1163
C22 H49 N9 O4 S2	1.0454	1.5539	0.7243	2.4503	2.1747	1.5804	0.4191	0.0173
C22 H53 N7 O12	1.3365	1.3242	1.2254	1.8600	2.0147	0.9237	1.1191	0.0654
C23 H23 N O2 S	1.6313	1.3487	1.4502	1.2236	1.3373	1.2144	1.5685	0.0754
C23 H24 O5 S	1.3122	1.3819	1.3419	1.6422	1.5146	1.2514	1.3762	0.0598
C23 H40 N4 O3	1.3937	1.2741	1.1805	1.3203	1.6371	1.5447	1.1307	0.1730
C23 H40 N4 O4	1.4626	1.2805	1.2380	1.5197	1.4674	1.6314	1.1549	0.0818
C23 H49 N2 O4 P	1.3401	1.3657	1.3207	1.3113	1.6139	1.5361	1.0738	0.1461
C25 H31 N3 O S	1.3797	1.3521	1.3366	1.4947	1.2788	1.4637	1.4387	0.0852
C25 H46 N6	0.4652	2.2853	2.0432	0.2169	0.2284	4.2752	0.3701	0.0386
C25 H51 N3 O4 P2	1.1169	2.2461	0.5964	2.4817	2.0162	0.8756	0.6570	0.0033
C25 H55 N3 O4 P2	1.2148	1.3478	0.7132	2.3077	2.1164	1.5374	0.7555	0.0024
C27 H44	1.4118	1.5209	1.3441	1.4502	1.2825	1.5281	1.3510	0.0371
C27 H58 N9 O5 P S	1.4111	1.3562	1.2614	1.9290	2.0224	0.7588	1.0716	0.0632
C28 H53 N O8 S	1.3501	1.1443	1.1617	1.5112	2.0632	0.7610	1.2774	0.2437
C29 H69 N9 O10	1.5917	2.2880	1.0609	1.8747	1.0873	0.8900	1.1333	0.0247
C30 H45 N9	1.4712	1.1432	0.6989	1.5626	1.7105	1.1939	0.8944	0.4418
C30 H53 N5 O2	0.3856	0.5213	2.1663	3.2390	2.6347	0.6686	0.1997	0.0616
C31 H41 N2 O7 P	1.3706	1.9771	0.6608	1.9422	2.0816	1.2826	0.6612	0.0079
C31 H76 N9 O6 P3	1.1338	1.3688	0.7834	1.7907	2.0423	2.1614	0.5770	0.0476
C32 H57 N5 O2	0.5410	0.3283	2.3438	3.1134	2.6492	0.7882	0.1579	0.0261
C33 H65 N O6	0.6864	0.3049	2.9023	2.8936	2.1347	0.8253	0.0901	0.0542
C34 H72 N6 P2	1.3341	1.4588	0.9160	2.0727	2.0679	1.4083	0.7149	0.0091
C34 H72 N7 O6 P	1.2087	1.7308	0.9174	2.3509	1.7196	1.2513	0.8042	0.0057
C34 H77 N5 O7 P2	1.1614	1.5497	0.8327	2.0187	2.2394	1.3812	0.7764	0.0135
C35 H73 N8 O4 P	1.3371	1.5468	0.8037	2.1236	1.7277	1.6440	0.7810	0.0120
C35 H75 N9 O4 S	1.1951	1.3774	0.8325	2.5605	1.8680	1.3933	0.7029	0.0234
C36 H79 N5 O13	1.3069	1.5596	0.8900	2.1892	1.9786	1.3088	0.7274	0.0132
C38 H83 N5 O13	1.2303	1.4823	0.6340	2.1318	2.2843	1.6004	0.5362	0.0336
C3 H12 N7 O3 P	1.1148	1.6107	1.2448	1.8483	1.2506	1.4522	1.4201	0.0195
C3 H12 N9 O P S	1.4527	1.3343	1.5779	1.5439	1.1434	1.3556	1.4397	0.0508
C3 H4 N8 O	1.2606	1.3669	1.2645	1.3091	1.5729	1.7518	1.4376	0.0122
C3 H8 N9 O P S	1.2509	1.5037	2.0152	1.4044	1.2809	1.1317	1.2966	0.0389
C3 H9 N10 O5 P	1.2728	1.0668	1.3488	1.9313	1.6481	0.9055	1.7773	0.0165
C40 H31 N2 O P S	0.9506	1.1879	2.0899	1.9143	1.5055	0.8001	1.3948	0.0523
C40 H81 N5 O7 P2	1.2007	1.5029	0.9012	1.8427	2.2925	1.5674	0.6892	0.0011
C41 H73 N3 O7	0.7962	2.4439	0.8699	1.6137	1.4628	1.6477	1.0059	0.0533
C42 H81 N5 O7 P2	1.1562	1.5617	0.8683	1.8458	2.2739	1.6286	0.5504	0.0383
C42 H81 N O3	1.3713	1.8326	1.5778	2.0560	1.8325	0.7217	0.4845	0.0412
C42 H83 N9 O8 P2	1.2750	1.6059	0.9222	1.8591	2.1093	1.4172	0.7590	0.0174
C43 H74 N O7 P	1.1957	1.4829	1.3552	1.9854	2.2521	1.0143	0.6800	0.0115
C43 H78 N5 O3 P	1.4229	1.6568	0.9230	1.5330	2.1704	1.5307	0.7411	0.0074
C43 H87 N8 O4 P	1.4510	1.1668	1.0476	2.9215	1.2948	1.3290	0.7637	0.0085
C45 H76 N P3	1.2952	1.3283	1.3837	2.3834	1.8768	1.0511	0.5909	0.0303
C46 H48 N10 O9	0.8076	1.2605	0.6768	2.2361	2.4702	2.1721	0.3683	0.0028
C46 H72 N5 O3 P	1.0508	1.6994	1.4206	1.6650	2.0902	1.1824	0.7877	0.0346
C46 H81 N3 O7	1.3086	1.5460	0.8308	2.3857	1.9562	1.3131	0.6505	0.0031
C47 H86 N4 O5	0.4604	2.7290	1.5280	0.8793	3.0200	1.1789	0.1155	0.0296
C48 H73 N7 O8	1.1484	1.4112	0.5519	1.9285	2.5223	1.6440	0.6234	0.0568
C4 H2 N6 O5	1.1268	1.4388	1.6857	1.8149	1.3384	1.0725	1.5160	0.0023
C4 H5 N O	1.4068	1.4265	1.3580	1.3677	1.4459	1.5357	1.4082	0.0171
C4 H6 N6 O4	0.9106	1.2273	2.9829	0.2490	1.2512	1.7977	1.5232	0.0194
C4 H9 N S	1.0418	2.3561	2.0757	1.0484	1.0068	1.2309	1.1990	0.0137
C50 H69 N7 O5 P2 S	0.8627	1.1087	0.8787	2.4289	2.4289	1.7057	0.4444	0.0474
C50 H74 N6 O8	1.1525	1.6050	1.1009	2.0824	2.0970	1.3207	0.5501	0.0304
C53 H58 O7 P2	0.9460	1.1179	0.6584	3.0438	2.0767	1.8279	0.3036	0.0086
C53 H61 N O8 P2	0.8063	1.3278	0.6337	2.1531	2.4800	2.2318	0.3546	0.0043
C53 H81 N O5	1.2722	1.5672	0.7600	2.0053	2.2767	1.4797	0.6309	0.0027
C57 H69 N O8 P2	0.7915	1.2580	0.8469	2.1407	2.4971	1.9274	0.5056	0.0110
C58 H56 N7 O2 P	1.0074	1.1271	0.8107	2.7200	2.0886	1.8825	0.3442	0.0065
C58 H56 N7 O3 P	0.8438	1.2243	0.7987	2.1656	2.4290	2.1096	0.4247	0.0014
C5 Carnitines	1.4964	1.1899	2.7178	1.3919	0.8344	0.9562	1.3759	0.0125
C5 H10 N2 O6	0.8405	1.5220	0.3020	1.6920	1.3190	1.5576	1.6571	0.3699
C5 H14 N O4 P	1.2795	1.6058	0.8669	2.3197	2.0684	1.1705	0.6616	0.0092
C5 H15 N3 O P2 S	1.0702	1.4077	0.4359	1.3940	1.4060	1.4244	1.5440	0.4393
C5 H17 N6 O3 P	1.5148	1.2650	0.9067	1.1710	1.2666	1.5231	2.1076	0.0817
C5 H2 N10	1.5139	1.0870	1.3340	1.0758	1.1965	2.3613	1.3668	0.0216
C5 H2 N2 O3	0.8410	1.3423	0.0533	1.7072	1.4685	1.6679	1.9395	0.3268
C5 H3 N O2	0.9368	1.4316	0.4871	1.5042	1.3386	1.4238	1.6552	0.4076
C5 H5 N O5	0.7949	1.4497	0.2755	1.7538	1.3239	1.6744	1.7576	0.3234
C5 H7 N O6	0.7843	1.3687	0.1583	1.7653	1.3484	1.6013	1.7155	0.4194
C5 H8 N2 O	1.2282	1.3896	1.5196	1.4236	1.1500	1.3204	1.1900	0.2595
C5 H8 N6 O4	1.2236	1.5783	1.7580	1.4093	1.3464	0.9721	1.6735	0.0129
C6 H11 N3 O2	1.3731	1.3089	1.8977	1.2566	1.0972	1.2821	1.3150	0.1565
C6 H13 N3 O	0.9543	1.5825	1.2256	1.8268	1.6503	1.3628	1.3603	0.0124
C6 H4 N2 O	1.9062	1.6232	0.8377	1.1120	1.5020	0.5417	1.3496	0.3758
C6 H4 N2 O (2)	0.8522	1.4648	0.0473	1.8100	1.6456	1.3209	2.0601	0.2664
C6 H6 N2 O4	0.8418	1.3689	0.0235	1.7542	1.4205	1.5959	1.9550	0.3468
C6 H6 N2 O4 (2)	0.4053	1.2181	0.0323	1.8484	1.2713	1.6512	2.7135	0.2866
C6 H9 N10 O3 P	1.2591	1.4277	1.2130	1.3000	1.4007	1.2422	1.3053	0.2840
C6 H9 N3	1.0404	1.3524	1.3485	1.4136	1.4549	1.2099	1.2469	0.3111
C6 H9 N O10	1.2668	1.0700	1.3136	1.9228	1.6572	0.9116	1.8355	0.0074
C6 H O4 P3 S	1.3269	1.4446	1.8436	1.2721	1.5478	1.2474	1.2147	0.0343
C7 H11 N O6	0.9809	1.4024	0.1408	1.5983	1.7590	1.3623	1.5521	0.4014
C7 H11 N O6 S	1.3502	1.3968	1.6226	1.5684	1.2825	1.3471	1.2750	0.0525
C7 H15 N O6 S2	1.2686	1.0590	1.3367	1.9458	1.6956	0.7667	1.8446	0.0277
C7 H18 N5 O5 P	1.5007	1.7406	0.2734	1.5554	1.5553	1.5044	1.5702	0.0999
C7 H19 N8 O8 P	1.4655	1.3948	1.1465	1.5175	1.3568	1.5177	1.5244	0.0256
C7 H20 N2 O6 P2 S	1.1110	1.3096	1.8492	1.1744	1.5183	0.9926	1.1303	0.3048
C7 H4 N3 O8 P	1.2432	1.3123	1.8935	1.5781	1.2197	1.3067	1.2589	0.0626
C7 H8 N2 O4	0.8517	1.3911	0.0230	1.7301	1.4494	1.5897	1.9839	0.3271
C7 H8 N2 O4 (2)	0.7998	1.3522	0.1962	1.5201	0.9799	1.4732	1.7351	0.6478
C8 H10 N10 O6 S2	1.0319	0.8403	1.6250	2.4021	1.4612	0.2752	2.0119	0.1175
C8 H10 N2 O3	0.7079	1.2312	0.1646	1.6647	1.3759	1.5415	2.1649	0.3831
C8 H11 N O6 S	1.4474	1.3648	1.2791	1.5781	1.3303	1.3185	1.6402	0.0139
C8 H12 N2 O7	0.8448	1.1006	0.2354	1.7362	1.5718	1.5222	1.9364	0.3509
C8 H12 O4	2.5085	2.6040	0.6566	1.2119	0.4462	0.7414	1.1827	0.2162
C8 H14 N2 O6	1.2060	1.3809	1.7329	1.0327	1.3203	1.2402	1.2751	0.2707
C8 H15 N3	1.6393	1.6819	0.6225	1.6918	1.6319	1.3771	1.1609	0.0649
C8 H15 N3 O3	0.7560	1.2540	0.0196	1.5465	1.3561	1.5969	1.9348	0.5121
C8 H16 N9 O2 P	0.9434	1.5721	1.5094	1.6573	1.1383	1.4546	1.5728	0.0507
C8 H17 N3 O3	1.3309	1.3984	1.9320	1.3225	1.3956	1.1798	1.3775	0.0211
C8 H18 N2 O2	1.4695	1.3755	1.5196	1.3922	1.3912	1.3855	1.4648	0.0006
C8 H18 N2 O3	1.3495	1.3796	1.8283	1.2863	1.3204	1.4232	1.4092	0.0012
C8 H20 N2 O3	0.9457	1.4516	2.3672	1.3760	1.4644	1.1401	1.2178	0.0124
C8 H24 Br N9 O2	0.9055	1.4840	0.1802	1.7058	1.7347	1.3539	1.7368	0.2997
C8 H6	1.2090	1.4352	2.0762	1.3526	1.2544	1.1838	1.4433	0.0152
C8 H8 N2 O4	0.6178	2.0033	0.0230	1.6803	1.3410	1.4408	2.1788	0.2384
C8 H9 N	1.2412	1.4386	2.0066	1.3642	1.2464	1.2363	1.4605	0.0021
C9 H11 Cl N5 O3 P	0.5770	0.9175	0.1912	2.6582	1.6515	1.9967	1.4145	0.1978
C9 H11 N7 O S2	1.3065	1.6149	1.9448	1.2508	1.4356	1.3565	0.9325	0.0528
C9 H14 N2 O2	1.0045	1.2172	0.0435	1.8092	1.7335	0.9753	2.7985	0.1394
C9 H14 N2 O5	1.2163	1.2867	0.9887	1.5688	1.2418	1.5569	1.4593	0.2271
C9 H15 N3 O4	0.6946	1.4034	0.0519	1.4618	1.2467	1.6480	1.6834	0.6034
C9 H16 N2 O	1.6621	1.5430	0.1724	1.6727	1.5756	0.9715	2.0593	0.1144
C9 H16 N2 O6	1.3902	1.2528	0.3880	1.3691	1.3143	1.6610	1.7539	0.2903
C9 H16 N2 O6 (2)	0.7119	1.2070	0.1651	1.8531	1.1862	1.6727	2.0855	0.3728
C9 H18 N4 O3	0.2264	1.8809	0.0855	3.1402	0.6495	2.5957	1.3761	0.0152
C9 H20 N2 O4	1.3066	1.3308	1.9679	1.3991	1.3964	1.2512	1.2951	0.0176
C9 H25 N10 O5 P3 S	1.0517	1.2269	1.6572	1.5408	1.4457	1.4627	1.4786	0.0455
carnitine	1.1223	1.2836	2.6809	1.3834	1.2799	1.0299	1.2126	0.0025
carnosine	1.9065	1.6367	1.3486	0.6396	1.8000	1.6588	0.3888	0.2070
Ceramide (d18:1/16:0)	1.4771	1.9350	1.2878	1.8065	1.3407	1.1587	0.8953	0.0330
C H3 O2 P S2	1.2744	1.3277	1.6136	1.1200	1.4449	1.1864	1.1640	0.2897
Choline	1.0270	1.4467	1.4437	1.7263	1.3991	1.4623	1.4876	0.0024
citrulline	1.3441	1.4622	1.7680	1.4132	1.2332	1.3857	1.2279	0.0553
Clavamycin E	0.7603	1.3250	0.0101	1.8445	1.2985	1.6955	2.2069	0.2864
coformycin	1.2627	1.6183	1.7682	1.1674	1.4707	1.2137	1.4224	0.0255
Corticosterone	1.9829	1.8461	0.2403	1.5480	0.9765	1.7163	1.2656	0.1415
Coumarin	1.3073	1.3924	2.1503	1.3398	1.2269	1.1497	1.3868	0.0156
Coumarone	1.3284	1.3329	2.1018	1.2982	1.2108	1.1801	1.5032	0.0148
creatine	1.2967	1.5311	1.6167	1.5432	1.3282	1.3688	1.3114	0.0013
creatinine	1.4005	1.4943	1.2963	1.5329	1.3258	1.3520	1.5851	0.0044
Creatinine degenerate	1.3144	1.5121	1.6308	1.5509	1.3498	1.3181	1.3135	0.0035
Cysteine-glutathione disulfide	1.3415	1.4281	1.5227	1.4021	1.5738	1.3940	1.2898	0.0160
cystine	1.3841	1.5785	2.0743	1.4588	1.1330	1.1332	1.1828	0.0184
cytidine	0.9975	1.3697	0.8941	1.8309	1.4062	1.7644	1.7083	0.0096
cytosine	1.0301	1.3846	0.9265	1.8292	1.4153	1.7193	1.6847	0.0035
CYTOSINE degenerate	1.4343	1.3967	1.3932	1.4391	1.3975	1.5132	1.4183	0.0026
Cytosine degenerate (2)	1.3021	1.4510	1.3696	1.5587	1.4035	1.3880	1.4499	0.0257
dCytidine	1.3509	1.3896	1.1300	1.5746	1.3888	1.4853	1.5224	0.0528
Dehydrocycloguanandin	1.4123	1.6795	2.4208	1.0261	1.1990	0.8667	1.2888	0.0356
Dehydroglycine	1.2116	2.2733	1.4011	1.1854	1.1830	1.3960	1.2782	0.0238
delta-guanidinovaleric acid	0.9970	1.3776	0.8978	2.2898	1.4524	1.4708	1.4825	0.0107
DEOXYCARNITINE	1.0218	1.5050	1.6716	1.5611	1.4753	1.3507	1.3668	0.0159
dimethylformamide	1.4250	1.4806	1.3610	1.4535	1.5073	1.3409	1.3322	0.0331
dimethylglicine	1.2143	1.1594	1.7864	1.1040	1.3287	1.0313	1.2561	0.3733
"DL-2,6-Diaminopimelic acid"	1.4298	1.4088	1.3132	1.4281	1.2224	1.6650	1.3503	0.0608
DL-Lysine	1.4555	1.3286	1.7286	1.1604	1.4315	1.3622	1.4320	0.0337
DL-Stachydrine	1.3874	1.5714	1.3451	1.3029	1.5920	1.0932	1.7026	0.0018
D-(+)-Pipecolinic acid	1.3742	1.3364	1.4228	1.3377	1.3715	1.3418	1.4173	0.1328
D-(+)-Pipecolinic acid (tail)	1.4238	1.3372	1.3301	1.3348	1.4293	1.5043	1.4659	0.0582
D-(+)-Proline	1.4703	1.3386	2.0197	1.2052	1.1354	1.2445	1.1416	0.1482
D-(+)-Pyroglutamic Acid	1.3904	1.4363	1.4155	1.3689	1.4259	1.5430	1.4096	0.0035
epsilon-(gamma-Glutamyl)-lysine	1.4403	1.3013	1.8100	1.1913	1.4207	1.4013	1.4273	0.0026
epsilon-(gamma-Glutamyl)-lysine (2)	1.5539	1.2224	1.8923	1.1254	1.3344	1.4520	1.4067	0.0043
Erucamide	0.5117	0.5712	4.7990	1.3968	0.5086	1.6178	0.4937	0.0337
fagomine	1.2809	1.3172	1.6340	1.4198	1.4334	1.3818	1.1910	0.1140
Formiminoglutamic Acid	1.5543	1.3002	1.2849	1.6323	1.0189	0.8938	1.6399	0.2252
Fructoselysine	1.3876	1.5856	1.8411	1.3713	1.2134	1.0651	1.4860	0.0167
fructosylglycine	1.2945	1.2639	1.5831	1.6953	1.5000	1.0145	1.4925	0.0520
gamma-Glu-gln	1.3463	1.3314	2.0328	1.0713	1.4645	1.4204	1.2995	0.0113
gamma-glutamyltyramine	1.0823	1.8425	0.9417	1.5708	1.2939	1.3940	1.7547	0.0401
glutamine	1.4006	1.4382	1.4176	1.3761	1.4224	1.5437	1.3935	0.0027
Glycerophosphocholine	1.1858	1.2645	1.7998	1.6447	1.4730	1.2721	1.3286	0.0105
GNK	0.9171	1.4845	1.4815	1.7011	1.5694	1.3190	1.4477	0.0266
Golotimod	1.2315	1.4448	1.9796	1.3892	1.4049	1.1294	1.3226	0.0327
GSH	2.1994	1.8596	0.2111	0.4861	0.9709	0.2203	3.6396	0.1376
GSSG	1.4225	1.1955	0.8685	1.4595	2.9073	1.2221	0.7660	0.0528
guanine	1.1440	1.2200	1.1168	1.7638	1.4315	1.5081	1.8016	0.0047
HC blue 2	1.4279	1.5530	1.0713	1.4152	1.5446	1.3242	1.6394	0.0081
hercynine	1.6248	1.7773	0.6795	1.6797	1.6107	1.4563	1.1486	0.0077
hercynine (2)	1.3970	1.4581	0.2564	1.9371	2.1223	1.2111	1.5028	0.0384
Heterodendrin	1.4701	1.4201	1.3349	1.5604	1.2328	1.6228	1.2794	0.0265
Hexadecanamide	1.6980	3.4530	1.0998	0.2135	1.0728	2.1752	0.2563	0.0105
histidine	1.2022	1.4067	2.0611	1.0348	1.4483	1.3049	1.4072	0.0450
histidine (tail)	1.5001	1.8727	1.2914	0.7751	1.7141	0.9011	1.7862	0.0531
homocitrulline	0.9276	1.2630	1.5631	1.3161	1.1443	1.1106	2.6383	0.0123
Homo-L-arginine	0.9997	1.5985	1.2347	1.7887	1.6225	1.4110	1.3442	0.0003
hypoxanthine	0.9876	1.3247	1.0023	1.8384	1.4236	1.7054	1.7149	0.0011
Imidazoleacetic acid riboside	1.3854	1.3395	0.7498	1.0356	1.1210	1.9485	1.4115	0.3363
inosine	1.0170	1.5685	0.9717	1.7397	1.4086	1.8290	1.4128	0.0175
kynurenine	0.9580	1.4454	1.2137	1.5471	1.5516	1.7331	1.4527	0.0328
L-Alanyl-3-{[(2E)-4-amino-4-oxo-2-butenoyl]amino}-L-alanine	0.7610	1.2750	0.0675	1.6699	1.1298	1.5545	1.8355	0.5690
L-Alanyl-L-glutamine	0.5214	0.9522	0.0430	2.0583	1.4497	1.6307	2.6580	0.2290
L-allysine	1.5535	1.4280	1.1102	1.4388	1.3327	1.4041	1.5309	0.0673
L-dihydroanticapsin	1.6076	1.1442	2.4057	1.2480	1.2722	0.9359	1.3459	0.0135
lentiginosine	1.6422	1.4714	1.1790	1.4623	1.5764	1.0294	1.6257	0.0045
leucine	1.5509	1.5450	1.6371	1.2421	1.0964	1.6245	1.2138	0.0301
L-Lysine lactam	1.2367	1.3907	1.7288	1.0452	1.4094	1.2689	1.3110	0.2031
L(-)-Pipecolinic acid	1.2915	1.4292	1.8873	1.2074	1.4726	1.3309	1.3469	0.0114
L-Prolinamide	1.4373	1.3803	1.9884	1.1800	1.1825	1.2576	1.1237	0.1501
L-Proline	1.3359	1.2860	1.8334	1.1653	1.0681	1.2009	1.2011	0.3031
lysine	1.2744	1.4763	1.8510	1.1956	1.4870	1.3529	1.3571	0.0019
meprobamate	1.5219	1.4391	1.3439	1.2472	1.3984	1.3970	1.3121	0.1135
methionine	1.0880	2.3680	2.1119	1.0264	0.9893	1.2566	1.1546	0.0017
Methionine sulfoxide	1.2763	2.3183	1.4140	1.1632	1.1701	1.4099	1.2439	0.0014
MFCD00036904	1.1428	1.3575	0.7054	2.4947	2.0643	1.5288	0.7036	0.0010
MFCD00127891	1.3626	1.3336	1.3080	1.5330	1.4771	1.5089	1.4455	0.0104
MFCD00135289	1.2346	1.5315	0.8797	1.9353	2.1805	1.5455	0.6905	0.0008
Muscimol	1.3242	1.0715	1.2371	2.0397	1.1329	1.4534	1.6953	0.0153
N~2~-(1-Carboxyethyl)-N~5~-(diaminomethylene)ornithine	1.4923	1.6244	1.0381	1.3065	1.3157	1.6575	1.4776	0.0293
N~2~-Acetyl-L-ornithine	1.3503	1.6396	1.7180	1.3399	1.1559	1.0981	1.6926	0.0019
"N(3)-(4-Methoxyfumaroyl)-2,3-diaminopropionic acid"	1.5329	0.9965	0.0971	1.3757	1.0299	1.3585	2.3303	0.4264
"N,4-Dinitroso-N-methylaniline"	1.0571	1.4072	0.0390	1.6467	1.2078	1.7162	1.8119	0.3714
N6-METHYLLYSINE	1.3381	1.5745	1.6831	1.2165	1.3150	1.4177	1.4533	0.0006
N8-Acetylspermidine (tail)	1.4041	1.4255	0.8969	1.4951	1.4046	1.5088	1.7431	0.0407
N-Acetyl-1-aspartylglutamic acid	1.4637	1.3998	0.8509	1.3756	1.3127	1.7448	1.4092	0.1478
N-acetyllysine	1.1944	1.3645	1.9047	1.3945	1.3418	1.1709	1.2504	0.1263
N-ACETYLPUTRESCINE	1.1404	1.2191	1.6033	1.2974	1.4031	0.9081	1.3099	0.3729
N-Benzylformamide	1.3564	1.3321	2.0976	1.2637	1.2622	1.1742	1.4964	0.0058
niacinamide	1.1621	1.2815	1.0227	1.2792	1.3336	1.9570	1.5781	0.1286
Nitrosoguvacoline	1.3027	1.3539	1.3122	1.3602	1.2521	1.4335	1.3605	0.2083
"N,N-DIMETHYLARGININE"	1.1412	1.3920	1.9683	1.3070	1.5487	1.3602	1.2803	0.0008
"N,N-dimethylarginine (2)"	1.0606	1.4749	1.7893	1.4766	1.3195	1.5069	1.3535	0.0062
N-NITROSOMETHYLVINYLAMINE	1.2159	1.4592	2.1905	1.1916	1.3332	1.1487	1.4145	0.0155
"N,N,N-TRIMETHYLLYSINE"	1.4929	1.3988	1.2791	1.4434	1.3725	1.5363	1.4764	0.0002
N-oleoylsphingosine-1-phosphocholine	0.9608	1.7308	0.7385	2.1645	2.4791	1.2294	0.6299	0.0223
"Norspermidine-2,3-dihydroxybenzoate"	0.8470	1.2603	0.4555	1.7607	1.2963	1.7802	2.4298	0.0567
NORURON	1.1295	1.7747	0.0683	1.6927	1.5988	1.4248	1.4193	0.2973
NP-001346	1.4257	1.6637	0.8807	1.4730	1.5769	1.5185	1.3321	0.0431
NPYR	1.3823	1.4164	1.4238	1.3659	1.4321	1.5464	1.4170	0.0054
Nudifloramide	0.9512	0.7857	1.1526	1.4061	1.4862	1.9024	1.3448	0.3236
ornithine	1.3907	1.3561	2.1067	1.2189	1.1634	1.2538	1.1837	0.1089
Orotic acid	0.8555	1.4365	0.0461	1.5785	1.4498	1.5850	1.8573	0.3971
OXOPROLINE/PYROGLUTAMATE	1.3027	1.2650	1.2446	1.5352	1.5093	1.3386	1.2748	0.1766
Oxynicotinamide	0.9718	1.4012	0.1150	1.5695	1.5146	1.4128	1.7492	0.4219
Oxynicotinamide (tail)	1.5481	1.4918	0.6268	1.1037	1.4448	0.6913	1.3384	0.5851
Palmitoyl sphingomyelin	1.2962	1.6413	0.9357	2.1530	1.7428	1.3986	0.8278	0.0015
Palustrine	1.9021	1.4261	0.1387	1.6951	1.1267	1.7775	1.0754	0.2861
p-aminobenzoate	1.2142	1.6675	1.5977	1.2651	1.5337	1.2355	1.4574	0.0096
PANTOTHENATE	1.6067	1.1692	2.4360	1.2659	1.2665	0.9075	1.3470	0.0004
PC	1.0795	1.2834	0.9013	2.6480	2.1838	1.2731	0.6294	0.0005
pentobarbital	1.5810	1.6317	1.0218	1.5288	1.7199	1.1608	1.0428	0.1043
Pergolide	1.2176	0.9561	1.8278	1.1753	1.9154	0.9617	1.6733	0.0910
phenylalanine	1.2494	1.4682	2.0272	1.3589	1.2035	1.2443	1.4392	0.0031
phosphocholine	1.2887	1.3814	1.3745	1.3562	1.8079	1.4590	1.3270	0.0017
Pipecolate	1.2257	1.8956	1.5234	1.6207	1.3039	1.2889	1.0948	0.0156
Piperidine	1.0789	1.6767	1.7407	1.2494	1.9438	0.9997	1.2884	0.0074
Piracetam	1.2411	1.6562	1.2780	1.2562	1.3194	1.2362	1.7820	0.0770
Pirbuterol	1.2405	1.4545	0.9998	1.4736	1.2193	1.5214	1.4156	0.2251
Pregabalin	1.4765	1.1847	2.6139	1.5469	1.0343	0.9875	1.1527	0.0011
Pro-Hyp	1.4037	1.3288	1.1461	1.3803	1.7457	1.6337	1.3386	0.0077
proline	1.0918	1.6713	2.1307	1.3350	1.3034	1.1692	1.2696	0.0097
Prolylglycine	1.1075	1.4098	1.4719	1.6059	1.5334	1.1469	1.4138	0.1036
Prolylleucine	1.2986	1.4184	1.0315	1.5387	1.4911	1.5816	1.5798	0.0201
propionylcarnitine	1.3622	1.2436	3.2331	1.4097	0.8987	0.6936	1.1179	0.0138
pseudouridine	1.2535	1.2934	0.8193	1.4685	1.2927	1.4574	1.3623	0.3509
Pyridoxal	1.3888	1.0358	2.3298	1.3028	1.3249	1.0522	1.1051	0.1535
PYRIDOXAMINE	1.0731	1.1317	0.5545	1.6647	1.4020	1.0887	1.9656	0.3732
Ricinine	0.6985	1.1900	0.1565	1.8262	1.4051	1.5011	2.1685	0.3514
(S)-ACPA (tail)	0.8618	1.2514	0.2501	1.4781	1.3361	1.3831	1.8746	0.5216
(S)-ACPA (tail) (2)	0.5859	1.1871	0.1286	1.9203	1.4640	1.2901	1.9034	0.5069
S-Adenosyl-L-methionine	1.4633	1.6232	1.0339	1.4664	1.5313	1.5421	1.3328	0.0023
serine	1.2807	1.4306	1.7480	1.1653	1.4740	1.1157	1.3866	0.1330
SJ6300000	0.5936	1.0103	0.2019	1.8256	1.4209	1.4939	2.5073	0.3155
ST2975000	1.4018	1.2304	0.9863	1.5062	1.2322	1.4508	2.1392	0.0177
Stearamide	0.3427	4.2307	0.2877	0.2201	0.7567	3.9730	0.1651	0.0080
streptidine	1.1177	1.6231	2.0266	1.5978	1.2106	1.2511	1.1406	0.0108
Succinyladenosine	1.4541	1.4353	1.0853	1.5861	1.3390	1.5107	1.5622	0.0091
taurine	1.4128	1.5670	2.2052	1.1634	1.3287	1.2702	1.0402	0.0042
Thiamine	1.2602	1.4458	1.2763	1.4853	1.4090	1.4691	1.6268	0.0091
threonine	1.4126	1.4776	1.2946	1.4409	1.4648	1.3112	1.3533	0.0817
THTC	1.0473	2.3513	2.1948	1.0051	0.9866	1.2303	1.1688	0.0053
Tilarginine	1.2164	1.4771	1.7753	1.2893	1.3993	1.4754	1.3622	0.0017
trans-3-Indoleacrylic acid	1.2951	1.6364	1.4397	1.5665	1.3687	1.3199	1.3678	0.0020
tyrosine	1.3218	1.3846	2.1061	1.3336	1.2036	1.2128	1.4232	0.0048
uracil	0.8055	1.2297	0.6346	1.9359	1.4493	1.7729	1.8534	0.1062
UROCANATE	1.8225	0.9522	1.1164	1.6327	2.1377	0.5798	0.8496	0.3030
valine	1.2853	1.2071	1.6864	1.3813	1.2010	1.2678	1.2547	0.2388
Veronal	1.1149	1.4532	0.0489	1.6188	1.5190	1.4433	1.7364	0.3552
vinylglycine	1.0108	1.6253	1.0999	0.9574	1.5668	1.4589	1.4963	0.2616
Vorinostat	1.0585	1.4805	0.0382	1.5940	1.6015	1.5383	1.5391	0.3833
YV8195000	1.2430	1.3961	1.9242	1.2812	1.4757	1.2784	1.3683	0.0110

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

Factors:

F1	Sample source:embryonic CSF | Mouse Type:CD1 317-1 (Wild Type Mouse) | Developmental Timepoint:E14.5
F2	Sample source:embryonic CSF | Mouse Type:CD1 317-2 (Wild Type Mouse) | Developmental Timepoint:E14.5
F3	Sample source:embryonic CSF | Mouse Type:CD1 317-3 (Wild Type Mouse) | Developmental Timepoint:E14.5
F4	Sample source:embryonic CSF | Mouse Type:CD1 317-4 (Wild Type Mouse) | Developmental Timepoint:E14.5
F5	Sample source:embryonic CSF | Mouse Type:CD1 317-5 (Wild Type Mouse) | Developmental Timepoint:E14.5
F6	Sample source:embryonic CSF | Mouse Type:CD1 317-6 (Wild Type Mouse) | Developmental Timepoint:E14.5
F7	Sample source:embryonic CSF | Mouse Type:CD1 317-7 (Wild Type Mouse) | Developmental Timepoint:E14.5
F8	Sample source:mock tube | Mouse Type:mock prep same as 1-7 | Developmental Timepoint:-