Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST000046)

(Analysis AN000076)

Metabolite	Structure	F1	F2	F3
Buprenorphine+6.5073805	ME648545	0.52	0.61	1.87
Buprenorphine	ME648544	0.09	0.27	2.66
1-HydroxyvitaminD33-D-glucopyranoside	ME648383	0.20	0.28	2.52
TrpTyrTyr	ME648788	0.17	0.29	2.54
13S-hydroxy-9E,11Z-octadecadienoicacid	ME648367	2.23	0.11	0.68
2-Ethylisonicotinicacid	ME648408	1.94	0.55	0.46
1-Methylinosine	ME648387	0.63	1.97	0.35
Azatadine	ME648528	0.59	1.67	0.72
10,12,15-octadecatrienoicacid	ME648356	0.57	1.34	0.44
Urocanicacid+2.856702	ME648797	0.79	1.75	0.48
3,3,45-Tetrahydroxystilbene+3.5932326	ME648430	0.93	1.59	0.40
L-Glutamicaciddibutylester	ME648670	0.75	1.48	0.39
Normeperidinicacid	ME648709	0.56	1.03	1.42
Traumaticacid	ME648770	0.70	0.73	1.47
ISOSAFROLE+1.0978807	ME648652	0.70	0.89	1.34
IleSerLys	ME648634	0.80	0.83	1.37
N,N-dimethylhistidine	ME648686	0.79	0.89	1.31
4-dodecynoicacid	ME648460	0.82	1.44	0.90
Cytosine	ME648569	0.77	1.35	0.79
5-(hydroxymethyl)-2-Furancarboxylicacid+5.6119556	ME648472	0.87	1.43	0.71
1-Phenyl-2-(diethylamino)-1-propanol	ME648391	0.84	1.38	0.74
Acetoaceticacid	ME648507	0.85	1.40	0.74
Bis(2-hydroxypropyl)amine+5.6003766	ME648543	0.97	1.24	0.73
3-DeoxyvitaminD3	ME648438	0.95	1.33	0.72
TROMETHAMINE+5.7465215	ME648781	0.92	1.33	0.74
ciclopirox	ME648558	0.88	1.30	0.80
5-NITRO-2-PHENYLPROPYLAMINOBENZOICACID[NPPB]+1.8134243	ME648478	0.86	1.29	0.83
Carbaryl	ME648551	0.88	1.29	0.83
GuanidinosuccinicAcid	ME648624	0.91	1.25	0.85
N-gamma-Acetyl-N-2-formyl-5-methoxykynurenamine	ME648700	0.87	1.24	0.87
TEGASEROD	ME648759	0.91	1.32	0.92
TrpArgGly	ME648787	0.88	1.37	0.88
L-gamma-Cyano-gamma-aminobutyricacid	ME648668	1.10	1.30	0.58
9-chloro-10-hydroxy-hexadecanoicacid	ME648498	0.99	1.23	0.82
14-methyl-1-hexadecanol	ME648369	1.06	1.14	0.79
Indole-3-ethanol+6.418022	ME648638	1.07	1.18	0.78
CARYLOPHYLLENEOXIDE	ME648553	1.03	1.20	0.78
D-1-Piperideine-2-carboxylicacid	ME648572	1.04	1.17	0.79
Chloramphenicolalcohol	ME648556	1.25	1.12	0.68
Proline+1.2899779	ME648734	1.14	1.13	0.74
Nalorphine	ME648695	1.17	1.09	0.75
TROMETHAMINE+5.4366517	ME648779	1.18	1.08	0.74
carisoprodol	ME648552	1.23	1.01	0.78
Urea+5.482235	ME648793	1.23	1.04	0.71
Benserazide	ME648529	1.21	0.80	0.90
6alpha-Hydroxycastasterone	ME648485	1.34	0.81	0.85
3-(3-Indolyl)-2-oxopropanoicacid	ME648428	1.27	0.91	0.86
9-chloro-10-hydroxy-hexadecanoicacid+1.4075756	ME648499	1.29	0.91	0.85
Propofol	ME648738	1.29	0.86	0.85
Pyroglutamicacid+6.828353	ME648749	1.33	0.87	0.85
Pyroglutamicacid	ME648747	1.16	0.64	1.19
2-Amino-2-methyl-1-propanol+5.645574	ME648401	1.22	0.79	1.03
Indoleacrylicacid	ME648640	1.16	0.78	1.04
Pyroglutamicacid+5.8255005	ME648748	1.16	0.82	1.03
Dihydroxylycopene/OH-Rhodopin	ME648590	1.20	0.71	1.09
TrpAlaIle	ME648786	1.14	0.73	1.13
Tiamulin	ME648765	1.15	0.74	1.10
2R-aminoheptanoicacid	ME648425	1.14	0.76	1.10
3alpha,12alpha,25-trihydroxy-5beta-cholestan-7-one	ME648435	1.13	0.76	1.11
1-Methylguanine	ME648385	1.30	0.67	1.05
N-arachidonoylD-serine	ME648697	1.44	0.75	0.99
Salicyluricacid	ME648753	1.01	1.12	0.93
BiliverdinIX+1.6236403	ME648538	0.99	1.13	0.88
Isoniazid	ME648647	0.99	1.10	0.89
2-Amino-2-methyl-1-propanol	ME648397	0.98	1.11	0.90
BiliverdinIX	ME648535	0.98	1.11	0.91
dimethylsulfoxide	ME648597	0.94	1.12	0.95
(Z)-N-(2-hydroxyethyl)hexadec-7-enamide	ME648346	0.95	1.13	0.95
Ketaminemetabolite(Cyclohexanone,2-(2-chlorophenyl)-5-hydroxy-2-(methylamino)-)	ME648653	0.93	1.10	0.95
Hydroxyhydroquinone+2.737934	ME648631	0.92	1.11	0.97
4-Hydroxypyridine+1.305617	ME648465	0.92	1.12	0.96
EthosuximideM7	ME648613	0.93	1.11	0.96
Phenacetine	ME648722	0.96	1.07	0.97
2-Pyrrolidinone+3.2970328	ME648423	0.96	1.07	0.97
CysIleHis	ME648568	0.96	1.07	0.97
Bilirubin	ME648533	0.99	1.06	0.95
(22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,24-tetradehydro-24a-homo-20-epivitaminD3/(22R)-1a	ME648336	0.97	1.07	0.95
Mefloquine	ME648676	0.98	1.07	0.95
Acetamide+1.3928151	ME648505	0.99	1.08	0.92
5-Methylthioribose	ME648476	0.98	1.08	0.93
TROMETHAMINE	ME648777	0.98	1.09	0.93
(24S)-1alpha,24-dihydroxy-22-oxa-20-epivitaminD3/(24S)-1alpha,24-dihydroxy-22-oxa-20-epicholecalc	ME648340	0.96	1.11	0.94
6,8,10,12-pentadecatetraenal	ME648482	0.97	1.10	0.94
Pinacidil	ME648728	0.97	1.10	0.93
epsilon-Caprolactam+6.1013503	ME648607	0.95	1.10	0.96
LEVULINICACID,3-BENZYLIDENYL-	ME648667	0.96	1.09	0.95
N1-Acetylspermidine	ME648689	0.91	1.21	0.90
(23R,25R)-1alpha,25-dihydroxyvitaminD326,23-lactone/(23R,25R)-1alpha,25-dihydroxycholecalciferol	ME648339	0.92	1.18	0.92
TROMETHAMINE+6.6530137	ME648785	0.92	1.18	0.90
N(pai)-Methyl-L-histidine	ME648685	0.92	1.15	0.93
Tranexamicacid+6.7028675	ME648769	0.95	1.13	0.91
Tranexamicacid	ME648767	0.96	1.15	0.89
Pergolide	ME648720	0.94	1.16	0.91
AsnAlaAsn	ME648525	0.95	1.15	0.91
Estronesulfate	ME648611	0.96	1.16	0.91
Aniline	ME648520	0.98	1.16	0.85
D-Leucicacid+1.7741078	ME648602	0.92	1.18	0.85
Dimethylglycine+2.050125	ME648592	1.10	0.94	0.96
QUERCETINTETRAMETHYL(5,7,3^,4^)ETHER	ME648750	1.09	0.92	0.99
1-(2-Pyrimidyl)piperazine+5.2760143	ME648349	1.09	0.92	0.99
LeuPro	ME648664	1.09	0.92	0.99
Parasiloxanthin/7,8-Dihydrozeaxanthin	ME648717	1.09	0.94	0.98
TROMETHAMINE+6.2190123	ME648784	1.10	0.93	0.98
ANCITABINE	ME648519	1.10	0.93	0.98
o-Toluenesulfamide	ME648714	1.10	0.93	0.98
PantothenicAcid	ME648716	1.13	0.93	0.94
3-oxo-4-pentenoicacid	ME648446	1.13	0.92	0.97
L-2-Aminoadipicacid	ME648655	1.14	0.91	0.96
1-octadecanoyl-rac-glycerol	ME648390	1.09	0.84	1.03
MetTrpGln	ME648680	1.12	0.85	1.03
Ergoline-8-methanol,10-methoxy-1,6-dimethyl-	ME648609	1.15	0.87	0.98
Proline	ME648733	1.13	0.88	0.99
2,5-decadienoicacid	ME648393	1.12	0.88	1.01
Ethosuximide	ME648612	1.11	0.89	1.00
p-Coumaricacid	ME648718	1.08	0.90	1.02
3R-hydroxy-5Z-dodecenoicacid	ME648447	1.07	0.91	1.02
1-hexadecanoyl-sn-glycerol	ME648379	1.08	0.91	1.02
3-Indolepropionicacid	ME648443	1.08	0.92	1.02
4-Aminobutyraldehyde+6.510029	ME648459	1.05	0.89	1.02
Fexofenadine	ME648614	1.06	0.89	0.99
1-(9Z,12Z-octadecadienoyl)-rac-glycerol	ME648351	1.04	0.91	1.05
25-hydroxy-26,27-dimethylvitaminD3/25-hydroxy-26,27-dimethylcholecalciferol	ME648396	1.05	0.92	1.04
Ecgonine-methylester	ME648604	1.05	0.92	1.04
(24S)-1alpha,24-dihydroxy-22-oxavitaminD3/(24S)-1alpha,24-dihydroxy-22-oxacholecalciferol	ME648341	1.06	0.93	1.03
1-(11E-octadecenoyl)-rac-glycerol	ME648347	1.05	0.94	1.01
3-tert-butyl-3-butenoicacid	ME648448	1.05	0.93	1.02
DIHYDROFISSINOLIDE	ME648588	1.04	0.94	1.02
AsnProLys	ME648526	1.04	0.93	1.03
TROMETHAMINE+5.9955096	ME648783	1.04	0.93	1.03
Taurine	ME648758	1.00	0.94	1.06
Bis(2-hydroxypropyl)amine+5.481559	ME648542	1.02	0.93	1.05
Diethanolamine+5.527126	ME648582	1.02	0.94	1.05
Dimethylglycine	ME648591	1.02	0.93	1.03
OLEANANOICACIDACETATE	ME648712	1.02	0.93	1.04
Niacinamide	ME648703	1.09	0.86	1.11
8-Amino-7-oxononanoate+7.294702	ME648493	1.05	0.85	1.10
4,7,10,13,16-docosapentaenoicacid	ME648451	1.03	0.88	1.08
PROPOXUR	ME648739	1.04	0.88	1.10
2-Octenedioicacid	ME648418	1.05	0.90	1.06
8R-hydroxy-9Z-octadecenoicacid	ME648496	1.06	0.89	1.06
5-(hydroxymethyl)-2-Furancarboxylicacid+5.7976537	ME648473	1.06	0.86	1.07
Tranexamicacid+1.6364517	ME648768	1.07	0.86	1.06
8-methoxy-13-hydroxy-9,11-octadecadienoicacid	ME648495	1.09	0.89	1.07
Dimethylglycine+6.2130203	ME648595	1.09	0.87	1.05
IsoquinolineN-oxide	ME648650	0.92	1.02	1.10
Vigabatrin	ME648805	0.89	1.00	1.12
1-Methyladenosine	ME648384	0.91	1.02	1.07
ISOSAFROLE	ME648651	0.92	1.01	1.05
Diethanolamine+6.6559505	ME648587	0.92	1.03	1.05
N-Methyl-2-pyridone-5-carboxamide(Nudifloramide)	ME648704	0.93	1.02	1.05
D-Homogesterone	ME648577	0.92	1.02	1.06
Valine	ME648801	0.93	1.02	1.06
AlaSerTrp	ME648515	0.91	1.06	1.04
Propionylglycinemethylester	ME648735	0.89	1.05	1.06
2-Methylbutyrylglycine+6.5558777	ME648417	0.90	1.04	1.05
Homoserine	ME648629	0.91	1.04	1.06
8-Amino-7-oxononanoate	ME648492	0.84	1.05	1.09
isoamylnitrite	ME648644	0.87	1.05	1.08
Pyridoxamine	ME648746	0.88	1.04	1.07
3-Aminoquinoline	ME648437	0.88	1.13	0.99
5-oxo-7-octenoicacid	ME648480	0.89	1.08	1.03
Dimethylglycine+2.8044205	ME648593	0.88	1.09	1.03
Isoquinoline	ME648649	0.90	1.07	1.02
2-Hydroxyiminodibenzyl	ME648412	0.90	1.09	1.01
ValHisAsn	ME648800	0.91	1.08	1.01
6-methyltetrahydropterin	ME648488	0.93	1.07	1.02
12-amino-dodecanoicacid	ME648360	0.93	1.05	1.02
16-hydroperoxy-9Z,12,14E-octadecatrienoicacid	ME648370	0.93	1.06	1.02
Adenine	ME648512	0.95	1.06	0.99
N-propyl-16,16-dimethyl-5Z,8Z,11Z,14Z-docosatetraenoylamine	ME648710	0.94	1.07	1.00
Urea	ME648792	0.92	1.09	1.00
LeuProPro	ME648666	0.93	1.08	0.99
Uricacid	ME648794	0.93	1.09	0.98
Arginine	ME648524	0.92	0.95	1.10
beta-Alanine+6.93935	ME648531	0.90	0.95	1.09
n-methylnicotinamide+6.0330334	ME648707	0.95	0.97	1.08
Lorazepamglucuronide	ME648671	0.94	0.96	1.09
4-Aminobutyraldehyde+5.617605	ME648458	0.95	0.96	1.10
DL-2-Aminooctanoicacid	ME648598	0.95	0.96	1.10
3-Amino-2-piperidone	ME648436	0.96	0.94	1.10
Tiamulin+6.5371113	ME648766	0.96	0.93	1.12
Ubiquinone	ME648789	0.98	0.95	1.10
5-(hydroxymethyl)-2-Furancarboxylicacid	ME648471	0.97	0.93	1.07
4-(diaminomethylideneamino)butanoicacid	ME648449	0.97	0.95	1.08
ValSerLys	ME648803	0.98	0.94	1.08
2-Pyrrolidinone+2.0697286	ME648421	0.96	0.98	1.06
DIHYDRO-OBLIQUIN	ME648589	0.97	0.98	1.05
HECOGENINACETATE	ME648627	0.95	1.00	1.05
Indoleacrylicacid+5.610031	ME648643	0.94	1.00	1.05
Triparanol+6.444099	ME648774	0.96	0.99	1.05
12beta-Hydroxy-3-oxo-5beta-cholan-24-oicAcid+1.0063637	ME648362	0.95	0.99	1.06
1-Hexadecyl-2-arachidonoyl-glycerol	ME648380	0.95	0.99	1.05
(E)-2-Methylglutaconicacid+2.7288678	ME648344	0.94	1.03	1.03
N-(2-hydroxyethyl)stearamide	ME648684	0.94	1.03	1.03
BiliverdinIX+1.4682751	ME648537	0.95	1.03	1.02
14-hydroxy-12-tetradecenoicacid	ME648368	0.94	1.02	1.02
cyclandelate	ME648563	0.94	1.03	1.02
2-docosanamidoethanesulfonicacid	ME648407	0.94	1.04	1.02
Hypoxanthine+2.7105587	ME648633	0.93	1.04	1.01
Indole-3-ethanol	ME648636	0.95	1.02	1.02
KOBUSONE	ME648654	0.96	1.02	1.02
Hippuricacid	ME648628	0.96	1.02	1.02
1-Methyluricacid	ME648389	0.96	1.02	1.02
AlaLeu	ME648514	0.96	1.02	1.02
OphiobolinA	ME648713	0.95	1.01	1.03
N^-5Z,8Z,11Z,14Z-eicosatetraenoyl-N^^-diethyl-ethylenediamine	ME648691	0.95	1.02	1.03
Urocanicacid	ME648796	0.95	1.02	1.03
Pinacidil+6.5333734	ME648729	0.94	1.02	1.04
2-Amino-3-methyl-1-butanol+6.472044	ME648403	0.95	1.01	1.04
LysGlnIle	ME648673	0.95	1.02	1.04
Norcodeine	ME648708	0.96	1.00	1.02
ValSerLys+1.0849711	ME648804	0.97	1.00	1.03
Ecgonine	ME648603	0.97	1.00	1.03
Pyridine	ME648745	0.97	1.00	1.03
1beta,25-dihydroxy-2beta-(3-hydroxypropoxy)vitaminD3/1beta,25-dihydroxy-2beta-(3-hydroxypropoxy)c	ME648378	0.97	0.99	1.04
N2,N2-Dimethylguanosine	ME648690	0.98	0.99	1.04
9R-hydroxy-10E-octadecenoicacid	ME648502	0.98	0.99	1.02
N-methyl-Gabapentin	ME648705	0.98	0.99	1.03
Glucoheptonicacid	ME648617	0.98	0.99	1.03
3,6-octadecadiynoicacid	ME648434	0.98	0.99	1.03
1-Methylpiperazine	ME648388	0.98	0.99	1.03
2-Amino-2-methyl-1-propanol+5.1998544	ME648399	0.98	0.99	1.03
VALERYLSALYCILATE	ME648799	0.98	0.98	1.03
N-(2-hydroxyethyl)palmitamide	ME648683	0.99	0.98	1.03
ProArgAsp	ME648731	0.99	0.98	1.03
Indole-3-ethanol+5.1084623	ME648637	0.99	0.99	1.02
Netilmicin	ME648698	0.98	1.00	1.02
2-tridecene-4,7-diynal	ME648427	0.98	1.00	1.02
4,8,12,15,19,21-tetracosahexaenoicacid	ME648453	0.98	1.00	1.02
n-HexanoicAcid	ME648701	0.99	1.00	1.01
Indoleacrylicacid+5.4790144	ME648641	0.99	1.00	1.01
1alpha,25-dihydroxy-3-deoxy-3-thiavitaminD3/1alpha,25-dihydroxy-3-deoxy-3-thiacholecalciferol	ME648376	0.99	1.00	1.01
1-(9Z-hexadecenoyl)-2-(9Z,12Z-heptadecadienoyl)-sn-glycerol	ME648352	0.99	1.00	1.01
1alpha,25-dihydroxy-2beta-(5-hydroxypentoxy)vitaminD3/1alpha,25-dihydroxy-2beta-(5-hydroxypentoxy	ME648375	0.99	1.00	1.01
4-Pyridoxicacid+2.8116002	ME648468	0.99	1.00	1.02
Amiloride	ME648517	0.99	1.00	1.02
sn-1,2-Dioctanoylglycerol	ME648755	0.98	1.01	1.01
L-Urobilin	ME648672	0.98	1.01	1.01
cyclohexylammonium	ME648564	0.98	1.01	1.01
7-Aminoclonazepam	ME648491	0.98	1.01	1.01
(1S,2S)-3-oxo-2-pentyl-cyclopentanebutanoicacid	ME648333	0.98	1.01	1.01
4-Aminobutyraldehyde+5.382866	ME648457	0.98	1.01	1.01
Cytosine+3.4283657	ME648570	0.97	1.01	1.02
Asymmetricdimethylarginine	ME648527	0.97	1.01	1.02
8-Hydroxypromazine	ME648494	0.97	1.01	1.02
10-hydroxy-2E,8E-Decadiene-4,6-diynoicacid+1.2059581	ME648358	0.97	1.01	1.02
2R-aminoheptanoicacid+6.352442	ME648426	0.97	1.01	1.02
Uridine	ME648795	0.97	1.02	1.01
1alpha,25-dihydroxy-24-oxovitaminD_3/1alpha,25-dihydroxy-24-oxocholecalciferol	ME648374	0.97	1.02	1.01
Leucine+4.3551145	ME648660	0.97	1.02	1.01
GluGlu	ME648620	1.00	1.05	0.95
4-Aminobutyraldehyde+5.271877	ME648456	1.01	1.04	0.95
Purine	ME648741	1.01	1.04	0.95
Hypoxanthine	ME648632	0.98	1.04	0.96
Acetoin+1.2081687	ME648509	1.00	1.04	0.97
TEGASEROD+6.4934783	ME648760	0.99	1.05	0.97
2-Hydroxyadipicacid	ME648409	0.98	1.02	1.00
AGELASINE	ME648513	0.99	1.02	1.00
beta-vinylacrylicacid	ME648532	0.99	1.02	0.99
Terephthalicacid	ME648761	0.98	1.02	0.99
Methylglyoxal+2.6626153	ME648679	1.00	1.02	0.98
Phenylethylmalonamide(PEMA)	ME648723	1.00	1.02	0.98
Chlorambucil	ME648555	0.98	1.04	0.98
2-Amino-2-methyl-1-propanol+4.6926875	ME648398	0.99	1.03	0.99
5-(3,4-Dihydroxy-1,5-cyclohexadien-1-yl)-5-phenylhydantoin	ME648470	0.99	1.03	0.98
n-methylnicotinamide	ME648706	0.99	1.03	0.98
pentanamide	ME648719	0.97	1.05	0.98
11-deoxy-PGE2	ME648359	0.96	1.05	0.98
3^-Methoxy-E,E-dienoestrol	ME648444	0.96	1.05	0.99
1-(2-Pyrimidyl)piperazine	ME648348	0.96	1.03	1.01
Methionine	ME648677	0.96	1.03	1.00
1alpha,25-dihydroxy-22-oxavitaminD33-hemiglutarate/1alpha,25-dihydroxy-22-oxacholecalciferol3-he	ME648373	0.95	1.04	1.00
B-ureidoisobutyricacid	ME648546	0.96	1.04	1.00
(22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,24-tetradehydro-24a-homo-20-epivitaminD3/(22R)-1a+1.1406572	ME648337	0.97	1.03	1.00
4-Hydroxypyridine	ME648464	0.98	1.03	1.00
Lacticacid	ME648658	0.97	1.04	0.99
Capryloylglycine	ME648550	0.97	1.03	0.99
INDOLE-3-CARBINOL	ME648635	0.96	1.03	0.99
ARECOLINE	ME648523	0.98	0.96	1.06
Diethanolamine+5.8253593	ME648584	0.98	0.97	1.06
Purine+0.8148545	ME648742	1.00	0.95	1.05
LeuPro+8.030013	ME648665	1.00	0.96	1.05
L-2-Aminoadipicacid+2.5918813	ME648656	1.00	0.96	1.04
Triparanol+6.739891	ME648775	1.00	0.96	1.04
Uracil	ME648791	1.00	0.95	1.03
BiliverdinIX+1.4045436	ME648536	1.01	0.96	1.03
12-oxo-9-octadecynoicacid	ME648365	1.01	0.96	1.03
3,4,5-Trimethoxycinnamicacid	ME648431	1.01	0.96	1.03
12-Ketodeoxycholicacid	ME648364	1.01	0.95	1.04
N,O-Didesmethylvenlafaxine	ME648687	1.01	0.95	1.03
1alpha,25-dihydroxy-11beta-phenylvitaminD3/1alpha,25-dihydroxy-11beta-phenylcholecalciferol	ME648372	1.00	0.98	1.03
Theobromine+1.4370109	ME648764	1.00	0.97	1.03
MYCOPHENOLICACID	ME648681	1.00	0.97	1.03
Diacetyl+2.5974343	ME648579	1.00	0.97	1.03
2,4-octadienal	ME648392	1.00	0.97	1.03
4-Hydroxybenzylcyanide+6.609466	ME648463	1.00	0.97	1.03
Propionylglycinemethylester+3.163646	ME648736	0.99	0.98	1.04
2-Amino-2-methyl-1-propanol+5.3564744	ME648400	0.99	0.97	1.04
5-Acetyl-4-methylthiazole	ME648474	0.99	0.97	1.04
Triparanol+7.1791935	ME648776	0.98	0.97	1.04
Ubiquinone+1.1367501	ME648790	0.98	0.98	1.04
2-Methylbutyrylglycine	ME648414	1.01	1.00	0.98
Pinacidil-N-Oxide	ME648730	1.01	1.00	0.99
Trimethylamine	ME648772	1.02	0.99	0.98
o-Hydroxyaniline	ME648711	1.02	0.99	0.99
Isoleucine	ME648646	1.02	0.99	0.99
2-Pyrrolidinone+2.8319786	ME648422	1.02	0.99	0.99
3,6,8-dodecatrien-1-ol	ME648433	1.02	0.99	0.99
URSINICACID	ME648798	1.00	0.99	1.01
5-NITRO-2-PHENYLPROPYLAMINOBENZOICACID[NPPB]+2.088407	ME648479	1.00	0.99	1.01
Acetoin+1.6314733	ME648510	1.00	0.99	1.01
Cytosine+3.9679208	ME648571	1.00	0.99	1.02
2-Methyl-5-isopropylhexa-2Z,5-dienal	ME648413	1.00	0.98	1.02
PGF2alphaisopropylester	ME648721	1.00	0.98	1.02
3-Nitrotyrosine	ME648445	1.01	1.00	1.00
(E)-2-Methylglutaconicacid	ME648343	1.01	1.00	1.00
Glycoursodeoxycholicacid	ME648623	1.00	1.00	1.00
p-Hydroxyaniline	ME648726	1.00	1.00	1.00
Leucine+5.7213707	ME648661	1.01	0.98	1.01
myo-Inositol	ME648682	1.01	0.98	1.01
2-Oxo-4E-hexenoicacid	ME648419	1.01	0.98	1.00
N1,N4-Diacetylsulfanilamide	ME648688	1.01	0.99	1.00
Diethanolamine	ME648581	1.01	0.99	1.00
Estradiolvalerate	ME648610	1.01	0.99	1.00
5-Ethyl-5-(1-methyl-3-carboxypropyl)barbituricacid	ME648475	1.03	0.95	1.01
beta-Alanine	ME648530	1.03	0.95	1.00
(20R)-1alpha,25-dihydroxy-20-phenyl-16,17-didehydro-21-norvitaminD3/(20R)-1alpha,25-dihydroxy-20-	ME648334	1.03	0.96	1.02
BiliverdinIX+3.9496963	ME648540	1.03	0.95	1.02
1,2-Didecanoyl-glycerol(10:0)	ME648353	1.03	0.95	1.02
1alpha,18-dihydroxyvitaminD_3/1alpha,18-dihydroxycholecalciferol	ME648371	1.03	0.95	1.02
D-Biotin	ME648573	1.02	0.96	1.02
Acetamide	ME648504	1.02	0.95	1.02
Bis(2-hydroxypropyl)amine	ME648541	1.02	0.95	1.03
(10E)-19-fluorovitaminD3/(10E)-19-fluorocholecalciferol	ME648332	1.02	0.97	1.01
N-Acetylarylamine	ME648692	1.02	0.97	1.01
L-4-Hydroxy-3-methoxy-a-methylphenylalanine	ME648657	1.01	0.97	1.02
Nevirapine	ME648699	1.01	0.97	1.02
Hydroxyhydroquinone	ME648630	1.03	0.96	1.00
campesta-5,22E-dien-3beta-ol	ME648549	1.04	0.97	1.00
stigmasta-7,22E,25-trien-3beta-ol	ME648756	1.03	0.97	1.00
deschlorobenzoylIndomethacin	ME648574	1.03	0.97	1.00
ProTyr	ME648740	1.03	0.97	1.00
Sulfaquinoxaline	ME648757	1.02	0.98	1.00
isoamylnitrite+1.8073217	ME648645	1.02	0.98	1.00
Leucine+6.7406497	ME648662	1.02	0.98	1.00
12Z,15Z-octadecadienoicacid	ME648366	1.03	0.98	0.99
DL-2-Aminooctanoicacid+6.892978	ME648600	1.03	0.98	1.00
2-Amino-3-methyl-1-butanol	ME648402	1.01	1.02	0.96
(3-Methoxy-4-hydroxyphenyl)ethyleneglycolsulfate	ME648342	1.02	1.02	0.96
Trihydroxycoprostanoicacid	ME648771	1.02	1.02	0.96
Formestane	ME648615	1.03	1.00	0.97
Mazindol	ME648675	1.03	1.00	0.97
1alpha-hydroxy-18-[m-(1-hydroxy-1-ethylpropyl)-benzyloxy]-23,24,25,26,27-pentanorvitaminD3/1alpha	ME648377	1.04	1.01	0.96
25-Hydroxy[26,27-methyl]vitaminD33beta-(1,2-epoxypropyl)ether	ME648395	1.03	1.01	0.96
Diacetyl	ME648578	1.03	1.00	0.96
2-Hydroxyadipicacid+2.74419	ME648411	1.04	1.00	0.96
6-Formylindolo[3,2-B]carbazole	ME648487	1.04	1.00	0.96
Methylglyoxal	ME648678	1.05	1.00	0.97
Theobromine	ME648763	1.04	0.99	0.97
Indoleacrylicacid+5.505976	ME648642	1.07	0.96	0.98
cyclohexylammonium+5.197659	ME648566	1.08	0.95	0.97
Valine+6.60313	ME648802	1.07	0.94	0.97
DL-2-Aminooctanoicacid+6.14302	ME648599	1.05	0.96	0.99
3-IndoleaceticAcid	ME648442	1.05	0.96	0.99
Chloramphenicolalcohol+3.2187703	ME648557	1.05	0.96	0.99
N-HISTIDYL-2-AMINONAPHTHALENE(betaNA)	ME648702	1.04	0.97	0.99
(+/-)14,15-EpETrE	ME648331	1.05	0.97	0.98
1-(9Z,12Z-heptadecadienoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-sn-glycerol	ME648350	1.04	0.97	0.98
cis-11-Hexadecenal	ME648559	1.04	0.97	0.98
Diacetyl+2.7385557	ME648580	1.05	0.98	0.96
7,12-Dioxo-5beta-cholan-24-oicAcid	ME648489	1.06	0.97	0.96
6-[3]-ladderane-1-hexanol	ME648484	1.06	0.96	0.97
Acetamide+2.071302	ME648506	1.06	0.97	0.97
D-Leucicacid	ME648601	1.19	0.86	0.93
ACECLIDINE	ME648503	1.19	0.90	0.94
Glutaral(Glutaraldehyde)+6.687109	ME648622	1.18	0.90	0.93
Creatinine+4.034313	ME648562	1.18	0.93	0.89
Purine+1.0468682	ME648743	1.19	0.94	0.88
Creatinine	ME648561	1.15	0.99	0.86
TROMETHAMINE+5.827722	ME648782	1.14	0.95	0.91
Ectoine	ME648605	1.15	0.95	0.90
Leupeptin	ME648663	1.15	0.95	0.90
2-Methylbutyrylglycine+2.0774822	ME648415	1.13	0.97	0.89
3E,13Z-octadecadien-1-ol	ME648440	1.14	0.99	0.90
Diethanolamine+6.525427	ME648586	1.05	1.05	0.90
Indoleacetaldehyde	ME648639	1.05	1.06	0.90
9-lauroleicacid	ME648501	1.07	1.05	0.88
epsilon-Caprolactam+6.236251	ME648608	1.07	1.03	0.89
20-oxo-heneicosanoicacid	ME648394	1.04	1.05	0.93
cefamandolenafate	ME648554	1.04	1.06	0.93
Rimiterol	ME648752	1.01	1.05	0.93
(E)-2-Methylglutaconicacid+7.1860867	ME648345	1.02	1.05	0.92
4,6-dioxoheptanoicacid	ME648450	1.02	1.06	0.92
Tetrahydrofuran	ME648762	1.02	1.06	0.92
5-NITRO-2-PHENYLPROPYLAMINOBENZOICACID[NPPB]	ME648477	1.03	1.04	0.92
4-Aminobutyraldehyde+5.1793814	ME648455	1.03	1.05	0.92
p-HYDROXYCINNAMALDEHYDE	ME648727	1.03	1.05	0.92
Glucosamine	ME648618	1.03	1.05	0.93
p-Aminobenzoicacid	ME648715	1.02	1.05	0.93
Dimethylglycine+6.4713974	ME648596	1.03	1.02	0.94
Propionylglycinemethylester+6.2598743	ME648737	1.03	1.03	0.94
(23R)-1alpha,23,25-trihydroxy-24-oxovitaminD3/(23R)-1alpha,23,25-trihydroxy-24-oxocholecalciferol	ME648338	1.05	1.02	0.93
Phenylmethylmethylketone	ME648724	1.05	1.03	0.94
C17Sphinganine	ME648547	1.11	0.96	0.91
6,9,12-hexadecatrienoicacid	ME648483	1.10	0.98	0.91
D-Glucose+2.9642036	ME648576	1.09	0.99	0.92
2-decylenicacid	ME648406	1.09	1.00	0.94
2-Methylbutyrylglycine+3.1958613	ME648416	1.08	0.99	0.94
Isopentenyladenine	ME648648	1.07	0.99	0.95
Nadolol	ME648694	1.06	1.00	0.95
10-hydroxy-2E,8E-Decadiene-4,6-diynoicacid	ME648357	1.08	0.96	0.95
5Z,8Z-tetradecadienoicacid	ME648481	1.07	0.97	0.95
HARMINE	ME648626	1.10	0.97	0.93
4-Hydroxybenzylcyanide+6.59952	ME648462	1.10	0.97	0.95
Pyrazinoicacid	ME648744	1.09	0.97	0.95
9-hydroxy-12-oxo-10-octadecenoicacid	ME648500	1.07	1.00	0.89
Acipimox	ME648511	1.10	1.02	0.92
ANISOMYCIN	ME648522	1.04	1.10	0.86
Glucosamine+2.7338603	ME648619	1.04	1.10	0.85
1-Methylguanosine	ME648386	1.04	1.11	0.83
alpha-Hydroxymetoprolol	ME648516	1.05	1.11	0.84
1,3-DIPROPYL-8-CYCLOPENTYLXANTHINE[DPCPX]	ME648354	1.09	1.06	0.79
6alpha-Hydroxycastasterone+1.0918373	ME648486	1.11	1.05	0.86
Aniline+5.6175404	ME648521	1.09	1.06	0.85
LysHisMet	ME648674	1.13	1.05	0.82
2-Aminopropanol+6.3286147	ME648405	1.14	1.02	0.84
3E,5E-tridecadienoicacid	ME648441	1.13	1.02	0.83
1-Hexadecylamine+3.6542141	ME648382	1.02	0.70	1.28
Triparanol	ME648773	0.92	0.74	1.33
Bilirubin+3.949239	ME648534	0.96	0.85	1.20
4-Aminobutyraldehyde	ME648454	0.96	0.85	1.18
L-gamma-Cyano-gamma-aminobutyricacid+1.2438003	ME648669	0.96	0.86	1.19
cyclohexylammonium+2.7358363	ME648565	0.95	0.85	1.16
TROMETHAMINE+5.5924644	ME648780	0.96	0.88	1.16
Anandamide(20:2,n-6)	ME648518	1.01	0.84	1.15
12beta-Hydroxy-3-oxo-5beta-cholan-24-oicAcid	ME648361	1.02	0.87	1.14
4-Pyridoxicacid	ME648467	1.03	0.88	1.12
7,8-dihydroxystearicacid	ME648490	1.05	0.83	1.22
GuanidinosuccinicAcid+5.802178	ME648625	0.98	0.74	1.16
Acetoin	ME648508	1.00	0.77	1.21
Creatine	ME648560	1.01	0.79	1.20
BiliverdinIX+2.0339859	ME648539	0.90	0.84	1.26
Diethanolamine+5.649868	ME648583	0.95	0.92	1.23
2-Pyrrolidinone	ME648420	0.87	0.92	1.22
4-Hydroxypyridine+3.056915	ME648466	0.84	0.93	1.22
Diethanolamine+6.332912	ME648585	0.91	0.94	1.15
S-Methylpenicillamine	ME648754	0.90	0.93	1.18
2-Pyrrolidinone+3.786596	ME648424	0.88	0.97	1.16
Quinone	ME648751	0.85	0.96	1.18
3,3,45-Tetrahydroxystilbene	ME648429	0.67	1.37	1.00
1,4-Methylimidazoleaceticacid	ME648355	0.68	1.22	1.14
9-amino-nonanoicacid	ME648497	0.80	1.10	1.11
D-Glucose	ME648575	0.77	1.05	1.07
Gabapentin	ME648616	0.77	1.06	1.17
Caffeine	ME648548	0.77	0.99	1.14
ProHis	ME648732	0.81	1.00	1.16
2-Aminopropanol	ME648404	0.83	1.10	1.03
2-Hydroxyadipicacid+2.0358596	ME648410	0.79	1.17	1.04
epsilon-Caprolactam	ME648606	0.83	1.16	1.02
Naphazoline	ME648696	0.83	1.16	1.01
4-Hydroxybenzylcyanide	ME648461	0.75	1.24	1.01
TROMETHAMINE+5.1856112	ME648778	0.77	1.21	0.90
12beta-Hydroxy-3-oxo-5beta-cholan-24-oicAcid+1.175578	ME648363	1.79	0.48	0.91
Glutaral(Glutaraldehyde)	ME648621	1.54	0.50	0.95
N-Acetylcadaverine	ME648693	1.62	0.41	0.97
(22E,24E)-1alpha,25-dihydroxy-26,27-diethyl-22,23,24,24a-tetradehydro-24a-homovitaminD3/(22E,24E)	ME648335	1.58	0.76	0.63
Vigabatrin+6.2900124	ME648806	1.53	0.81	0.64
3,4-Dihydrospirilloxanthin	ME648432	1.60	0.67	0.84
4,7,10,13-hexadecatetraenoicacid	ME648452	1.63	0.67	0.72
1-Hexadecylamine	ME648381	1.32	1.16	0.50
CysAsnThr	ME648567	1.35	0.99	0.64
PhthalicacidMono-2-ethylhexylEster	ME648725	1.38	1.03	0.63
3-dodecynoicacid	ME648439	1.37	0.94	0.76
4-undecynoicacid	ME648469	1.40	0.93	0.68
Dimethylglycine+4.069634	ME648594	1.57	0.97	0.49
Leucine	ME648659	1.47	1.05	0.56

Factors:

F1	Cognitive Status:AD
F2	Cognitive Status:CN
F3	Cognitive Status:MCI

Data matrix