Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for ms3076 T1D poor glycemic control and control samples (Study ST000421)

HILIC POSITIVE ION MODE (Analysis AN000663)

Metabolite	Structure	F1	F2
6-hydroxy-2-hexynoic acid	ME138437	1.94	0.06
BERGENIN	ME138453	1.98	0.02
L-Fucose	ME139408	2.00	0.00
Leu His Cys	ME138438	2.00	0.00
L-4-Hydroxy-3-methoxy-a-methylphenylalanine + 2.0514681	ME139699	2.00	0.00
Gly Gly Gly	ME139665	2.00	0.00
4-hydroxy-3,5-bis(1-methylethyl)phenyl glucuronide	ME139691	2.00	0.00
cefamandole nafate + 2.0600944	ME139667	2.00	0.00
Isoquinoline + 3.7221823	ME138640	1.80	0.20
L-4-Hydroxy-3-methoxy-a-methylphenylalanine	ME138454	1.89	0.11
4-Amino-6,7-dimethoxy-2-(1-piperazinyl)quinazoline	ME139248	1.84	0.16
cefamandole nafate	ME139663	1.86	0.14
p-HYDROXYCINNAMALDEHYDE	ME138966	1.86	0.14
GPEtn(O-16:0/22:5(4Z,7Z,10Z,13Z,16Z))	ME139454	0.46	1.54
1alpha-hydroxy-23-[3-(1-hydroxy-1-methylethyl)phenyl]-22,22,23,23-tetradehydro-24,25,26,27-tetranorv	ME138151	0.44	1.56
Diacetyl + 1.5359212	ME139376	0.44	1.56
5-O-Methylvisamminol	ME138295	0.45	1.55
Paraxanthine + 3.9014282	ME139445	0.45	1.55
9-amino-nonanoic acid	ME138248	0.38	1.62
p-Aminobenzoic acid + 6.457855	ME139532	0.38	1.62
Chlortetracycline	ME139430	0.41	1.59
Met Glu Cys	ME139436	0.41	1.59
Leucine	ME139015	0.66	1.34
GPEtn(18:1(11Z)/18:1(9Z))[U]	ME139373	0.64	1.36
1-Hexadecylamine + 3.5535161	ME138638	0.64	1.36
5-oxo-7-octenoic acid	ME139366	0.64	1.36
(22E,24E,24bE)-1alpha,25-dihydroxy-26,27-dimethyl-22,23,24,24a,24b,24c-hexadehydro-24a,24b,24c-triho + 1.1248193	ME139330	0.65	1.35
beta-vinyl acrylic acid	ME138506	0.65	1.35
Arginine	ME139641	0.63	1.37
Lys Asn Pro + 5.9515862	ME139633	0.62	1.38
L-2-Aminoadipic acid	ME138531	0.62	1.38
Lanthionine ketimine	ME137803	0.62	1.38
(3-Methoxy-4-hydroxyphenyl)ethylene glycol sulfate	ME139711	0.60	1.40
Oxprenolol	ME139360	0.60	1.40
n-Pentadecylamine	ME139410	0.61	1.39
Ecgonine	ME138991	0.61	1.39
Indole-3-ethanol + 6.3566046	ME139536	0.61	1.39
ACECLIDINE	ME138318	0.54	1.46
Limonene-1,2-epoxide + 1.2240425	ME138249	0.55	1.45
2-oxo capric acid	ME138051	0.55	1.45
2-Oxovaleric acid	ME139417	0.55	1.45
5,7-nonadienoic acid	ME138242	0.56	1.44
Acetoacetic acid + 2.6840415	ME138546	0.57	1.43
(5E,10Z)-19-fluoro-1alpha-hydroxyvitamin-D3 / (5E,10Z)-19-fluoro-1alpha-hydroxycholecalciferol	ME137921	0.57	1.43
9,13-dihydroxy-11-octadecenoic acid	ME137950	0.57	1.43
8-Amino-7-oxononanoate	ME138323	0.58	1.42
N-Didesethylquinagolide glucuronide	ME139516	0.59	1.41
1-Aminocyclohexanecarboxylic acid	ME139271	0.49	1.51
2-Amino-3-methyl-1-butanol + 5.2393837	ME139627	0.49	1.51
1-O-(1Z-hexadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine + 4.351981	ME139610	0.48	1.52
Benzene	ME139326	0.48	1.52
Ethanolamine phosphate (Phosphoethanolamine)	ME138490	0.53	1.47
11-deoxy-PGE2 + 1.1395481	ME138180	0.51	1.49
1-Aminocyclopropane-1-carboxylic acid	ME139239	0.52	1.48
4-Aminophenyl 1-thio-beta-D-glucuronide + 2.6188798	ME138535	0.52	1.48
N-Acetyl-9-O-lactoylneuraminic acid	ME139443	0.00	2.00
beta-vinyl acrylic acid + 2.7240262	ME138580	0.22	1.78
2-Hydroxyadipic acid + 2.7286863	ME139598	0.23	1.77
Gly Glu	ME139704	0.24	1.76
12beta-Hydroxy-3-oxo-5beta-cholan-24-oic Acid + 1.1757581	ME138192	0.26	1.74
2-Methylbutyrylglycine + 6.4871807	ME139207	0.28	1.72
(E)-2-Methylglutaconic acid + 2.7561738	ME139421	0.10	1.90
Glucosamine + 4.094891	ME139452	0.15	1.85
Linoleamide	ME139344	0.15	1.85
Lyxosylamine	ME139075	0.69	1.31
Indole-3-ethanol + 6.4458528	ME139193	0.69	1.31
Biliverdin IX	ME138311	0.69	1.31
1alpha,25-dihydroxy-11alpha-[(1R)-oxiranyl]vitamin D3 / 1alpha,25-dihydroxy-11alpha-[(1R)-oxiranyl]c + 4.5681615	ME139701	0.69	1.31
5Z,8Z-tetradecadienoic acid	ME137983	0.69	1.31
Benserazide	ME139556	0.68	1.32
Metoprolol acid	ME138370	0.68	1.32
TEGASEROD	ME139492	0.71	1.29
(E)-2-Methylglutaconic acid	ME138509	0.71	1.29
HYDROLYSIS PRODUCT OF BUSSEIN + 1.4087132	ME139587	0.71	1.29
Triparanol + 6.662329	ME139240	0.70	1.30
Pro His Gly	ME138367	0.70	1.30
Succinic anhydride	ME138539	0.70	1.30
Phenylalanine	ME139017	0.78	1.22
Hydroxyhydroquinone	ME138512	0.78	1.22
Bis (2-hydroxypropyl) amine + 5.2407393	ME138872	0.78	1.22
Capryloylglycine	ME138488	0.78	1.22
Vigabatrin + 6.230679	ME139115	0.77	1.23
D-Glucose	ME138297	0.77	1.23
Biliverdin IX + 5.3967257	ME139629	0.77	1.23
Acetoacetic acid	ME138528	0.77	1.23
1-(9Z-hexadecenoyl)-2-(9Z,12Z-heptadecadienoyl)-sn-glycerol	ME137951	0.77	1.23
3-(a-Naphthoxy)lactic acid glucuronide	ME138559	0.77	1.23
o-Hydroxyaniline	ME137805	0.76	1.24
Methylglyoxal + 0.99377394	ME139306	0.76	1.24
Adenine	ME138593	0.76	1.24
8-Amino-7-oxononanoate + 1.2685084	ME139582	0.76	1.24
1alpha,25-dihydroxy-2beta-(5-hydroxypentoxy)vitamin D3 / 1alpha,25-dihydroxy-2beta-(5-hydroxypentoxy	ME138068	0.76	1.24
7,8-dihydroxy stearic acid	ME137958	0.76	1.24
Tetrahydrothiophene sulfoxide	ME138619	0.75	1.25
Methylglyoxal + 2.6880658	ME138547	0.75	1.25
Crotonic acid	ME139415	0.75	1.25
Bis (2-hydroxypropyl) amine + 5.448429	ME138932	0.75	1.25
3-Oxovalproic acid	ME138812	0.75	1.25
(22E)-3beta-Hydroxychola-5,22-dien-24-oic Acid	ME138215	0.75	1.25
2-Pyrrolidinone	ME138254	0.75	1.25
Vidarabine	ME138592	0.74	1.26
Quinone + 2.690432	ME138542	0.74	1.26
Phe Leu	ME139604	0.74	1.26
Leucine + 6.6482687	ME139238	0.74	1.26
2,5-decadienoic acid	ME138033	0.74	1.26
Ethosuximide	ME138661	0.74	1.26
Tacrolimus	ME139363	0.73	1.27
Indole-3-ethanol + 5.098097	ME138835	0.73	1.27
Hypoxanthine + 2.7262764	ME139412	0.73	1.27
2-Hydroxyadipic acid	ME138510	0.73	1.27
glyceraldehyde	ME138543	0.73	1.27
stigmasta-7,22E,25-trien-3beta-ol	ME137941	0.72	1.28
Poloxalene	ME138286	0.72	1.28
Mono-N-depropylprobenecid	ME139399	0.72	1.28
Guanidinosuccinic Acid	ME139012	0.72	1.28
Ethosuximide + 5.3117914	ME139489	0.72	1.28
cyclohexylammonium + 4.9269075	ME138801	0.72	1.28
2-Methylbutyrylglycine	ME138397	0.72	1.28
4-pentyn-1-ol	ME138238	0.72	1.28
Urocanic acid	ME138371	0.88	1.12
Pyridine	ME138283	0.88	1.12
Lys Leu Ser	ME137876	0.88	1.12
GPEtn(20:2(5Z,8Z)/18:0)[S]	ME138844	0.88	1.12
B-ureidoisobutyric acid	ME139427	0.88	1.12
beta-Alanine	ME139151	0.88	1.12
8R-hydroxy-9Z-octadecenoic acid	ME137940	0.88	1.12
4-Hydroxylevamisole Glucuronide	ME139503	0.88	1.12
4-Guanidinobutanoate	ME139083	0.88	1.12
1-(14-methyl-pentadecanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerol	ME139612	0.88	1.12
12beta-Hydroxy-3-oxo-5beta-cholan-24-oic Acid	ME137823	0.88	1.12
Phenylethylamine	ME139490	0.87	1.13
N-Acryloylglycine	ME138838	0.87	1.13
Glucosamine	ME138525	0.87	1.13
cyclohexylammonium + 4.572306	ME138749	0.87	1.13
11-deoxy-PGE2	ME138063	0.87	1.13
13E,17-octadecadienoic acid	ME137949	0.87	1.13
N-Didesethylquinagolide sulfate	ME138667	0.90	1.10
9-lauroleic acid	ME137912	0.90	1.10
2-Amino-3-methyl-1-butanol + 6.443457	ME139183	0.90	1.10
2,4-Diamino-6,7-dimethoxyquinazoline	ME138402	0.90	1.10
12-oxo-9-octadecynoic acid + 1.118277	ME138082	0.90	1.10
12-oxo-10Z-dodecenoic acid	ME138252	0.90	1.10
12-oxo-9-octadecynoic acid	ME137974	0.90	1.10
Tranexamic acid	ME138372	0.89	1.11
TG(17:2(9Z,12Z)/18:0/22:3(10Z,13Z,16Z))[iso6]	ME138927	0.89	1.11
Pyroglutamic acid + 6.9008365	ME139253	0.89	1.11
Propionylglycine methyl ester	ME138456	0.89	1.11
Glutaral (Glutaraldehyde)	ME138157	0.89	1.11
Bis (2-hydroxypropyl) amine + 5.6669173	ME138989	0.89	1.11
Bis (2-hydroxypropyl) amine	ME138786	0.89	1.11
1-Aminocyclohexanecarboxylic acid + 7.9329	ME139289	0.89	1.11
3alpha-HYDROXY-4,4-BISNOR-8,11,13-PODOCARPATRIENE	ME138224	0.89	1.11
Valine + 6.5252156	ME139219	0.81	1.19
Sulfaquinoxaline	ME138504	0.81	1.19
Linolenoyl lysolecithin	ME139637	0.81	1.19
GPEtnNMe(18:1(9Z)/18:1(9Z))[U] + 5.188982	ME138870	0.81	1.19
(3S,4R,3^R)-4-Hydroxyalloxanthin	ME139564	0.81	1.19
2-methyl-tridecanedioic acid	ME137996	0.81	1.19
13S-hydroxy-9E,11Z-octadecadienoic acid	ME137969	0.81	1.19
2-Ethylisonicotinic acid	ME137798	0.81	1.19
Tylosin	ME138841	0.82	1.18
Isoleucine + 4.312832	ME138704	0.82	1.18
6-[3]-ladderane-1-hexanol	ME137952	0.82	1.18
Glycoursodeoxycholic acid	ME138788	0.82	1.18
Quinone	ME138507	0.80	1.20
Phendimetrazine	ME138113	0.80	1.20
PGI3	ME138153	0.80	1.20
Isobutyrylglycine	ME139635	0.80	1.20
Hydroxyhydroquinone + 2.6956372	ME138538	0.80	1.20
GUVACINE	ME139675	0.80	1.20
11-amino-undecanoic acid	ME138808	0.80	1.20
beta-vinyl acrylic acid + 2.6553457	ME138530	0.80	1.20
Rhodoxanthin	ME137824	0.79	1.21
Phenylethylmalonamide (PEMA)	ME139431	0.79	1.21
Indospicine	ME139108	0.79	1.21
1-Hexadecylamine + 3.443868	ME138628	0.79	1.21
9,12,14-octadecatrienoic acid	ME137954	0.79	1.21
Pyroglutamic acid	ME139023	0.86	1.14
Podophyllotoxin (Podophyllum)	ME139387	0.86	1.14
N,N-Didemethylchlorpromazine	ME138588	0.86	1.14
Methionine	ME138614	0.86	1.14
Leucine + 1.5093799	ME139375	0.86	1.14
L-Alanine n-butyl ester	ME139140	0.86	1.14
3,6-octadecadiynoic acid	ME138022	0.86	1.14
2-Amino-2-methyl-1-propanol + 5.1816993	ME138852	0.86	1.14
15-methyl-15S-PGD2	ME138100	0.86	1.14
1-Aminocyclohexanecarboxylic acid + 1.2134709	ME139581	0.86	1.14
MELOXICAM	ME138983	0.85	1.15
GPSer(16:0/20:0)	ME138836	0.85	1.15
epsilon-Caprolactam + 1.5566033	ME138341	0.85	1.15
Diacetyl + 2.5729017	ME139411	0.85	1.15
3-tert-butyl-3-butenoic acid	ME137934	0.85	1.15
(22E,24E,24bE)-1alpha,25-dihydroxy-26,27-dimethyl-22,23,24,24a,24b,24c-hexadehydro-24a,24b,24c-triho	ME138010	0.85	1.15
2-Amino-2-methyl-1-propanol + 5.2878256	ME138886	0.85	1.15
Nadolol	ME139098	0.84	1.16
N1-Acetylspermidine	ME139557	0.84	1.16
Erythromycin	ME139189	0.84	1.16
dimethyl sulfoxide	ME138396	0.84	1.16
desmethylnortriptyline glucuronide	ME137808	0.84	1.16
1alpha-hydroxy-18-[m-(1-hydroxy-1-ethylpropyl)-benzyloxy]-23,24,25,26,27-pentanorvitamin D3 / 1alpha	ME138162	0.84	1.16
Benorilate	ME139385	0.84	1.16
Triparanol + 7.607654	ME139287	0.83	1.17
N-gamma-Acetyl-N-2-formyl-5-methoxykynurenamine	ME139478	0.83	1.17
Ivermectin B1a	ME139588	0.83	1.17
Glutaral (Glutaraldehyde) + 1.3851916	ME138299	0.83	1.17
GABOXADOL	ME139280	0.83	1.17
(E)-2-Methylglutaconic acid + 2.7002208	ME138545	0.83	1.17
Bis (2-hydroxypropyl) amine + 5.5734115	ME138957	0.83	1.17
Bilirubin + 3.964413	ME138663	0.83	1.17
6,9,12-hexadecatrienoic acid	ME137973	0.83	1.17
2-decylenic acid	ME137916	0.83	1.17
2-Methylbutyrylglycine + 2.0688164	ME138461	0.83	1.17
Vigabatrin	ME138300	1.04	0.96
Ritodrine glucuronide	ME138250	1.04	0.96
GPEtn(18:0/20:4(5Z,8Z,11Z,14Z))[U]	ME138722	1.04	0.96
Dihydroxylycopene/ OH-Rhodopin	ME137860	1.04	0.96
5-Methylcytidine	ME138626	1.04	0.96
3alpha,7alpha,12beta-Trihydroxy-11-oxo-5beta-cholan-24-oic Acid + 5.5670652	ME139488	1.04	0.96
2-Pyrrolidinone + 2.8145652	ME138583	1.04	0.96
2-amino-4-cyano-butanoic acid	ME138276	1.04	0.96
1-Monopalmitin	ME138026	1.04	0.96
14-hydroxy-12-tetradecenoic acid	ME138013	1.04	0.96
1-heptadecanoyl-2-(9Z-tetradecenoyl)-sn-glycero-3-phosphoserine	ME138832	1.04	0.96
N-Deacetylketoconazole	ME139433	1.05	0.95
Methylglyoxal	ME138508	1.05	0.95
Ile Ala	ME139270	1.05	0.95
D-Glucose + 2.726834	ME138549	1.05	0.95
4-undecynoic acid	ME137948	1.05	0.95
3,5-hexadienoic acid	ME137946	1.05	0.95
3-(a-Naphthoxy)lactic acid	ME138944	1.05	0.95
Ubiquinone + 1.6377995	ME139381	1.03	0.97
Pilocarpine	ME138272	1.03	0.97
1-(11E-octadecenoyl)-rac-glycerol	ME138106	1.03	0.97
Hypoxanthine + 2.8479283	ME138587	1.03	0.97
Nalorphine	ME138066	1.02	0.98
N-Acetyltranexamic acid	ME139129	1.02	0.98
epsilon-Caprolactam	ME138309	1.02	0.98
Diacetyl	ME139276	1.02	0.98
Creatinine + 3.992575	ME138668	1.02	0.98
Acetoin + 1.6106687	ME138361	1.02	0.98
4-Aminobutyraldehyde + 5.1598577	ME138849	1.02	0.98
4,7,10,13-hexadecatetraenoic acid	ME138115	1.02	0.98
1-Methyladenosine	ME139078	1.02	0.98
1,3-Dimethyluric acid	ME139396	1.02	0.98
1alpha,25-dihydroxy-26,27-dimethyl-20,21,22,22,23,23-hexadehydro-24a-homovitamin D3 / 1alpha,25-dihy	ME139651	1.02	0.98
Trp Tyr Tyr	ME138620	1.01	0.99
Terephthalic acid	ME137889	1.01	0.99
Pinacidil	ME139208	1.01	0.99
Phthalic acid Mono-2-ethylhexyl Ester	ME137896	1.01	0.99
n-Hexanoic Acid	ME138270	1.01	0.99
N-Acetylarylamine	ME139020	1.01	0.99
Lys His Met	ME138087	1.01	0.99
Indoleacrylic acid + 5.5371394	ME138947	1.01	0.99
His Asn Asp	ME138544	1.01	0.99
GPIns(16:0/16:0)	ME138831	1.01	0.99
(E)-2-Methylglutaconic acid + 7.117085	ME139275	1.01	0.99
4-Aminophenyl 1-thio-beta-D-glucuronide + 2.7811708	ME138564	1.01	0.99
4,8,12,15,19,21-tetracosahexaenoic acid	ME138228	1.01	0.99
(17Z)-1alpha,25-dihydroxy-26,27-dimethyl-17,20,22,22,23,23-hexadehydrovitamin D3 / (17Z)-1alpha,25-d	ME139567	1.01	0.99
2-Pyrrolidinone + 3.2609262	ME138616	1.01	0.99
Limonene-1,2-epoxide	ME137917	1.00	1.00
L-Alanine n-butyl ester + 7.122861	ME139274	1.00	1.00
Gemeprost + 6.1370444	ME139104	1.00	1.00
6-Formylindolo [3,2-B] carbazole	ME138931	1.00	1.00
(+/-)5,6-DiHETrE	ME138178	1.00	1.00
4-Aminobutyraldehyde	ME138758	1.00	1.00
2-Aminopropanol + 6.2639914	ME139125	1.00	1.00
3-Methyl-3Z-Pentenoic Acid	ME137915	1.00	1.00
Urocanic acid + 2.6179063	ME138533	0.93	1.07
TG(18:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z))[iso6]	ME138908	0.93	1.07
Taurine	ME138847	0.93	1.07
p-Coumaric acid	ME139019	0.93	1.07
Myricetin	ME138366	0.93	1.07
ISOLIQUIRITIGENIN	ME138602	0.93	1.07
Gemeprost	ME138054	0.93	1.07
Fexofenadine	ME138883	0.93	1.07
CARYLOPHYLLENE OXIDE	ME137981	0.93	1.07
3-oxo-4-pentenoic acid	ME138529	0.93	1.07
1-Hexadecylamine	ME138519	0.93	1.07
(22S)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,23,24,24-tetradehydro-24a-homovitamin D3 / (22S)-1al	ME138134	0.93	1.07
Trolamine	ME138981	0.94	1.06
Trihydroxycoprostanoic acid	ME137970	0.94	1.06
Propofol	ME137922	0.94	1.06
Phosphoric acid	ME138019	0.94	1.06
Leu Pro	ME139288	0.94	1.06
dodecanamide	ME138135	0.94	1.06
DL-2-Aminooctanoic acid	ME139232	0.94	1.06
Dimethylglycine	ME139171	0.94	1.06
BUFEXAMAC	ME138489	0.94	1.06
7,12-Dioxo-5beta-cholan-24-oic Acid + 1.1811479	ME138208	0.94	1.06
6-Dimethylaminopurine	ME138406	0.94	1.06
2-Amino-3-methyl-1-butanol + 5.725701	ME139054	0.94	1.06
2-Butanone	ME138260	0.94	1.06
Proline	ME139122	0.91	1.09
Ophiobolin A	ME138936	0.91	1.09
Indoleacrylic acid	ME138901	0.91	1.09
alpha-Ketopantoic acid	ME138084	0.91	1.09
alpha-Hydroxymetoprolol	ME139134	0.91	1.09
9-amino-nonanoic acid + 4.460704	ME139614	0.91	1.09
5-(hydroxymethyl)- 2-Furancarboxylic acid + 5.4691124	ME138992	0.91	1.09
3alpha,7alpha,12alpha-Trihydroxy-24-methyl-5beta-cholest-23-en-26-oic acid	ME138043	0.91	1.09
3R-hydroxy-5Z-dodecenoic acid	ME138040	0.91	1.09
Pro Pro Leu	ME138958	0.92	1.08
Propanoic acid, 2-hydroxy-3-[2-(2-propenyloxy)phenoxy]-	ME138338	0.92	1.08
ISOPIMPINELLIN	ME138558	0.92	1.08
Diethanolamine + 5.770817	ME139022	0.92	1.08
Glutaral (Glutaraldehyde) + 6.6251254	ME139231	0.92	1.08
Lys Trp Pro	ME138377	0.99	1.01
Leu Pro + 7.9430532	ME139290	0.99	1.01
GPEtnNMe(18:1(9Z)/18:1(9Z))[U] + 5.253908	ME138953	0.99	1.01
3-Hydroxyphenytoin	ME139429	0.99	1.01
1-O-(1Z-hexadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine	ME138716	0.99	1.01
12,13-dihydroxy-11-methoxy-9-octadecenoic acid	ME138079	0.99	1.01
1-(9Z,12Z-octadecadienoyl)-rac-glycerol	ME138044	0.99	1.01
Uridine	ME138352	0.98	1.02
Pro His	ME139026	0.98	1.02
Pinacidil-N-Oxide	ME139281	0.98	1.02
Norcodeine	ME138124	0.98	1.02
N-Methyl-2-pyridone-5-carboxamide (Nudifloramide) + 1.9322278	ME138403	0.98	1.02
Isoniazid	ME139369	0.98	1.02
Hydroxytinidazole glucuronide	ME139509	0.98	1.02
Creatine	ME139261	0.98	1.02
Acetoacetic acid + 7.57222	ME139285	0.98	1.02
6alpha-Hydroxycastasterone	ME137956	0.98	1.02
3,6,8-dodecatrien-1-ol	ME137907	0.98	1.02
2-Aminoisobutyric acid	ME138386	0.98	1.02
16-hydroperoxy-9Z,12,14E-octadecatrienoic acid + 1.123054	ME139335	0.98	1.02
1alpha-hydroxy-18-[m-(1-hydroxy-1-ethylpropyl)-benzyloxy]-23,24,25,26,27-pentanorvitamin D3 / 1alpha + 1.150902	ME139649	0.98	1.02
Phenylmethyl methyl ketone	ME138098	0.95	1.05
pentanamide	ME139286	0.95	1.05
N-HISTIDYL-2-AMINONAPHTHALENE (betaNA)	ME138097	0.95	1.05
Isoleucine	ME138355	0.95	1.05
Glu Cys Tyr	ME139389	0.95	1.05
D-Leucic acid + 1.7634912	ME138392	0.95	1.05
Dihydrocodeine-6-glucuronide	ME138212	0.95	1.05
Diethanolamine + 5.6117415	ME139499	0.95	1.05
Diethanolamine + 5.4235935	ME138962	0.95	1.05
2-Pyrrolidinone + 2.050616	ME138457	0.95	1.05
Caffeine	ME139368	0.95	1.05
L-Glutamic acid n-butyl ester	ME139272	0.97	1.03
Diethanolamine + 5.6023684	ME138990	0.97	1.03
Cys Asn Thr	ME138903	0.97	1.03
ciclopirox	ME138340	0.97	1.03
Acenocoumarol	ME137796	0.97	1.03
8-methoxy-13-hydroxy-9,11-octadecadienoic acid	ME138083	0.97	1.03
6^-Hydroxysiphonaxanthin ester/ 6^-Hydroxysiphonaxanthin dodecenoate/ 6^-Hydroxysiphonaxanthin 19-(t	ME138893	0.97	1.03
5-(hydroxymethyl)- 2-Furancarboxylic acid	ME138859	0.97	1.03
4-Aminobutyraldehyde + 5.2646117	ME138866	0.97	1.03
1-Methylguanosine	ME138608	0.97	1.03
3-hexenal	ME138785	0.97	1.03
Vigabatrin + 3.9106317	ME138656	0.96	1.04
Valine	ME138394	0.96	1.04
Urea + 5.2478967	ME139674	0.96	1.04
Urea + 1.9498616	ME139593	0.96	1.04
Trp Trp His	ME137866	0.96	1.04
OXYQUINOLINE + 5.5401073	ME138949	0.96	1.04
Normeperidinic acid	ME139095	0.96	1.04
Carbaryl	ME138296	0.96	1.04
(+)-Bornane-2,5-dione	ME137976	0.96	1.04
ARECOLINE	ME138329	0.96	1.04
2-Hydroxyadipic acid + 2.7516344	ME138561	0.96	1.04
2-Amino-3-methyl-1-butanol + 5.6115484	ME138996	0.96	1.04
2-Amino-3-methyl-1-butanol + 6.3776693	ME139164	0.96	1.04
GPIns(16:0/18:1(9Z))	ME138610	1.13	0.87
GPEtnNMe(18:1(9Z)/18:1(9Z))[U]	ME138842	1.13	0.87
Bilirubin	ME137923	1.13	0.87
5-Methylthioribose	ME138576	1.13	0.87
1-heneicosanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine	ME139625	1.13	0.87
16-hydroperoxy-9Z,12,14E-octadecatrienoic acid	ME138164	1.13	0.87
12beta-Hydroxy-3-oxo-5beta-cholan-24-oic Acid + 0.9860499	ME137888	1.13	0.87
1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-3-(8-(2E,4Z-decadienoyloxy)-5,6-octadienoyl)-sn-glycerol	ME139043	1.13	0.87
Ritodrine glucuronide 2	ME138821	1.12	0.88
Phenacetine	ME139069	1.12	0.88
p-Aminobenzoic acid	ME138407	1.12	0.88
cyclohexylammonium	ME138569	1.12	0.88
8-Amino-7-oxononanoate + 7.30499	ME139279	1.12	0.88
2-Pyrrolidinone + 1.5893642	ME138345	1.12	0.88
1-heneicosanoyl-2-(13Z,16Z-docosadienoyl)-sn-glycerol	ME137980	1.12	0.88
(1S,2S)-3-oxo-2-pentyl-cyclopentanebutanoic acid	ME138005	1.12	0.88
Tranexamic acid + 6.6438603	ME139233	1.11	0.89
Proparacaine	ME137835	1.11	0.89
Hypoxanthine	ME138523	1.11	0.89
Buprenorphine	ME139200	1.11	0.89
Acetoin	ME138258	1.11	0.89
3-Methylxanthine	ME138343	1.11	0.89
1-Methylguanine	ME138637	1.11	0.89
2-Octenedioic acid + 6.6523614	ME139547	1.11	0.89
INDOLE-3-CARBINOL	ME137802	1.10	0.90
Eicosanedioic acid	ME139089	1.10	0.90
25-hydroxy-26,27-dimethylvitamin D3 / 25-hydroxy-26,27-dimethylcholecalciferol	ME137897	1.10	0.90
1-Methylinosine	ME138499	1.10	0.90
20alpha-Dihydroprednisolone	ME138225	1.10	0.90
LEVULINIC ACID, 3-BENZYLIDENYL-	ME137901	1.07	0.93
KOBUSONE	ME137997	1.07	0.93
Glc-GP(18:0/20:4(5Z,8Z,11Z,14Z))	ME138707	1.07	0.93
Dinorpromazine	ME138605	1.07	0.93
beta-Alanine + 6.861986	ME139260	1.07	0.93
Asn Phe Ala	ME137841	1.07	0.93
ANISOMYCIN	ME139198	1.07	0.93
Allocortol	ME138126	1.07	0.93
8-Amino Caprylic acid	ME139257	1.07	0.93
1alpha,25-dihydroxy-22-oxavitamin D3 3-hemiglutarate/ 1alpha,25-dihydroxy-22-oxacholecalciferol 3-he	ME139118	1.07	0.93
5-(hydroxymethyl)- 2-Furancarboxylic acid + 5.278392	ME138888	1.07	0.93
Pro Arg Asp	ME138110	1.06	0.94
Leupeptin	ME138200	1.06	0.94
Chloramphenicol alcohol	ME138595	1.06	0.94
Ecgonine + 6.5281243	ME139218	1.06	0.94
Vigabatrin + 5.8527026	ME139039	1.08	0.92
OXYQUINOLINE	ME138090	1.08	0.92
Diethanolamine	ME138875	1.08	0.92
4-dodecynoic acid	ME137931	1.08	0.92
1-(10Z,13Z,16Z-docosatrienoyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol	ME138017	1.08	0.92
1alpha,25-dihydroxy-16,17-didehydrovitamin D_3 / 1alpha,25-dihydroxy-16,17-didehydrocholecalciferol	ME138197	1.08	0.92
Uridine + 2.1526797	ME138473	1.09	0.91
Lys Val Leu	ME137891	1.09	0.91
L-Glutamic acid dibutyl ester	ME139143	1.09	0.91
Isoleucine + 6.546938	ME139548	1.09	0.91
GPEtn(22:0/20:1(11Z))	ME138819	1.09	0.91
GPEtn(18:0/0:0)	ME139212	1.09	0.91
FENDILINE	ME138655	1.09	0.91
Cytosine + 3.9254932	ME138659	1.09	0.91
26,27-diethyl-1alpha,25-dihydroxy-20,21-methano-23-oxavitamin D3 / 26,27-diethyl-1alpha,25-dihydroxy	ME139302	1.09	0.91
(24S)-1alpha,24-dihydroxy-22-oxavitamin D3 / (24S)-1alpha,24-dihydroxy-22-oxacholecalciferol	ME139298	1.09	0.91
(22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,23,24,24-tetradehydro-24a,24b,24c-trihomovitamin D3	ME138030	1.09	0.91
1alpha,25-dihydroxy-11beta-methoxyvitamin D3 / 1alpha,25-dihydroxy-11beta-methoxycholecalciferol	ME137985	1.09	0.91
1-octadecanoyl-rac-glycerol	ME137993	1.09	0.91
Calcipotriene	ME139300	1.23	0.77
2-Amino-3-methyl-1-butanol	ME138375	1.23	0.77
2-Amino-3-methyl-1-butanol + 6.487953	ME139205	1.23	0.77
Kynurenine	ME138955	1.22	0.78
GPEtn(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))	ME138725	1.22	0.78
Acipimox	ME138475	1.22	0.78
7-Hydroxymethotrexate	ME138408	1.22	0.78
3alpha,7alpha,12beta-Trihydroxy-11-oxo-5beta-cholan-24-oic Acid	ME138985	1.22	0.78
5-Hydroxypyrazinamide	ME139434	1.22	0.78
Oxymorphone	ME138148	1.24	0.76
3-Indolepropionic acid	ME138102	1.24	0.76
4-Hydroxybenzyl cyanide	ME137804	1.24	0.76
OXYQUINOLINE + 1.1740991	ME138176	1.25	0.75
n-methylnicotinamide	ME138302	1.25	0.75
Indole-3-ethanol	ME138823	1.25	0.75
ISOSAFROLE	ME137903	1.25	0.75
Succinylacetone	ME139262	1.19	0.81
Pyrazinoic acid	ME138470	1.19	0.81
Lys Asn Pro	ME139060	1.19	0.81
LOMATIN	ME138382	1.19	0.81
Isoquinoline	ME138125	1.19	0.81
Cadaverine	ME138600	1.19	0.81
1-(9Z-hexadecenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycerol	ME137886	1.19	0.81
2-Aminopropanol	ME138395	1.19	0.81
4-Hydroxypyridine	ME138607	1.18	0.82
2-Methylhippuric acid	ME138467	1.18	0.82
1alpha,25-dihydroxy-2beta-(4-hydroxybutoxy)vitamin D3 / 1alpha,25-dihydroxy-2beta-(4-hydroxybutoxy)c	ME138648	1.18	0.82
1-heptadecanoyl-2-(9Z-tetradecenoyl)-sn-glycero-3-phosphoserine + 5.1421776	ME138846	1.18	0.82
URSINIC ACID	ME138943	1.20	0.80
Creatinine	ME138497	1.20	0.80
2-Pyrrolidinone + 3.762933	ME138643	1.20	0.80
8R-hydroxy-9Z-octadecenoic acid + 1.1166265	ME138136	1.20	0.80
4-Aminophenyl 1-thio-beta-D-glucuronide	ME138503	1.21	0.79
Paraxanthine	ME138316	1.21	0.79
Triparanol + 6.3799906	ME139166	1.16	0.84
N-Methyl-2-pyridone-5-carboxamide (Nudifloramide)	ME138399	1.16	0.84
L-gamma-Cyano-gamma-aminobutyric acid	ME139278	1.16	0.84
HYDROLYSIS PRODUCT OF BUSSEIN	ME138174	1.16	0.84
cyclohexylammonium + 5.1955566	ME138858	1.16	0.84
Buprenorphine + 6.549572	ME139223	1.16	0.84
4,7,10,13,16-docosapentaenoic acid	ME137831	1.16	0.84
1-(8-[3]-ladderane-octanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphoethanolamine	ME138713	1.16	0.84
3-Nitrotyrosine	ME138471	1.16	0.84
Uracil	ME138351	1.17	0.83
Trp Phe	ME138787	1.17	0.83
5-Acetyl-4-methylthiazole	ME138333	1.17	0.83
3-Indoleacetic Acid	ME138139	1.17	0.83
1alpha,25-dihydroxy-24-oxovitamin D_3 / 1alpha,25-dihydroxy-24-oxocholecalciferol	ME138156	1.17	0.83
3,3^,5-Triiodothyropropionic acid	ME139062	1.17	0.83
n-methylnicotinamide + 5.7782574	ME139027	1.14	0.86
Niacinamide	ME138353	1.14	0.86
Gabapentin	ME139268	1.14	0.86
D-Leucic acid	ME138369	1.14	0.86
7,12-Dioxo-5beta-cholan-24-oic Acid	ME137895	1.14	0.86
4,6-Diamino-5-formamidopyrimidine	ME138627	1.14	0.86
19^-Hexanoyloxyfucoxanthinol	ME137862	1.14	0.86
2E,4E,8Z-eicosatrienoic acid	ME138154	1.14	0.86
Triparanol	ME138374	1.15	0.85
SAFROLE	ME138072	1.15	0.85
n-methylnicotinamide + 5.9732666	ME139068	1.15	0.85
Lactic acid	ME138511	1.15	0.85
2-amino-4^-hydroxy-Propiophenone	ME139252	1.15	0.85
Brassinolide	ME138217	1.15	0.85
Cytosine	ME138483	1.29	0.71
1-octadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoserine	ME138854	1.29	0.71
2H-Indol-2-one, 1,3-dihydro-4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]-	ME137961	1.29	0.71
N,N-HEXAMETHYLENEAMILORIDE	ME138623	1.30	0.70
Lys Gln Ile	ME138629	1.30	0.70
5-NITRO-2-PHENYLPROPYLAMINOBENZOIC ACID [NPPB]	ME138168	1.30	0.70
5-NITRO-2-PHENYLPROPYLAMINOBENZOIC ACID [NPPB] + 1.9546849	ME138413	1.30	0.70
p-Aminobenzoic acid + 6.608752	ME139229	1.28	0.72
2-Octenedioic acid	ME138275	1.26	0.74
Ubiquinone	ME138143	1.27	0.73
Ser Pro Asn	ME138376	1.27	0.73
OLEANANOIC ACID ACETATE	ME137864	1.27	0.73
Biliverdin IX + 1.6432531	ME138360	1.27	0.73
dirithromycin	ME139527	1.27	0.73
Tyr Pro	ME138273	1.36	0.64
HYDROLYSIS PRODUCT OF BUSSEIN + 1.4680848	ME138336	1.35	0.65
URETHANE	ME138502	1.35	0.65
3E,5E-tridecadienoic acid	ME138198	1.32	0.68
Pantothenic Acid	ME138501	1.32	0.68
8,11,14-nonadecatriynoic acid	ME137845	1.31	0.69
Anandamide (20:5, n-3)	ME137905	1.31	0.69
1-(8-[3]-ladderane-octanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphoethanolamine + 5.104187	ME138843	1.34	0.66
Trimethylamine	ME138997	1.33	0.67
GPEtn(18:0/18:3(9Z,12Z,15Z))[U]	ME138734	1.33	0.67
1alpha,25-dihydroxy-11alpha-[(1R)-oxiranyl]vitamin D3 / 1alpha,25-dihydroxy-11alpha-[(1R)-oxiranyl]c	ME138578	1.33	0.67
1-heptadecanoyl, 2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoethanolamine	ME138833	1.33	0.67
3-Methylamino-1,2-propandiol	ME139141	1.44	0.56
4-Hydroxypyridine + 0.82303476	ME139295	1.45	0.55
Nitrosobenzene	ME138491	1.38	0.62
Cytosine + 3.4042628	ME138625	1.38	0.62
(23R,25R)-1alpha,25-dihydroxyvitamin D3 26,23-lactone / (23R,25R)-1alpha,25-dihydroxycholecalciferol	ME138166	1.38	0.62
3,5-Pyridinedicarboxylic acid, 2,6-dimethyl-4-(3-nitrophenyl)-, methyl 2-[methyl(phenylmethyl)amino]	ME138384	1.38	0.62
GPA(21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))	ME138848	1.37	0.63
HYDROLYSIS PRODUCT OF BUSSEIN + 1.9674853	ME138416	1.37	0.63
2E,5Z,8Z,11Z,14Z-eicosapentaenoic acid	ME137928	1.39	0.61
Urea	ME138405	1.39	0.61
1,2-di-(9Z-heptadecenoyl)-3-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycerol	ME139299	1.41	0.59
Netilmicin	ME138693	1.40	0.60
GPIns(16:0/18:1(9Z)) + 5.0012336	ME138820	1.40	0.60
Indoxylsulfuric acid	ME137806	1.40	0.60
Diazepam	ME138444	1.72	0.28
1beta,25-dihydroxy-2beta-(3-hydroxypropoxy)vitamin D3 / 1beta,25-dihydroxy-2beta-(3-hydroxypropoxy)c	ME138631	1.69	0.31
Creatinine + 4.191031	ME139453	1.70	0.30
Ethosuximide + 4.8916454	ME138775	1.70	0.30
1-(2-Pyrimidyl)piperazine	ME138867	1.64	0.36
6-methyltetrahydropterin	ME138460	1.67	0.33
Propoxyphene	ME139574	1.67	0.33
Hippuric acid	ME138604	1.49	0.51
2-Amino-2-methyl-1-propanol	ME138342	1.52	0.48
VALERYL SALYCILATE	ME139340	1.52	0.48
Carboxyibuprofen	ME139397	1.57	0.43
10-hydroxy-2E,8E-Decadiene-4,6-diynoic acid	ME138282	1.55	0.45
2-Hydroxyiminodibenzyl	ME138500	1.56	0.44
7-Aminoclonazepam	ME139402	1.59	0.41
Ethosuximide + 5.762143	ME139524	1.62	0.38
Distearyl phosphatidyl ethanolamine	ME139470	1.61	0.39
Lamivudine	ME137810	1.61	0.39

Factors:

F1	treatment:ND
F2	treatment:T1D poor glycemic control

Data matrix