Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST003066)

(Analysis AN005022)

Metabolite	Structure	F1	F2
VGAHAGEYGAEALER*	ME799649	1.00	NA
triethanolamine	ME799626	1.00	NA
doxycycline	ME799450	1.00	NA
phenol red	ME799572	1.00	NA
valylphenylalanine	ME799645	NA	1.00
valylmethionine	ME799644	NA	1.00
valylasparagine	ME799638	NA	1.00
naproxen	ME799551	NA	1.00
p-acetamidophenylglucuronide	ME799562	NA	1.00
carboxyibuprofen	ME799422	0.33	1.67
2-hydroxyacetaminophen sulfate*	ME799352	0.20	1.40
ibuprofen	ME799495	0.29	1.35
4-ethylphenylsulfate	ME799377	1.53	0.47
4-vinylphenol sulfate	ME799380	1.61	0.90
6-phosphogluconate	ME799382	1.68	0.86
glycodeoxycholate	ME799479	1.65	0.80
4-acetamidophenol	ME799374	1.90	0.55
oleoylcarnitine	ME799558	1.90	0.74
glucose-6-phosphate (G6P)	ME799468	1.75	0.67
sphingosine	ME799609	1.77	0.69
leucylleucine	ME799520	0.46	1.34
dimethyl sulfoxide (DMSO)*	ME799444	0.40	1.23
arginylphenylalanine	ME799409	0.38	1.31
Isobar: leucylisoleucine, isoleucylleucine	ME799501	0.35	1.24
leucylphenylalanine	ME799521	0.34	1.28
3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF)	ME799366	0.45	1.12
tyrosylhistidine	ME799632	0.47	1.21
lysylphenylalanine	ME799528	0.52	1.19
leucylalanine	ME799515	0.55	1.19
leucyltryptophan	ME799524	0.55	1.18
4-acetaminophen sulfate	ME799375	0.54	1.23
asparagylleucine	ME799411	0.53	1.24
leucylglycine	ME799518	0.53	1.27
valylserine	ME799646	0.51	1.27
2-methoxyacetaminophen sulfate*	ME799359	0.65	1.35
leucylserine	ME799522	0.61	1.22
valylthreonine	ME799647	0.60	1.23
alanylphenylalanine	ME799396	0.59	1.10
phenylalanylleucine	ME799578	0.67	1.17
leucylglutamate	ME799517	0.66	1.16
serylleucine	ME799600	0.66	1.15
1,2-propanediol	ME799323	0.66	1.13
threonylleucine	ME799621	0.66	1.13
dodecanedioate	ME799449	0.64	1.16
leucylthreonine	ME799523	0.63	1.14
3-hydroxybutyrate (BHBA)	ME799368	0.64	1.14
leucylaspartate	ME799516	0.64	1.14
2-hydroxyibuprofen	ME799356	0.62	1.19
isoleucylglutamate	ME799506	0.61	1.17
isoleucylserine	ME799509	0.62	1.17
leucylhistidine	ME799519	0.60	1.16
tryptophan betaine	ME799628	0.61	1.15
isoleucylaspartate	ME799505	0.58	1.16
lysylvaline	ME799529	0.59	1.18
glycoursodeoxycholate	ME799480	0.74	1.22
serylphenyalanine	ME799601	0.69	1.14
threonylvaline	ME799623	0.70	1.14
indoleacrylate	ME799497	0.70	1.09
gamma-glutamylthreonine*	ME799464	0.69	1.12
1-stearoylplasmenylethanolamine*	ME799344	0.70	1.11
pipecolate	ME799581	0.70	1.11
alpha-tocopherol	ME799402	0.69	1.10
tyrosylarginine	ME799630	0.69	1.10
isoleucylhistidine	ME799508	0.74	1.14
pyrophosphate (PPi)	ME799590	0.75	1.13
alanylleucine	ME799395	0.76	1.09
prolylglutamate	ME799585	0.77	1.09
S-methylcysteine	ME799604	0.73	1.11
valylleucine	ME799643	0.72	1.11
threonylphenylalanine	ME799622	0.75	1.11
alanylisoleucine	ME799394	0.74	1.10
gamma-glutamylvaline	ME799465	0.74	1.10
mannitol	ME799534	0.75	1.10
tetradecanedioate	ME799616	0.75	1.10
alpha-ketoglutarate	ME799401	1.39	0.83
stachydrine	ME799610	1.40	0.85
4-androsten-3beta,17beta-diol disulfate 1*	ME799376	1.48	0.82
glycochenodeoxycholate	ME799478	1.46	0.84
1-stearoylglycerophosphocholine (18:0)	ME799340	1.20	0.92
palmitoylcarnitine	ME799566	1.21	0.92
caffeine	ME799418	1.26	0.90
glucose	ME799467	1.26	0.90
biliverdin	ME799417	1.24	0.92
ribose 5-phosphate	ME799593	1.24	0.90
alpha-hydroxyisovalerate	ME799400	1.33	0.87
androsterone sulfate	ME799403	1.33	0.87
epiandrosterone sulfate	ME799454	1.32	0.89
pregnen-diol disulfate*	ME799583	1.31	0.90
1,6-anhydroglucose	ME799325	1.35	0.92
2-hydroxyhippurate (salicylurate)	ME799355	1.37	0.88
Isobar: pentulose 5-phosphates	ME799502	1.17	0.94
10-heptadecenoate (17:1n7)	ME799326	1.17	0.94
choline	ME799430	1.17	0.94
urea	ME799634	1.16	0.94
palmitoleate (16:1n7)	ME799564	1.16	0.94
1-linoleoylglycerophosphoethanolamine*	ME799333	1.16	0.94
isovalerylcarnitine	ME799510	1.16	0.94
glycerol 3-phosphate (G3P)	ME799475	1.19	0.93
pregn steroid monosulfate*	ME799582	1.18	0.94
myristoleate (14:1n5)	ME799542	1.15	0.92
threitol	ME799618	1.14	0.95
2-aminooctanoate	ME799347	1.14	0.94
allantoin	ME799399	1.14	0.94
dihydroxyacetone phosphate (DHAP)	ME799443	1.05	0.98
pelargonate (9:0)	ME799570	1.05	0.98
uridine	ME799635	1.06	0.98
inosine 5^-monophosphate (IMP)	ME799499	1.06	0.98
succinylcarnitine	ME799614	1.06	0.98
arabinose	ME799404	1.07	0.96
trans-4-hydroxyproline	ME799625	1.08	0.97
prolylthreonine	ME799586	1.08	0.97
nicotinamide	ME799553	1.08	0.97
linolenate [alpha or gamma; (18:3n3 or 6)]	ME799526	1.08	0.97
inosine	ME799498	1.08	0.97
choline phosphate	ME799431	1.08	0.97
erythritol	ME799456	1.08	0.97
2-palmitoylglycerophosphoethanolamine*	ME799364	1.07	0.98
urate	ME799633	1.07	0.97
linoleate (18:2n6)	ME799525	1.07	0.97
3-(4-hydroxyphenyl)lactate	ME799365	1.07	0.97
isobutyrylcarnitine	ME799503	1.07	0.97
pentadecanoate (15:0)	ME799571	1.11	0.92
gluconate	ME799466	1.10	0.94
N-methyl proline	ME799554	1.11	0.94
mannose	ME799535	1.13	0.95
histidylisoleucine	ME799490	1.12	0.95
ergothioneine	ME799455	1.12	0.95
caprate (10:0)	ME799419	1.12	0.95
cis-vaccenate (18:1n7)	ME799432	1.12	0.95
dehydroisoandrosterone sulfate (DHEA-S)	ME799439	1.12	0.96
13-HODE + 9-HODE	ME799327	1.12	0.96
3-methyl-2-oxovalerate	ME799371	1.12	0.96
EDTA	ME799451	1.11	0.96
4-methyl-2-oxopentanoate	ME799379	1.11	0.96
citrate	ME799433	1.11	0.96
paraxanthine	ME799568	1.08	0.95
mannose-6-phosphate	ME799536	1.09	0.96
phenol sulfate	ME799573	1.10	0.96
1-linoleoylglycerophosphocholine (18:2n6)	ME799332	1.10	0.96
guanine	ME799483	1.10	0.96
methylphosphate	ME799540	1.00	1.00
glutamine	ME799470	1.00	1.00
1-oleoylglycerophosphocholine (18:1)	ME799334	1.00	1.00
creatinine	ME799436	1.00	1.00
S-lactoylglutathione	ME799603	0.99	1.00
phenylalanylaspartate	ME799576	0.99	1.00
myo-inositol	ME799541	0.99	1.00
maltotriose	ME799533	0.99	1.00
docosapentaenoate (n6 DPA; 22:5n6)	ME799448	0.99	1.00
dihomo-linoleate (20:2n6)	ME799441	0.99	1.00
1-stearoylglycerophosphoethanolamine	ME799341	0.99	1.00
adenosine	ME799387	0.99	1.00
glycylleucine	ME799482	1.01	1.00
2-palmitoylglycerophosphocholine*	ME799363	1.01	1.00
glycerate	ME799473	1.01	1.00
palmitate (16:0)	ME799563	1.01	0.99
margarate (17:0)	ME799537	1.01	0.99
caproate (6:0)	ME799420	1.01	0.99
cholestanol	ME799428	1.01	0.99
thymol sulfate	ME799624	1.04	0.96
sorbitol	ME799606	1.02	0.99
nonadecanoate (19:0)	ME799555	1.02	0.99
7-alpha-hydroxycholesterol	ME799383	1.02	0.99
2-hydroxyglutarate	ME799354	1.02	0.99
2-arachidonoylglycerophosphocholine*	ME799348	1.02	0.99
1-oleoylplasmenylethanolamine*	ME799336	1.02	0.99
1-palmitoylglycerophosphocholine (16:0)	ME799337	1.02	0.99
theobromine	ME799617	1.03	0.99
scyllo-inositol	ME799598	1.03	0.99
pyroglutamine*	ME799589	1.03	0.99
N-acetylphenylalanine	ME799550	1.03	0.99
mead acid (20:3n9)	ME799538	1.03	0.99
lathosterol	ME799513	1.03	0.99
guanosine 5^- monophosphate (5^-GMP)	ME799484	1.03	0.99
2-aminobutyrate	ME799346	1.03	0.99
erythronate*	ME799457	1.03	0.99
oleate (18:1n9)	ME799557	1.04	0.99
maltose	ME799531	1.04	0.99
C-glycosyltryptophan*	ME799425	1.04	0.99
dihomo-linolenate (20:3n3 or n6)	ME799442	1.04	0.99
3-methyl-2-oxobutyrate	ME799370	1.03	0.98
sarcosine (N-Methylglycine)	ME799597	1.04	0.98
pantothenate	ME799567	1.04	0.98
Isobar: fructose 1,6-diphosphate, glucose 1,6-diphosphate, myo-inositol 1,4 or 1,3-diphosphate	ME799500	1.04	0.98
gamma-glutamylglutamate	ME799462	1.04	0.98
2-hydroxybutyrate (AHB)	ME799353	1.04	0.98
arabonate	ME799406	1.04	0.98
2-linoleoylglycerophosphocholine*	ME799357	0.94	1.03
maltotetraose	ME799532	0.93	1.03
malate	ME799530	0.93	1.03
lysine	ME799527	0.93	1.03
gulono-1,4-lactone	ME799486	0.93	1.03
glutathione, reduced (GSH)	ME799472	0.93	1.03
fumarate	ME799461	0.93	1.03
2-oleoylglycerophosphoethanolamine*	ME799362	0.93	1.03
arabitol	ME799405	0.93	1.03
stearoyl sphingomyelin	ME799613	0.91	1.04
cysteinylglycine	ME799438	0.91	1.04
N-acetylmethionine sulfoxide	ME799548	0.91	1.04
threonine	ME799620	0.91	1.03
leucine	ME799514	0.91	1.03
1-stearoylglycerophosphoserine*	ME799343	0.91	1.03
7-ketocholesterol	ME799385	0.91	1.03
ornithine	ME799560	0.92	1.03
glycine	ME799477	0.92	1.03
carnitine	ME799423	0.92	1.03
2-methylbutyrylcarnitine (C5)	ME799360	0.92	1.03
3-dehydrocarnitine*	ME799367	0.92	1.03
threonate	ME799619	0.98	1.01
spermine	ME799608	0.98	1.01
ribulose	ME799594	0.98	1.01
phosphate	ME799579	0.98	1.01
orotate	ME799561	0.98	1.01
isoleucine	ME799504	0.98	1.01
histidylphenylalanine	ME799491	0.98	1.01
heme	ME799487	0.98	1.01
guanosine 5^-diphospho-fucose	ME799485	0.98	1.01
7-beta-hydroxycholesterol	ME799384	0.98	1.01
2-linoleoylglycerophosphoethanolamine*	ME799358	0.98	1.01
1-arachidonoylglycerophosphocholine (20:4n6)*	ME799328	0.98	1.01
1-oleoylglycerophosphoethanolamine	ME799335	0.98	1.01
xylose	ME799652	0.97	1.01
xylonate	ME799651	0.97	1.01
xanthine	ME799650	0.97	1.01
valylglutamate	ME799640	0.97	1.01
stearate (18:0)	ME799612	0.97	1.01
propionylcarnitine	ME799587	0.97	1.01
proline	ME799584	0.97	1.01
N-acetylneuraminate	ME799549	0.97	1.01
N-acetylalanine	ME799544	0.97	1.01
kynurenine	ME799511	0.97	1.01
eicosapentaenoate (EPA; 20:5n3)	ME799452	0.97	1.01
beta-alanine	ME799414	0.97	1.01
alanine	ME799391	0.97	1.01
adenosine 5^-monophosphate (AMP)	ME799389	0.97	1.01
3-indoxyl sulfate	ME799369	0.97	1.01
1-palmitoylglycerophosphoethanolamine	ME799338	0.97	1.01
2-oleoylglycerophosphocholine*	ME799361	0.97	1.01
tyrosylglutamate	ME799631	0.96	1.01
tyrosine	ME799629	0.96	1.01
N-acetylmethionine	ME799547	0.96	1.01
N-acetylmannosamine	ME799546	0.96	1.01
hypoxanthine	ME799494	0.96	1.01
1-stearoylglycerophosphoinositol	ME799342	0.96	1.01
hydroxybutyrylcarnitine*	ME799492	0.96	1.01
valine	ME799636	0.96	1.02
tryptophan	ME799627	0.96	1.02
S-adenosylhomocysteine (SAH)	ME799595	0.96	1.02
pyruvate	ME799591	0.96	1.02
p-cresol sulfate	ME799569	0.96	1.02
lactate	ME799512	0.96	1.02
caprylate (8:0)	ME799421	0.96	1.02
asparagine	ME799410	0.96	1.02
2,3-diphosphoglycerate	ME799345	0.96	1.02
arginine	ME799408	0.96	1.02
pseudouridine	ME799588	0.94	1.02
eicosenoate (20:1n9 or 11)	ME799453	0.94	1.02
catechol sulfate	ME799424	0.94	1.02
betaine	ME799415	0.94	1.02
adenosine 5^-diphosphate (ADP)	ME799388	0.94	1.02
3-phosphoglycerate	ME799373	0.94	1.02
1-arachidonoylglycerophosphoethanolamine*	ME799329	0.94	1.02
2-ethylhexanoate (isobar with 2-propylpentanoate)	ME799351	0.94	1.02
valylhistidine	ME799642	0.95	1.02
spermidine	ME799607	0.95	1.02
phenylalanine	ME799575	0.95	1.02
isoleucylglycine	ME799507	0.95	1.02
iminodiacetate (IDA)	ME799496	0.95	1.02
histidine	ME799489	0.95	1.02
glutathione, oxidized (GSSG)	ME799471	0.95	1.02
docosapentaenoate (n3 DPA; 22:5n3)	ME799447	0.95	1.02
creatine	ME799435	0.95	1.02
citrulline	ME799434	0.95	1.02
cholesterol	ME799429	0.95	1.02
1-arachidonoylglycerophosphoinositol*	ME799330	0.95	1.02
5-oxoproline	ME799381	0.95	1.02
4-hydroxyphenylpyruvate	ME799378	0.95	1.03
cholate	ME799427	0.96	1.03
beta-sitosterol	ME799416	0.82	1.15
salicylate	ME799596	0.92	1.08
S-methylglutathione	ME799605	0.88	1.04
taurine	ME799615	0.88	1.04
1-palmitoylplasmenylethanolamine*	ME799339	0.87	1.05
phosphoenolpyruvate (PEP)	ME799580	0.87	1.05
serylvaline	ME799602	0.88	1.05
N-delta-acetylornithine*	ME799552	0.88	1.05
N6-acetyllysine	ME799543	0.88	1.05
acetylcarnitine	ME799386	0.88	1.05
alanylglutamate	ME799392	0.88	1.05
stearamide	ME799611	0.90	1.03
valylglycine	ME799641	0.89	1.04
phenylacetylglutamine	ME799574	0.89	1.04
palmitoyl sphingomyelin	ME799565	0.89	1.04
glycerol 2-phosphate	ME799474	0.89	1.04
2-arachidonoylglycerophosphoethanolamine*	ME799349	0.89	1.04
arachidonate (20:4n6)	ME799407	0.89	1.04
serine	ME799599	0.90	1.04
ophthalmate	ME799559	0.90	1.04
N-acetylglycine	ME799545	0.90	1.04
deoxycarnitine	ME799440	0.90	1.04
methionine	ME799539	0.90	1.04
alanylvaline	ME799398	0.84	1.05
glutamate	ME799469	0.84	1.06
quinate	ME799592	0.86	1.05
gamma-glutamylleucine	ME799463	0.86	1.05
fructose	ME799460	0.86	1.05
ethanolamine	ME799458	0.86	1.05
chiro-inositol	ME799426	0.86	1.05
dimethylarginine (SDMA + ADMA)	ME799445	0.86	1.05
alanylhistidine	ME799393	0.86	1.06
aspartate	ME799413	0.85	1.06
alanyltryptophan	ME799397	0.76	1.04
flavin adenine dinucleotide (FAD)	ME799459	0.84	1.08
valylaspartate	ME799639	0.82	1.07
1,5-anhydroglucitol (1,5-AG)	ME799324	0.82	1.07
docosahexaenoate (DHA; 22:6n3)	ME799446	0.82	1.07
glycerophosphorylcholine (GPC)	ME799476	0.81	1.07
hippurate	ME799488	0.81	1.07
1-docosahexaenoylglycerophosphoethanolamine*	ME799331	0.83	1.06
valylalanine	ME799637	0.83	1.06
phenylalanylglutamate	ME799577	0.83	1.07
cyclo(leu-ala)	ME799437	0.83	1.07
3-methylhistidine	ME799372	0.83	1.07
adrenate (22:4n6)	ME799390	0.83	1.07
asparagylvaline	ME799412	0.79	1.09
glycylglutamate	ME799481	0.79	1.10
hypotaurine	ME799493	0.80	1.08
valylvaline	ME799648	0.80	1.08
2-docosahexaenoylglycerophosphoethanolamine*	ME799350	0.79	1.07
N-palmitoyl-D-erythro-sphingosine	ME799556	0.78	1.07

Factors:

F1	Genotype:DZ
F2	Genotype:MZ

Data matrix