Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST004242)

Reversed phase NEGATIVE ION MODE (Analysis AN007062)

Metabolite	Structure	F1	F2	F3
5-OXO-D-PROLINE_2	ME1148259	1.10	1.09	0.82
THYMIDINE_2	ME1148358	0.82	0.91	1.24
3-SULFINO-L-ALANINE	ME1148250	1.09	0.98	0.95
ALPHA-KETOGLUTARIC ACID_2	ME1148267	0.98	1.15	0.86
L-GLUTAMIC ACID_3	ME1148317	1.08	0.95	0.98
2,4-Dinitrophenol	ME1148239	1.13	0.99	0.90
N-BOC-L-Tryptophan_1	ME1148342	0.99	1.02	1.00
SUCCINATE_1	ME1148353	0.92	1.25	0.82
HOMOSERINE	ME1148307	1.73	0.67	0.71
CITRULLINE_1	ME1148281	0.81	1.07	1.09
D-(-)-3-PHOSPHOGLYCERIC ACID	ME1148286	0.75	1.25	0.96
D-ASPARTATE	ME1148289	1.22	0.89	0.91
SUCCINATE_2	ME1148354	0.92	1.26	0.81
ASPARTATE	ME1148272	1.13	1.01	0.88
ASPARAGINE	ME1148271	1.51	0.74	0.82
L-GLUTAMIC ACID_2	ME1148316	1.06	0.96	0.99
D-(+)-CELLOBIOSE_1	ME1148287	0.46	1.92	0.55
ALDOPENTOSE	ME1148264	0.99	1.07	0.94
3-tert-Butyladipic acid	ME1148251	1.01	1.02	0.97
ALPHA-AMINOADIPATE	ME1148265	1.15	0.98	0.88
2,5-DIHYDROXYBENZOATE	ME1148240	0.02	1.29	1.55
4-METHYL-2-OXO-PENTANOIC ACID	ME1148256	1.08	0.97	0.96
6-Hydroxycaproic acid_1	ME1148261	0.94	0.91	1.15
L-VALINE	ME1148327	0.93	1.07	0.99
INDOLE-3-ACETATE	ME1148310	1.07	0.96	0.98
INOSINE	ME1148311	1.18	1.08	0.77
5-Acetamidopentanoate	ME1148257	1.14	1.02	0.86
Succinic-2,2,3,3-D4 Acid	ME1148355	0.96	1.04	0.99
D-(+)-CELLOBIOSE_2	ME1148288	1.26	1.05	0.73
5-OXO-D-PROLINE_1	ME1148258	1.09	1.10	0.83
2^-DEOXYGUANOSINE	ME1148243	0.83	0.92	1.23
2-DEOXY-D-GLUCOSE_1	ME1148232	0.67	0.86	1.43
AZELAIC ACID_1	ME1148273	1.01	1.21	0.78
Creatine-D3	ME1148284	1.04	0.94	1.02
6-Hydroxycaproic acid_2	ME1148262	1.06	0.97	0.98
ADENINE	ME1148263	0.78	0.91	1.28
N-ACETYL-L-ALANINE	ME1148334	0.99	1.01	1.00
4-HYDROXYPHENYLACETATE	ME1148255	0.29	1.66	0.95
6-CARBOXYHEXANOATE	ME1148260	0.99	1.08	0.93
ALPHA-KETOGLUTARIC ACID_1	ME1148266	1.08	1.04	0.89
1-Methylxanthine	ME1148230	0.74	1.73	0.49
D-GLUCONATE	ME1148290	1.12	1.06	0.84
3-(2-HYDROXYPHENYL)PROPANOATE	ME1148244	1.06	1.05	0.90
3,4-DIHYDROXY-L-PHENYLALANINE	ME1148252	1.12	0.89	1.01
N-ACETYLNEURAMINATE	ME1148337	1.20	1.04	0.79
O-ACETYL-L-SERINE	ME1148344	1.07	0.92	1.02
UROCANATE	ME1148360	1.33	0.97	0.74
D-GLYCERIC ACID	ME1148291	1.75	0.63	0.73
PROPIONATE	ME1148346	1.67	0.58	0.84
PYRIDOXAMINE	ME1148347	1.04	0.94	1.03
MEVALOLACTONE	ME1148330	1.04	1.03	0.93
THYMIDINE_1	ME1148357	0.78	0.95	1.24
GLUCOSE/FRUCTOSE_3	ME1148297	1.64	0.84	0.61
GLUCOSE/FRUCTOSE_2	ME1148296	1.12	1.09	0.80
GLUCOSE/FRUCTOSE_5	ME1148299	0.70	1.57	0.69
L-Phenylalanine-13C6	ME1148323	0.97	1.02	1.00
GLUTARATE_1	ME1148300	1.05	1.14	0.81
L-ISOLEUCINE	ME1148319	0.97	1.03	0.99
Sulfoacetaldehyde	ME1148356	1.06	0.73	1.22
AZELAIC ACID_3	ME1148275	1.01	1.06	0.94
2-Oxoadipate	ME1148238	1.09	1.09	0.84
Erythrulose	ME1148294	1.08	1.10	0.84
ARABINOSE	ME1148268	0.93	1.43	0.63
HYPOTAURINE_2	ME1148309	1.20	0.95	0.89
Vanillin	ME1148361	1.08	0.93	1.00
GLUCOSE/FRUCTOSE_1	ME1148295	1.32	1.00	0.72
L-Cysteine-S-Sulfate	ME1148314	1.21	0.94	0.88
CITRULLINE_2	ME1148282	1.17	0.98	0.88
D-SACCHARIC ACID	ME1148292	1.79	0.63	0.69
Cystine	ME1148285	1.02	1.15	0.84
L-ARGININE	ME1148312	1.35	0.80	0.91
ASCORBATE	ME1148269	0.61	1.34	0.99
3-(4-HYDROXYPHENYL)LACTATE	ME1148245	1.28	0.90	0.86
2-DEOXY-D-GLUCOSE_3	ME1148234	1.61	0.74	0.74
2-METHYLGLUTARIC ACID_2	ME1148237	1.06	1.20	0.75
N-BOC-L-Tryptophan_2	ME1148343	0.99	1.01	1.00
3-methyladipic acid	ME1148249	0.99	1.07	0.93
3-HYDROXYPHENYLACETATE	ME1148248	0.93	1.16	0.90
GLYCERALDEHYDE	ME1148302	0.91	1.38	0.69
QUINATE	ME1148348	1.21	1.29	0.54
Tryptophan-2,3,3-D3	ME1148359	0.98	1.00	1.02
3^,5^-CYCLIC AMP	ME1148253	0.96	1.01	1.02
L-TYROSINE	ME1148325	1.07	0.99	0.95
GLYCINE	ME1148303	0.99	1.13	0.88
1-AMINOCYCLOPROPANE-1-CARBOXYLATE	ME1148229	1.04	0.98	0.98
2,6-DIHYDROXYPYRIDINE	ME1148242	1.09	1.11	0.81
L-GLUTAMIC ACID_1	ME1148315	1.60	0.73	0.75
3-HYDROXY-3-METHYLGLUTARATE	ME1148246	1.19	1.08	0.76
LEUCINE	ME1148329	1.03	1.00	0.97
GUANINE	ME1148305	0.80	0.85	1.32
S-CARBOXYMETHYL-L-CYSTEINE	ME1148349	1.89	0.50	0.73
N-ACETYL-L-LEUCINE	ME1148335	1.15	1.01	0.86
PHENYLPYRUVATE	ME1148345	1.01	0.97	1.02
HEXANOATE	ME1148306	1.12	0.76	1.13
2-METHYLGLUTARIC ACID_1	ME1148236	1.06	1.21	0.74
2-AMINOETHYL DIHYDROGEN PHOSPHATE	ME1148231	0.59	1.35	1.01
2-HYDROXY-4-(METHYLTHIO)BUTYRIC ACID	ME1148235	1.14	1.01	0.87
L-METHIONINE	ME1148321	0.99	0.90	1.11
BOC-L-Tyrosine_1	ME1148278	1.01	1.00	0.99
ASCORBIC ACID-2H	ME1148270	1.13	1.04	0.85
BETA-ALANINE	ME1148277	1.00	1.03	0.97
2,5-DIMETHYLPYRAZINE	ME1148241	1.03	0.99	0.98
2-DEOXY-D-GLUCOSE_2	ME1148233	1.04	0.89	1.07
L-Tyrosine-13C6	ME1148326	0.98	1.01	1.01
Caffeic Acid	ME1148280	0.97	1.18	0.84
AZELAIC ACID_4	ME1148276	1.00	1.06	0.94
N-BOC-L-Aspartic Acid_2	ME1148339	0.99	1.01	0.99
AZELAIC ACID_2	ME1148274	1.01	1.06	0.93
L-CYSTEIC ACID	ME1148313	1.09	0.99	0.94
3-HYDROXYBENZOATE	ME1148247	1.09	1.00	0.92
BOC-L-Tyrosine_2	ME1148279	1.01	1.00	0.99
N-BOC-L-tert-Leucine_1	ME1148340	0.96	1.02	1.01
GLUTARATE_2	ME1148301	1.03	1.14	0.83
Salicylic Acid-D4	ME1148350	0.98	1.01	1.01
CREATINE	ME1148283	0.82	1.37	0.78
GLYCOLATE	ME1148304	1.11	1.05	0.85
Mono-(2-Ethylhexyl) Phthalate	ME1148331	1.02	1.06	0.93
(R)-MALATE	ME1148227	1.07	0.92	1.02
SARCOSINE/BETA-ALANINE	ME1148351	1.16	1.03	0.83
L-PHENYLALANINE	ME1148322	1.09	1.00	0.92
Monoethyl phthalate (mEP)	ME1148333	1.03	0.98	1.00
(S)-LACTATE	ME1148228	0.69	1.42	0.84
D-TRYPTOPHAN	ME1148293	1.04	0.98	0.99
L-Leucine-13C6	ME1148320	0.92	1.04	1.03
N-BOC-L-Aspartic Acid_1	ME1148338	1.00	1.01	0.99
GLUCOSE/FRUCTOSE_4	ME1148298	0.86	1.42	0.70
N-ACETYLGLYCINE	ME1148336	1.04	1.04	0.93
L-SERINE	ME1148324	1.66	0.66	0.77
LACTATE	ME1148328	0.92	1.18	0.88
SUBERIC ACID	ME1148352	0.99	1.12	0.89
L-HISTIDINE	ME1148318	1.16	0.87	0.99
N-BOC-L-tert-Leucine_2	ME1148341	0.97	1.02	1.01
HYPOTAURINE_1	ME1148308	1.67	0.65	0.78
4-HYDROXYBENZALDEHYDE	ME1148254	0.97	1.12	0.90
Monobenzyl phthalate (mBzP)	ME1148332	1.11	1.05	0.86

Factors:

F1	Sample source:Splenic Tfh cells \| Genotype:Wild-type \| Treatment:WT_Ctrl
F2	Sample source:Splenic Tfh cells \| Genotype:W.Yaa \| Treatment:2DG
F3	Sample source:Splenic Tfh cells \| Genotype:W.Yaa \| Treatment:Ctrl

Data matrix