Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST004402)

HILIC NEGATIVE ION MODE (Analysis AN007360)

Metabolite	Structure	F1	F2
2-Methylcitric acid	ME1228238	1.13	0.87
Tartaric acid	ME1228353	1.16	0.84
3-Methyl-2-oxovaleric acid	ME1228245	1.15	0.85
6-Phosphogluconic acid	ME1228249	1.15	0.85
CMP	ME1228264	1.24	0.76
dCMP	ME1228269	1.32	0.68
Glucosamine 6-phosphate	ME1228289	1.31	0.69
Nicotinamide purin-6-ol-dinucleotide	ME1228331	1.24	0.39
dUMP	ME1228274	1.47	0.53
Deoxyguanosine	ME1228270	1.70	0.30
Phosphocreatine	ME1228338	1.60	0.40
Galactaric acid	ME1228279	0.87	1.13
Malic acid	ME1228312	0.87	1.13
Glucose 6-phosphate	ME1228292	0.88	1.12
Pyroglutamic acid	ME1228344	0.88	1.12
Oxalic acid	ME1228335	0.86	1.14
Glucaric acid	ME1228287	0.86	1.14
Folic acid	ME1228275	0.86	1.14
Fumaric acid	ME1228278	0.86	1.14
Guanosine	ME1228300	0.85	1.15
N-Acetylphenylalanine	ME1228327	0.85	1.15
Succinic acid	ME1228351	0.92	1.08
Itaconic acid	ME1228308	0.92	1.08
Galactose 1-phosphate	ME1228282	0.92	1.08
CTP	ME1228265	0.92	1.08
Citramalic acid	ME1228262	0.92	1.08
Allose	ME1228254	0.92	1.08
ATP	ME1228257	0.92	1.08
Xanthosine	ME1228367	0.91	1.09
N-Methyl-glutamic acid	ME1228333	0.91	1.09
Pipecolic acid	ME1228341	0.91	1.09
Malonic acid	ME1228313	0.89	1.11
ADP-glucose	ME1228251	0.90	1.10
Glyceric acid	ME1228297	0.90	1.10
UDP-N-acetylglucosamine	ME1228359	1.09	0.91
NADH	ME1228329	1.03	0.94
Dimethylallyl-diphosphate	ME1228272	1.07	0.93
4-Hydroxybenzaldehyde	ME1228247	1.06	0.94
Isocitric acid	ME1228306	1.06	0.94
dCDP	ME1228268	1.04	0.96
Ureidopropionic acid	ME1228361	1.05	0.95
N-Acetylaspartic acid	ME1228323	1.05	0.95
Isopentenyl-diphosphate	ME1228307	1.05	0.95
Meso-tartaric acid	ME1228319	1.05	0.95
Oxaloacetic acid	ME1228336	0.99	1.01
2-Hydroxybutyric acid	ME1228237	0.99	1.01
GDP	ME1228285	0.99	1.01
UDP	ME1228355	1.00	1.00
N-Acetylglutamic acid	ME1228324	1.00	1.00
3^,5^ cyclic GMP	ME1228242	1.00	1.00
Dihydroxyacetone phosphate	ME1228271	1.00	1.00
Citric acid	ME1228263	1.01	0.99
Uridine	ME1228363	1.01	0.99
GDP-mannose	ME1228286	1.02	0.98
Glyoxylic acid	ME1228298	1.02	0.98
2-Oxoglutaric acid	ME1228239	0.94	1.06
Lactic acid	ME1228309	0.95	1.05
Mannose 6-phosphate	ME1228317	0.95	1.05
Hydroxypyruvic acid	ME1228304	0.98	1.02
UDP-galactose	ME1228356	0.96	1.04
CDP-Ethanolamine	ME1228260	0.96	1.04
Maleic acid	ME1228311	0.96	1.04
UTP	ME1228365	0.97	1.03
Methylacetoacetic acid	ME1228320	0.97	1.03
sn-Glycero-3-phosphate	ME1228348	0.97	1.03
Glucuronic acid	ME1228293	0.83	1.17
3-Hydroxymethylglutaric acid	ME1228244	0.83	1.17
Galacturonic acid	ME1228283	0.83	1.17
Fructose 1,6-bisphosphate	ME1228276	0.81	1.19
UMP	ME1228360	0.82	1.18
2^,3^ cyclic AMP	ME1228236	0.82	1.18
3^,5^ cyclic AMP	ME1228241	0.82	1.18
N-Acetylglycine	ME1228325	0.78	1.22
dAMP	ME1228267	0.79	1.21
10-Hydroxydecanoic acid	ME1228235	0.79	1.21
6-Hydroxynicotinic acid	ME1228248	0.79	1.21
Sorbose	ME1228350	0.80	1.20
Ribose 5-phosphate	ME1228346	0.80	1.20
Psicose	ME1228342	0.80	1.20
N-Acetylalanine	ME1228322	0.80	1.20
Glucose	ME1228290	0.80	1.20
Galactose	ME1228281	0.80	1.20
Allantoin	ME1228253	0.80	1.20
D-Tagatose	ME1228273	0.80	1.20
AMP	ME1228255	0.70	1.30
GMP	ME1228299	0.71	1.29
Myo-inositol	ME1228321	0.74	1.26
Mannose	ME1228316	0.74	1.26
Mannitol	ME1228315	0.74	1.26
Aspartic acid	ME1228256	0.74	1.26
Gulose	ME1228301	0.74	1.26
N-Methyl-D-aspartic acid	ME1228332	0.73	1.27
Fructose 6-phosphate	ME1228277	0.73	1.27
Glutamic acid	ME1228295	0.73	1.27
Sorbitol	ME1228349	0.75	1.25
Glucose 1-phosphate	ME1228291	0.75	1.25
Glucuronolactone	ME1228294	0.75	1.25
3E-Methylglutaconic acid	ME1228243	0.77	1.23
ADP	ME1228250	0.77	1.23
Uric acid	ME1228362	0.76	1.24
O-Acetylserine	ME1228334	0.76	1.24
Galactitol	ME1228280	0.76	1.24
N-Acetylserine	ME1228328	0.76	1.24
Urocanic acid	ME1228364	0.65	1.35
Trehalose	ME1228354	0.64	1.36
Sucrose	ME1228352	0.64	1.36
Palatinose	ME1228337	0.64	1.36
Melibiose	ME1228318	0.64	1.36
Maltose	ME1228314	0.64	1.36
Cellobiose	ME1228261	0.64	1.36
Lactose	ME1228310	0.64	1.36
gamma-Aminobutyric acid	ME1228284	0.66	1.34
sn-Glycero-2-phosphate	ME1228347	0.66	1.34
Homovanillic acid	ME1228302	0.67	1.33
Azelaic acid	ME1228258	0.68	1.32
Hydroxyphenyllactic acid	ME1228303	0.68	1.32
N-Acetylmethionine	ME1228326	0.54	1.46
Gluconic acid	ME1228288	0.59	1.41
Butyric acid	ME1228259	0.57	1.43
Pyridoxal 5^-phosphate	ME1228343	0.56	1.44
IMP	ME1228305	0.25	1.75
Phosphoserine	ME1228340	0.23	1.77
AICAR-P	ME1228252	0.44	1.56
Phosphoenolpyruvic acid	ME1228339	0.44	1.56
UDP-glucuronic acid	ME1228358	0.51	1.49
N-Formylmethionine	ME1228330	0.49	1.51
2-Phosphoglyceric acid	ME1228240	0.47	1.53
3-Phosphoglyceric acid	ME1228246	0.48	1.52

Factors:

F1	Sample source:Male Homo sapien iPSCs derived neurons \| Genotype:FXS
F2	Sample source:Male Homo sapien iPSCs derived neurons \| Genotype:TD

Data matrix