Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for High Resolution GC-MS Metabolomics of Non-Human Primate Serum (Study ST000972)

GCxGC TOF POSITIVE ION MODE (Analysis AN001592)

Metabolite	Structure	F1	F2
Uridine	ME238764	1.00	NA
Urea	ME238684	1.00	NA
Undecane	ME238802	1.00	NA
Trimethyl sulfonium	ME238789	1.00	NA
Trimethylamine	ME238706	1.00	NA
Tridecane	ME238809	1.00	NA
Tetradecanol	ME238788	1.00	NA
Tetradecal	ME238808	1.00	NA
Terephthalic acid	ME238724	1.00	NA
Taurine	ME238758	1.00	NA
Sucrose	ME238760	1.00	NA
Succinic acid	ME238759	1.00	NA
Stearic acid	ME238702	1.00	NA
Sarcosine	ME238762	1.00	NA
Salicylic acid	ME238781	1.00	NA
Ribonic acid	ME238704	1.00	NA
Pyrrolidonecarboxylic acid	ME238699	1.00	NA
Pyroglutamic acid	ME238761	1.00	NA
Pyridoxine	ME238683	1.00	NA
Putrescine	ME238714	1.00	NA
Purine	ME238712	1.00	NA
Pseudouridine	ME238697	1.00	NA
Propylthiouracil	ME238792	1.00	NA
Propionic acid	ME238682	1.00	NA
Propal	ME238727	1.00	NA
Prenol	ME238734	1.00	NA
Pipecolic acid	ME238668	1.00	NA
Phthalic acid	ME238718	1.00	NA
Phosphoric acid	ME238719	1.00	NA
Phenylglyoxylic acid	ME238778	1.00	NA
Phenylacetic acid	ME238679	1.00	NA
Pentadecanoic acid	ME238701	1.00	NA
Pelargonic acid	ME238703	1.00	NA
Palmitic acid	ME238681	1.00	NA
Palmitelaidic acid	ME238730	1.00	NA
Paliperidone	ME238795	1.00	NA
Oxalic acid	ME238723	1.00	NA
Ornithine	ME238756	1.00	NA
Oleamide	ME238783	1.00	NA
Octadecane	ME238805	1.00	NA
Nocosane	ME238810	1.00	NA
N-Methyl-a-aminoisobutyric acid	ME238784	1.00	NA
N-Dodecane	ME238801	1.00	NA
N-Decane	ME238803	1.00	NA
N-Alpha-acetyllysine	ME238686	1.00	NA
N-Acetyl-D-glucosamine	ME238757	1.00	NA
Myristic acid	ME238700	1.00	NA
myo-Inositol	ME238680	1.00	NA
Methyl propenyl ketone	ME238711	1.00	NA
Methyl benzoate	ME238807	1.00	NA
Methionine sulfoxide	ME238782	1.00	NA
Malonic acid	ME238696	1.00	NA
L-Valine	ME238705	1.00	NA
Lumichrome	ME238811	1.00	NA
L-Tyrosine	ME238673	1.00	NA
L-Tryptophan	ME238707	1.00	NA
L-Threonine	ME238676	1.00	NA
L-Serine	ME238753	1.00	NA
L-Proline	ME238675	1.00	NA
L-Phenylalanine	ME238674	1.00	NA
L-Methionine	ME238772	1.00	NA
L-Lysine	ME238751	1.00	NA
L-Leucine	ME238771	1.00	NA
L-Isoleucine	ME238750	1.00	NA
L-Iditol	ME238787	1.00	NA
L-Glutamine	ME238769	1.00	NA
L-Glutamic acid	ME238745	1.00	NA
Levamisole	ME238793	1.00	NA
L-Cystine	ME238754	1.00	NA
L-Aspartic acid	ME238678	1.00	NA
L-Asparagine	ME238749	1.00	NA
L-Arginine	ME238766	1.00	NA
L-Alanine	ME238747	1.00	NA
Ketamine	ME238794	1.00	NA
Isocaproic acid	ME238695	1.00	NA
Indoleacetic acid	ME238755	1.00	NA
Hydroxypropionic acid	ME238773	1.00	NA
Heptanoic acid	ME238694	1.00	NA
Heptadecanoic acid	ME238721	1.00	NA
Guanosine	ME238744	1.00	NA
Glyoxylic acid	ME238742	1.00	NA
Glycine	ME238743	1.00	NA
Glycerol	ME238671	1.00	NA
Glutaric acid	ME238693	1.00	NA
Gamma-Tocopherol	ME238715	1.00	NA
Ethyl benzoate	ME238806	1.00	NA
Ethylamine	ME238732	1.00	NA
Ethanolamine	ME238746	1.00	NA
Ethanol	ME238669	1.00	NA
Erythritol	ME238726	1.00	NA
Elaidic acid	ME238690	1.00	NA
D-Xylulose	ME238779	1.00	NA
D-Ribose 5-phosphate	ME238777	1.00	NA
D-Ribose	ME238763	1.00	NA
D-Pinitol	ME238737	1.00	NA
D-Phenyllactic acid	ME238768	1.00	NA
Dodecanoic acid	ME238692	1.00	NA
Docosanol	ME238733	1.00	NA
Docosahexaenoic acid	ME238720	1.00	NA
D-Mannose	ME238677	1.00	NA
D-Maltose	ME238748	1.00	NA
D-Malic acid	ME238804	1.00	NA
Dimethylurea	ME238796	1.00	NA
Dihydrouracil	ME238740	1.00	NA
D-Glucose	ME238670	1.00	NA
D-Galactose	ME238672	1.00	NA
D-Fructose	ME238770	1.00	NA
D-Alanine	ME238776	1.00	NA
Creatinine	ME238767	1.00	NA
Coumarin	ME238775	1.00	NA
Citric acid	ME238741	1.00	NA
Citraconic acid	ME238691	1.00	NA
Cholesterol	ME238667	1.00	NA
Carbamic acid	ME238728	1.00	NA
Carbachol	ME238791	1.00	NA
Caproic acid	ME238689	1.00	NA
Capric acid	ME238688	1.00	NA
Cadaverine	ME238722	1.00	NA
Butyric acid	ME238665	1.00	NA
Butyl propiote	ME238798	1.00	NA
Benzoic acid	ME238716	1.00	NA
Azelaic acid	ME238698	1.00	NA
Ascorbic acid	ME238739	1.00	NA
Arachidonic acid	ME238708	1.00	NA
Arabinofuranose	ME238729	1.00	NA
Aniline	ME238785	1.00	NA
Aminomalonic acid	ME238710	1.00	NA
Alpha-Tocopherol	ME238780	1.00	NA
Alpha-Linolenic acid	ME238713	1.00	NA
Alpha-Lactose	ME238752	1.00	NA
Allyl propiote	ME238797	1.00	NA
Allantoin	ME238765	1.00	NA
Aesculetin	ME238799	1.00	NA
Adipic acid	ME238687	1.00	NA
Acrylic acid	ME238736	1.00	NA
Acetic acid	ME238666	1.00	NA
4-Hydroxyproline	ME238774	1.00	NA
3-Methyl-3-buten-1-ol	ME238735	1.00	NA
3-Hexenedioic acid	ME238685	1.00	NA
2-Pyrrolidinone	ME238717	1.00	NA
2-Hydroxyphenethylamine	ME238709	1.00	NA
1-Undecanol	ME238790	1.00	NA
1-phthylamine	ME238812	1.00	NA
1-Hexanol	ME238731	1.00	NA
1-Hexadecanol	ME238786	1.00	NA
1-Butylamine	ME238800	1.00	NA
1,3-Diaminopropane	ME238738	1.00	NA
1,5-Anhydrosorbitol	ME238725	1.00	NA

Factors:

F1	Platform Type:2D GC-ToF-MS
F2	Platform Type:GC-Orbitrap-MS

Data matrix