GOLM METABOLOME DATABASE

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Details of Hexanoic acid, 3-ethyl-

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Role	Metabolite
MPIMP ID	M000614
stereoisomer
isotopomer	ambient
formula	C8H16O2
molecular mass	144.212
monoisotopic mass	144.11503
InChI	InChI=1S/C8H16O2/c1-3-5-7(4-2)6-8(9)10/h7H,3-6H2,1-2H3,(H,9,10)
InChIKey	UWWDUVVCVCAPNU-UHFFFAOYSA-N
class	Acid (Fatty acid trimethylsilyl ester)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%278060bfa4-5e5d-464c-8acd-a17316e2ebe1%27)

Synonyms of Hexanoic acid, 3-ethyl-

property	value
ChemSpider ID	35506
PubChem CID	38755
PubChem SID	92298258
synonym	Caproic acid, 3-ethyl-
synonym	Hexanoic acid, 3-ethyl-
5 synonym(s)

Derivatives of Hexanoic acid, 3-ethyl-

analyte	stereoisomer	isotopomer
Hexanoic acid, 3-ethyl- (1TBS)		ambient
1 analyte(s)

Reference substances of Hexanoic acid, 3-ethyl-

reference substance	supplier	supplier code	lot
No Reference substances found!

Isotopomers and stereoisomers of Hexanoic acid, 3-ethyl-

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Hexanoic acid, 3-ethyl- Profile Data

Each graph visualises metabolite concentrations across a single metabolite profiling experiment. Each box plot represents relative (normalised) metabolite concentrations for single replica groups in the specific metabolite profiling experiment.

Name	Organism	Factor	Heatmap	Box plot	Variance	Anova F score
no metabolite profile(s) found.

Qualitative Hexanoic acid, 3-ethyl- Profile Data

species
no qualitative metabolite profile data available!

compound timestamp information
deposited	at 8/29/2006 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed	at 8/11/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Hummel J.

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