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Details of 4-acetylbutyric acid

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Role Metabolite
MPIMP IDM001440
stereoisomer 
isotopomerambient
formulaC6H10O3.Na
molecular mass153.132
monoisotopic mass153.05276
InChIInChI=1S/C6H10O3.Na/c1-2-3-4-5(7)6(8)9;/h2-4H2,1H3,(H,8,9);/q;+1/p-1
InChIKeyWDCARDDLMCHULC-UHFFFAOYSA-M
class 
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27ac24f865-675d-486d-a7c1-243b49b6cbdb%27)

Synonyms of 4-acetylbutyric acid

propertyvalue
CAS13022-85-0
ChemSpider ID16156644
synonym4-acetylbutyric acid
3 synonym(s)

Derivatives of 4-acetylbutyric acid

Reference substances of 4-acetylbutyric acid

reference substancesuppliersupplier codelot
No Reference substances found!

Isotopomers and stereoisomers of 4-acetylbutyric acid

Quantitative 4-acetylbutyric acid 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.
NameOrganismFactorHeatmapBox plotVarianceAnova F score
no metabolite profile(s) found.

Qualitative 4-acetylbutyric acid Profile Data

species
no qualitative metabolite profile data available!
compound timestamp information
deposited at 9/24/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 10/1/2012 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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