GOLM METABOLOME DATABASE

Details of Hexane

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Role Metabolite
MPIMP IDM000684
stereoisomern-
isotopomerambient
formulaC6H14
molecular mass86.176
monoisotopic mass86.10955
InChIInChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3
InChIKeyVLKZOEOYAKHREP-UHFFFAOYSA-N
classAlkane
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27680af2ee-a7b6-479b-bfb3-0f5354069f72%27)

Synonyms of Hexane

propertyvalue
BRENDA22648
CAS110-54-3
ChEBI IDChEBI:29021
ChEBI ontologyhas role non-polar solvent
ChEBI ontologyis a alkane
ChemSpider ID7767
MetaCycCPD-9288
PubChem CID8058
PubChem SID92297501
synonymCH3-[CH2]4-CH3
14 synonym(s)
    of 2    

Derivatives of Hexane

analytestereoisomerisotopomer
Hexane, n-  ambient
1 analyte(s)

Reference substances of Hexane

reference substancesuppliersupplier codelot
No Reference substances found!

Isotopomers and stereoisomers of Hexane

Quantitative Hexane 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 Hexane 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 8/7/2013 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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