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Details of cis-4,7,10,13,16,19-docosahexaenoic acid

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Role Metabolite
MPIMP IDM000495
stereoisomern-
isotopomerambient
formulaC22H32O2
molecular mass328.489
monoisotopic mass328.24023
InChIInChI=1S/C22H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-
InChIKeyMBMBGCFOFBJSGT-KUBAVDMBSA-N
classAcid (Fatty acid trimethylsilyl ester)
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27800e8e72-bbf4-46f7-a60b-b8f2b54669c7%27)

Synonyms of cis-4,7,10,13,16,19-docosahexaenoic acid

propertyvalue
BRENDA12185
CAS6217-54-5
ChEBI IDChEBI:28125
ChEBI ontologyhas role nutraceutical
ChEBI ontologyis a docosahexaenoic acid
ChEBI ontologyis a docosahexaenoic acids
ChEBI ontologyis a omega-3 fatty acid
ChemSpider ID393183
PubChem CID445580
PubChem SID24893696
27 synonym(s)

Derivatives of cis-4,7,10,13,16,19-docosahexaenoic acid

Reference substances of cis-4,7,10,13,16,19-docosahexaenoic acid

Isotopomers and stereoisomers of cis-4,7,10,13,16,19-docosahexaenoic acid

Quantitative cis-4,7,10,13,16,19-docosahexaenoic 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 cis-4,7,10,13,16,19-docosahexaenoic acid 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 10/1/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Eckardt A., Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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