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CHEBI:190799 - 4,5-dehydro Docosahexaenoic Acid

ChEBI IDCHEBI:190799
ChEBI Name4,5-dehydro Docosahexaenoic Acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H30O2
Net Charge0
Average Mass326.480
Monoisotopic Mass326.22458
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC#CCCC(=O)O
InChIInChI=1S/C22H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17,20-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-,16-15-
InChIKeyOXENLKNOBTVOJA-JLNKQSITSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) root (BTO:0001188) MetaboLights (MTBLS4362)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4,5-dehydro Docosahexaenoic Acid (CHEBI:190799) is a very long-chain fatty acid (CHEBI:27283)
IUPAC Name 
(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaen-4-ynoic acid
Manual XrefsDatabases
9568148ChemSpider