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CHEBI:187256 - 12E,16E-octadecadienoic acid

ChEBI IDCHEBI:187256
ChEBI Name12E,16E-octadecadienoic acid
Stars
Last Modified23 February 2022
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O2
Net Charge0
Average Mass280.452
Monoisotopic Mass280.24023
SMILESC/C=C/CC/C=C/CCCCCCCCCCC(=O)O
InChIInChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-3,6-7H,4-5,8-17H2,1H3,(H,19,20)/b3-2+,7-6+
InChIKeyZKLAMZVXHZVASN-BLWKUPHCSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
12E,16E-octadecadienoic acid (CHEBI:187256) is a octadecadienoic acid (CHEBI:25627)
IUPAC Name 
(12E,16E)-octadeca-12,16-dienoic acid
Manual XrefsDatabases
LMFA01030301LIPID MAPS
4471877ChemSpider