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CHEBI:77522 - (9Z,12Z)-hexadecadienoic acid

ChEBI IDCHEBI:77522
ChEBI Name(9Z,12Z)-hexadecadienoic acid
Stars
ASCII Name(9Z,12Z)-hexadecadienoic acid
DefinitionA hexadecadienoic acid in which the two double bonds are located at positions 9 and 12 (the 9Z,12Z-isomer).
Last Modified24 March 2016
SubmitterSteve
DownloadsMolfile
FormulaC16H28O2
Net Charge0
Average Mass252.398
Monoisotopic Mass252.20893
SMILESCCC/C=C\C/C=C\CCCCCCCC(=O)O
InChIInChI=1S/C16H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h4-5,7-8H,2-3,6,9-15H2,1H3,(H,17,18)/b5-4-,8-7-
InChIKeyRVEKLXYYCHAMDF-UTOQUPLUSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
(9Z,12Z)-hexadecadienoic acid (CHEBI:77522) has role plant metabolite (CHEBI:76924)
(9Z,12Z)-hexadecadienoic acid (CHEBI:77522) is a hexadecadienoic acid (CHEBI:77524)
(9Z,12Z)-hexadecadienoic acid (CHEBI:77522) is conjugate acid of (9Z,12Z)-hexadecadienoate (CHEBI:77219)
Incoming Relation(s)
(9Z,12Z)-hexadecadienoyl-CoA (CHEBI:76889) has functional parent (9Z,12Z)-hexadecadienoic acid (CHEBI:77522)
1-[(10Z,13Z,16Z)-docosatrienoyl]-2-[(9Z,12Z)-hexadecadienoyl]-sn-glycero-3-phospho-1D-myo-inositol (CHEBI:89247) has functional parent (9Z,12Z)-hexadecadienoic acid (CHEBI:77522)
(9Z,12Z)-hexadecadienoate (CHEBI:77219) is conjugate base of (9Z,12Z)-hexadecadienoic acid (CHEBI:77522)
IUPAC Name 
(9Z,12Z)-hexadeca-9,12-dienoic acid
Synonyms  Source
Palmitolinoleic acidLIPID MAPS
C16:2n-4,7LIPID MAPS
9Z,12Z-hexadecadienoic acidLIPID MAPS
Manual XrefsDatabases
LMFA01030275LIPID MAPS
Registry NumbersSources
CAS:5070-03-1Reaxys
Citations