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CHEBI:86142 - (9Z,12E)-hexadecadienoic acid

ChEBI IDCHEBI:86142
ChEBI Name(9Z,12E)-hexadecadienoic acid
Stars
ASCII Name(9Z,12E)-hexadecadienoic acid
DefinitionA hexadecadienoic acid having two double bonds located at positions 9 and 12 (the 9Z,12E-geoisomer).
Last Modified22 June 2015
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-HTKRNXBHSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(9Z,12E)-hexadecadienoic acid (CHEBI:86142) is a hexadecadienoic acid (CHEBI:77524)
Incoming Relation(s)
(9Z,12E)-hexadecadienoyl-containing glycerolipid (CHEBI:88262) has functional parent (9Z,12E)-hexadecadienoic acid (CHEBI:86142)
(9Z,12E)-hexadecadienoyl group (CHEBI:85923) is substituent group from (9Z,12E)-hexadecadienoic acid (CHEBI:86142)
Manual XrefsDatabases
CPD-17412MetaCyc