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CHEBI:142250 - octadeca-9,12-diynoic acid

ChEBI IDCHEBI:142250
ChEBI Nameoctadeca-9,12-diynoic acid
Stars
DefinitionAn octadecadiynoic acid having its triple bonds at positions 9 and 12.
Last Modified19 September 2018
Submittermwilliams
DownloadsMolfile
FormulaC18H28O2
Net Charge0
Average Mass276.420
Monoisotopic Mass276.20893
SMILESCCCCCC#CCC#CCCCCCCCC(=O)O
InChIInChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-5,8,11-17H2,1H3,(H,19,20)
InChIKeyKDYILQLPKVZDGB-UHFFFAOYSA-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)
octadeca-9,12-diynoic acid (CHEBI:142250) is a octadecadiynoic acid (CHEBI:61234)
IUPAC Name 
octadeca-9,12-diynoic acid
Synonyms  Source
9,12-octadecadiynoic acidChEBI
9a-12a-octadecadiynoic acidChemIDplus
ODYAChEBI
Manual XrefsDatabases
LMFA01030540LIPID MAPS
Registry NumbersSources
Reaxys:1789578Reaxys
CAS:2012-14-8ChemIDplus
Citations