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CHEBI:9261 - sterculic acid

ChEBI IDCHEBI:9261
ChEBI Namesterculic acid
Stars
DefinitionA long-chain, monounsaturated fatty acid composed of 9-octadecenoic acid having a 9,10-cyclopropenyl group.
Last Modified28 July 2014
DownloadsMolfile
FormulaC19H34O2
Net Charge0
Average Mass294.479
Monoisotopic Mass294.25588
SMILESCCCCCCCCC1=C(CCCCCCCC(=O)O)C1
InChIInChI=1S/C19H34O2/c1-2-3-4-5-7-10-13-17-16-18(17)14-11-8-6-9-12-15-19(20)21/h2-16H2,1H3,(H,20,21)
InChIKeyPQRKPYLNZGDCFH-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)
sterculic acid (CHEBI:9261) has functional parent octadec-9-enoic acid (CHEBI:36021)
sterculic acid (CHEBI:9261) is a cyclopropenyl fatty acid (CHEBI:23501)
sterculic acid (CHEBI:9261) is a long-chain fatty acid (CHEBI:15904)
sterculic acid (CHEBI:9261) is a monounsaturated fatty acid (CHEBI:25413)
IUPAC Name 
8-(2-octylcycloprop-1-en-1-yl)octanoic acid
Synonyms  Source
Sterculic acidKEGG COMPOUND
2-octyl-1-cyclopropene-1-octanoic acidChemIDplus
9,10-methylene-9-octadecenoic acidLIPID MAPS
ω-(2-n-octylcycloprop-1-enyl)octanoic acidLIPID MAPS
SterculinsäureChEBI
Sterculia-SäureChEBI
Manual XrefsDatabases
C08366KEGG COMPOUND
LMFA01140018LIPID MAPS
C00001239KNApSAcK
Registry NumbersSources
Reaxys:1880442Reaxys
CAS:738-87-4KEGG COMPOUND
CAS:738-87-4ChemIDplus
Citations