EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:67260 - geranate

ChEBI IDCHEBI:67260
ChEBI Namegeranate
Stars
DefinitionAn unsaturated fatty acid anion that is the conjugate base of geranic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified8 January 2014
SubmitterKAX
DownloadsMolfile
FormulaC10H15O2
Net Charge-1
Average Mass167.228
Monoisotopic Mass167.10775
SMILESCC(C)=CCC/C(C)=C/C(=O)[O-]
InChIInChI=1S/C10H16O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,7H,4,6H2,1-3H3,(H,11,12)/p-1/b9-7+
InChIKeyZHYZQXUYZJNEHD-VQHVLOKHSA-M
ChEBI Ontology
Outgoing Relation(s)
geranate (CHEBI:67260) is a polyunsaturated fatty acid anion (CHEBI:76567)
geranate (CHEBI:67260) is conjugate base of geranic acid (CHEBI:67264)
Incoming Relation(s)
geranic acid (CHEBI:67264) is conjugate acid of geranate (CHEBI:67260)
IUPAC Name 
(2E)-3,7-dimethylocta-2,6-dienoate
Synonym  Source
(E)-3,7-dimethylocta-2,6-dienoateChEBI
UniProt Name  Source
geranateUniProt
Manual XrefsDatabases
CPD-7618MetaCyc
Citations