EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:76709 - 3-hydroxyicosanoate

Default Structure
ChEBI IDCHEBI:76709
ChEBI Name3-hydroxyicosanoate
Stars
DefinitionA hydroxy fatty acid anion that is the conjugate base of 3-hydroxyicosanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified15 June 2018
Submitterlaimo
DownloadsMolfile
FormulaC20H39O3
Net Charge-1
Average Mass327.529
Monoisotopic Mass327.29047
SMILESCCCCCCCCCCCCCCCCCC(O)CC(=O)[O-]
InChIInChI=1S/C20H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(21)18-20(22)23/h19,21H,2-18H2,1H3,(H,22,23)/p-1
InChIKeyXXKHCFPQYSMGCI-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
3-hydroxyicosanoate (CHEBI:76709) has functional parent icosanoate (CHEBI:32360)
3-hydroxyicosanoate (CHEBI:76709) is a 3-hydroxy fatty acid anion (CHEBI:84196)
3-hydroxyicosanoate (CHEBI:76709) is a hydroxy fatty acid anion 20:0 (CHEBI:139194)
3-hydroxyicosanoate (CHEBI:76709) is a long-chain fatty acid anion (CHEBI:57560)
3-hydroxyicosanoate (CHEBI:76709) is conjugate base of 3-hydroxyicosanoic acid (CHEBI:52347)
Incoming Relation(s)
3-hydroxyicosanoic acid (CHEBI:52347) is conjugate acid of 3-hydroxyicosanoate (CHEBI:76709)
IUPAC Name 
3-hydroxyicosanoate
Synonyms  Source
3-hydroxyarachidateSUBMITTER
3-OH-C20:0(1−)SUBMITTER
UniProt Name  Source
3-hydroxyeicosanoateUniProt