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CHEBI:85197 - 9,10-dihydroxystearate

ChEBI IDCHEBI:85197
ChEBI Name9,10-dihydroxystearate
Stars
DefinitionA long-chain fatty acid anion that is the conjugate base of 9,10-dihydroxystearic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Secondary ChEBI IDCHEBI:20816
Last Modified6 May 2015
Submitternhn
DownloadsMolfile
FormulaC18H35O4
Net Charge-1
Average Mass315.474
Monoisotopic Mass315.25408
SMILESCCCCCCCCC(O)C(O)CCCCCCCC(=O)[O-]
InChIInChI=1S/C18H36O4/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)22/h16-17,19-20H,2-15H2,1H3,(H,21,22)/p-1
InChIKeyVACHUYIREGFMSP-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
9,10-dihydroxystearate (CHEBI:85197) is a hydroxy fatty acid anion (CHEBI:59835)
9,10-dihydroxystearate (CHEBI:85197) is a long-chain fatty acid anion (CHEBI:57560)
9,10-dihydroxystearate (CHEBI:85197) is conjugate base of 9,10-dihydroxyoctadecanoic acid (CHEBI:28724)
Incoming Relation(s)
(9R,10R)-dihydroxyoctadecanoate (CHEBI:142837) is a 9,10-dihydroxystearate (CHEBI:85197)
9,10-dihydroxyoctadecanoic acid (CHEBI:28724) is conjugate acid of 9,10-dihydroxystearate (CHEBI:85197)
IUPAC Name 
9,10-dihydroxyoctadecanoate
UniProt Name  Source
9,10-dihydroxyoctadecanoateUniProt
Citations