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CHEBI:85147 - (9S,10R)-dihydroxyoctadecanoate

ChEBI IDCHEBI:85147
ChEBI Name(9S,10R)-dihydroxyoctadecanoate
Stars
ASCII Name(9S,10R)-dihydroxyoctadecanoate
DefinitionA hydroxy fatty acid anion that is the conjugate base of (9S,10R)-dihydroxyoctadecanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified5 May 2015
Submitternhn
DownloadsMolfile
FormulaC18H35O4
Net Charge-1
Average Mass315.474
Monoisotopic Mass315.25408
SMILESCCCCCCCC[C@@H](O)[C@@H](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/t16-,17+/m1/s1
InChIKeyVACHUYIREGFMSP-SJORKVTESA-M
ChEBI Ontology
Outgoing Relation(s)
(9S,10R)-dihydroxyoctadecanoate (CHEBI:85147) is a hydroxy fatty acid anion (CHEBI:59835)
(9S,10R)-dihydroxyoctadecanoate (CHEBI:85147) is a long-chain fatty acid anion (CHEBI:57560)
(9S,10R)-dihydroxyoctadecanoate (CHEBI:85147) is conjugate base of (9S,10R)-dihydroxyoctadecanoic acid (CHEBI:85633)
Incoming Relation(s)
(9S,10R)-dihydroxyoctadecanoic acid (CHEBI:85633) is conjugate acid of (9S,10R)-dihydroxyoctadecanoate (CHEBI:85147)
IUPAC Names 
(9S,10R)-dihydroxystearate
(9S,10R)-dihydroxyoctadecanoate
UniProt Name  Source
(9S,10R)-dihydroxyoctadecanoateUniProt
Citations