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CHEBI:91294 - 12,18-dihydroxyoctadecanoate

ChEBI IDCHEBI:91294
ChEBI Name12,18-dihydroxyoctadecanoate
Stars
DefinitionA hydroxy fatty acid anion that is the conjugate base of 12,18-dihydroxyoctadecanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified23 January 2023
Submitternhn
DownloadsMolfile
FormulaC18H35O4
Net Charge-1
Average Mass315.474
Monoisotopic Mass315.25408
SMILESO=C([O-])CCCCCCCCCCC(O)CCCCCCO
InChIInChI=1S/C18H36O4/c19-16-12-8-7-10-14-17(20)13-9-5-3-1-2-4-6-11-15-18(21)22/h17,19-20H,1-16H2,(H,21,22)/p-1
InChIKeyILQLNMYYQUJEBU-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
12,18-dihydroxyoctadecanoate (CHEBI:91294) is a ω-hydroxy-long-chain fatty acid anion (CHEBI:140992)
12,18-dihydroxyoctadecanoate (CHEBI:91294) is conjugate base of 12,18-dihydroxyoctadecanoic acid (CHEBI:128770)
Incoming Relation(s)
12,18-dihydroxyoctadecanoic acid (CHEBI:128770) is conjugate acid of 12,18-dihydroxyoctadecanoate (CHEBI:91294)
Synonym  Source
12,18-dihydroxystearateSUBMITTER
UniProt Name  Source
12,18-dihydroxyoctadecanoateUniProt
Citations