Terminology Service for NFDI4Health
3-hydroxyoctadecanoate
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http://purl.obolibrary.org/obo/CHEBI_76614
A 3-hydroxy fatty acid anion that is the conjugate base of 3-hydroxyoctadecanoic acid (3-hydroxystearic acid), obtained by deprotonation of the carboxy group; major species at pH 7.3.
Term info
Label
3-hydroxyoctadecanoate
Synonyms
- 3-hydroxyoctadecanoate
Subsets
3_STAR
charge
-1
formula
C18H35O3
has obo namespace
chebi_ontology
has related synonym
beta-hydroxystearate, beta-hydroxyoctadecanoate, 3-hydroxystearate, 3-OH-C18:0(1-)
id
CHEBI:76614
inchi
InChI=1S/C18H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(19)16-18(20)21/h17,19H,2-16H2,1H3,(H,20,21)/p-1
inchikey
POMQYTSPMKEQNB-UHFFFAOYSA-M
mass
299.46870
monoisotopicmass
299.25917
smiles
CCCCCCCCCCCCCCCC(O)CC([O-])=O