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CHEBI:28724 - 9,10-dihydroxyoctadecanoic acid

ChEBI IDCHEBI:28724
ChEBI Name9,10-dihydroxyoctadecanoic acid
Stars
DefinitionA hydroxy-fatty acid formally derived from octacecanoic (stearic) acid by hydroxy substitution at positions 9 and 10.
Secondary ChEBI IDsCHEBI:2329, CHEBI:20815
Last Modified23 March 2017
DownloadsMolfile
FormulaC18H36O4
Net Charge0
Average Mass316.482
Monoisotopic Mass316.26136
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)
InChIKeyVACHUYIREGFMSP-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
9,10-dihydroxyoctadecanoic acid (CHEBI:28724) is a dihydroxy monocarboxylic acid (CHEBI:35972)
9,10-dihydroxyoctadecanoic acid (CHEBI:28724) is a hydroxyoctadecanoic acid (CHEBI:24747)
9,10-dihydroxyoctadecanoic acid (CHEBI:28724) is conjugate acid of 9,10-dihydroxystearate (CHEBI:85197)
Incoming Relation(s)
(S,S)-9,10-dihydroxyoctadecanoic acid (CHEBI:49254) is a 9,10-dihydroxyoctadecanoic acid (CHEBI:28724)
9,10-dihydroxystearate (CHEBI:85197) is conjugate base of 9,10-dihydroxyoctadecanoic acid (CHEBI:28724)
IUPAC Name 
9,10-dihydroxyoctadecanoic acid
Synonyms  Source
9,10-DihydroxystearinsäureChemIDplus
DioxystearinsäureChemIDplus
DHSAChEBI
9,10-DHSAChEBI
9,10-diOH C18:0ChEBI
9,10-diOH 18:0ChEBI
Manual XrefsDatabases
LMFA02000142LIPID MAPS
Registry NumbersSources
Gmelin:383116Gmelin
Reaxys:1728015Reaxys
CAS:120-87-6ChemIDplus
Citations