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CHEBI:185070 - 9R,10S,18-trihydroxy-stearic acid

ChEBI IDCHEBI:185070
ChEBI Name9R,10S,18-trihydroxy-stearic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H36O5
Net Charge0
Average Mass332.481
Monoisotopic Mass332.25627
SMILESO=C(O)CCCCCCC[C@@H](O)[C@@H](O)CCCCCCCCO
InChIInChI=1S/C18H36O5/c19-15-11-7-2-1-4-8-12-16(20)17(21)13-9-5-3-6-10-14-18(22)23/h16-17,19-21H,1-15H2,(H,22,23)/t16-,17+/m0/s1
InChIKeyOISFHODBOQNZAG-DLBZAZTESA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
9R,10S,18-trihydroxy-stearic acid (CHEBI:185070) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(9R,10S)-9,10,18-trihydroxyoctadecanoic acid
Manual XrefsDatabases
LMFA02000006LIPID MAPS
Registry NumbersSources
CAS:17673-81-3ChemIDplus