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CHEBI:187438 - 9,10,11-trihydroxy-12Z-octadecenoic acid

ChEBI IDCHEBI:187438
ChEBI Name9,10,11-trihydroxy-12Z-octadecenoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H36O5
Net Charge0
Average Mass344.492
Monoisotopic Mass344.25627
SMILESCCCCCC/C=C\[C@@H](O)[C@@H](O)[C@@H](O)CCCCCCCC(=O)O
InChIInChI=1S/C19H36O5/c1-2-3-4-5-7-10-13-16(20)19(24)17(21)14-11-8-6-9-12-15-18(22)23/h10,13,16-17,19-21,24H,2-9,11-12,14-15H2,1H3,(H,22,23)/b13-10-/t16-,17+,19-/m1/s1
InChIKeyLPFKOMDPLVHSPN-HQCKIKERSA-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)
9,10,11-trihydroxy-12Z-octadecenoic acid (CHEBI:187438) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(Z,9S,10S,11R)-9,10,11-trihydroxynonadec-12-enoic acid
Manual XrefsDatabases
113371063ChemSpider
LMFA05000713LIPID MAPS