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CHEBI:187947 - (9R,13R)-10-oxo-11-phytoenoic acid

ChEBI IDCHEBI:187947
ChEBI Name(9R,13R)-10-oxo-11-phytoenoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H30O3
Net Charge0
Average Mass294.435
Monoisotopic Mass294.21949
SMILESCCCCC[C@@H]1C=CC(=O)[C@@H]1CCCCCCCC(=O)O
InChIInChI=1S/C18H30O3/c1-2-3-7-10-15-13-14-17(19)16(15)11-8-5-4-6-9-12-18(20)21/h13-16H,2-12H2,1H3,(H,20,21)/t15-,16-/m1/s1
InChIKeyWKABMUFTMQMEAJ-HZPDHXFCSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
ChEBI Ontology
Outgoing Relation(s)
(9R,13R)-10-oxo-11-phytoenoic acid (CHEBI:187947) is a prostanoid (CHEBI:26347)
IUPAC Name 
8-[(1R,5R)-2-oxo-5-pentylcyclopent-3-en-1-yl]octanoic acid
Manual XrefsDatabases
LMFA02010002LIPID MAPS
17220756ChemSpider