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CHEBI:187928 - (1R,2R)-3-oxo-2-pentyl-cyclopentaneoctanoic acid

Default Structure
ChEBI IDCHEBI:187928
ChEBI Name(1R,2R)-3-oxo-2-pentyl-cyclopentaneoctanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O3
Net Charge0
Average Mass296.451
Monoisotopic Mass296.23514
SMILESCCCCC[C@H]1C(=O)CC[C@H]1CCCCCCCC(=O)O
InChIInChI=1S/C18H32O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h15-16H,2-14H2,1H3,(H,20,21)/t15-,16-/m1/s1
InChIKeyITXGIRZCCUTEJX-HZPDHXFCSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
ChEBI Ontology
Outgoing Relation(s)
(1R,2R)-3-oxo-2-pentyl-cyclopentaneoctanoic acid (CHEBI:187928) is a prostanoid (CHEBI:26347)
IUPAC Name 
8-[(1R,2R)-3-oxo-2-pentylcyclopentyl]octanoic acid
Manual XrefsDatabases
17220760ChemSpider
LMFA02010012LIPID MAPS