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CHEBI:221167 - (1S,2R)-3-oxo-2-pentylcyclopentane-1-hexanoic acid methyl ester

ChEBI IDCHEBI:221167
ChEBI Name(1S,2R)-3-oxo-2-pentylcyclopentane-1-hexanoic acid methyl ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H30O3
Net Charge0
Average Mass282.424
Monoisotopic Mass282.21949
SMILESCCCCC[C@H]1C(=O)CC[C@@H]1CCCCCC(=O)OC
InChIInChI=1S/C17H30O3/c1-3-4-6-10-15-14(12-13-16(15)18)9-7-5-8-11-17(19)20-2/h14-15H,3-13H2,1-2H3/t14-,15+/m0/s1
InChIKeyJHOXQZUAUCLZOH-LSDHHAIUSA-N
Species of MetaboliteComponentSourceComments
Fusarium oxysporum (ncbitaxon:5507) - DOI (10.1016/s0031-9422(98)00596-2)
ChEBI Ontology
Outgoing Relation(s)
(1S,2R)-3-oxo-2-pentylcyclopentane-1-hexanoic acid methyl ester (CHEBI:221167) is a prostanoid (CHEBI:26347)
IUPAC Name 
methyl 6-[(1S,2R)-3-oxo-2-pentylcyclopentyl]hexanoate
Manual XrefsDatabases
78437676ChemSpider