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CHEBI:215380 - (1S,2S)-3-oxo-2-pentylcyclopentane-1-octanoic acid methyl ester

ChEBI IDCHEBI:215380
ChEBI Name(1S,2S)-3-oxo-2-pentylcyclopentane-1-octanoic acid methyl ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H34O3
Net Charge0
Average Mass310.478
Monoisotopic Mass310.25079
SMILESCCCCC[C@@H]1C(=O)CC[C@@H]1CCCCCCCC(=O)OC
InChIInChI=1S/C19H34O3/c1-3-4-8-12-17-16(14-15-18(17)20)11-9-6-5-7-10-13-19(21)22-2/h16-17H,3-15H2,1-2H3/t16-,17-/m0/s1
InChIKeyBUIQBWUKJHFEOQ-IRXDYDNUSA-N
Species of MetaboliteComponentSourceComments
Fusarium oxysporum (ncbitaxon:5507) - DOI (10.1016/s0031-9422(98)00596-2)
ChEBI Ontology
Outgoing Relation(s)
(1S,2S)-3-oxo-2-pentylcyclopentane-1-octanoic acid methyl ester (CHEBI:215380) is a prostanoid (CHEBI:26347)
IUPAC Name 
methyl 8-[(1S,2S)-3-oxo-2-pentylcyclopentyl]octanoate
Manual XrefsDatabases
78438079ChemSpider