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CHEBI:206071 - Citrinolactone A

ChEBI IDCHEBI:206071
ChEBI NameCitrinolactone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H14O6
Net Charge0
Average Mass290.271
Monoisotopic Mass290.07904
SMILESCOC(=O)[C@]1(O)CCc2oc(=O)c3c(O)cc(C)cc3c21
InChIInChI=1S/C15H14O6/c1-7-5-8-11(9(16)6-7)13(17)21-10-3-4-15(19,12(8)10)14(18)20-2/h5-6,16,19H,3-4H2,1-2H3/t15-/m0/s1
InChIKeyMWJQDTTVNPGMAY-HNNXBMFYSA-N
Species of MetaboliteComponentSourceComments
Penicillium citrinum (ncbitaxon:5077) - PubMed (17284855)
ChEBI Ontology
Outgoing Relation(s)
Citrinolactone A (CHEBI:206071) is a isocoumarins (CHEBI:38758)
IUPAC Name 
methyl (1S)-1,6-dihydroxy-8-methyl-5-oxo-2,3-dihydrocyclopenta[c]isochromene-1-carboxylate
Manual XrefsDatabases
24608519ChemSpider