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CHEBI:213982 - Citreoviripyrone A

ChEBI IDCHEBI:213982
ChEBI NameCitreoviripyrone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H28O3
Net Charge0
Average Mass352.474
Monoisotopic Mass352.20384
SMILESCOc1cc(=O)oc(/C=C/C=C/[C@@H]2[C@H]3C(C)=CC(C)=C[C@@]3(C)[C@H]2C)c1C
InChIInChI=1S/C23H28O3/c1-14-11-15(2)22-18(17(4)23(22,5)13-14)9-7-8-10-19-16(3)20(25-6)12-21(24)26-19/h7-13,17-18,22H,1-6H3/b9-7+,10-8+/t17-,18-,22+,23-/m0/s1
InChIKeyAFLXFQMVMOJBCC-PNWRMOOYSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies (ncbitaxon:5081) - PubMed (23405967)
ChEBI Ontology
Outgoing Relation(s)
Citreoviripyrone A (CHEBI:213982) is a pyranone (CHEBI:37963)
IUPAC Name 
4-methoxy-5-methyl-6-[(1E,3E)-4-[(1R,6S,7S,8S)-1,3,5,8-tetramethyl-7-bicyclo[4.2.0]octa-2,4-dienyl]buta-1,3-dienyl]pyran-2-one
Manual XrefsDatabases
78438053ChemSpider