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CHEBI:211367 - Penicidone A

ChEBI IDCHEBI:211367
ChEBI NamePenicidone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H17NO5
Net Charge0
Average Mass327.336
Monoisotopic Mass327.11067
SMILESC/C=C/c1cc(=O)c([C@@H]2OC(=O)c3cc(OC)cc(OC)c32)cn1
InChIInChI=1S/C18H17NO5/c1-4-5-10-6-14(20)13(9-19-10)17-16-12(18(21)24-17)7-11(22-2)8-15(16)23-3/h4-9,17H,1-3H3,(H,19,20)/b5-4+/t17-/m0/s1
InChIKeyVHRYRCYSKWAFFV-BDUNBXCCSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies IFB-E022 (ncbitaxon:419823) - PubMed (17804027)
ChEBI Ontology
Outgoing Relation(s)
Penicidone A (CHEBI:211367) is a benzofurans (CHEBI:35259)
IUPAC Name 
5-[(1R)-5,7-dimethoxy-3-oxo-1H-2-benzouran-1-yl]-2-[(E)-prop-1-enyl]-1H-pyridin-4-one
Manual XrefsDatabases
28284877ChemSpider