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CHEBI:208539 - Penicilazaphilone D

ChEBI IDCHEBI:208539
ChEBI NamePenicilazaphilone D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H15ClO5
Net Charge0
Average Mass298.722
Monoisotopic Mass298.06080
SMILESCC(=O)/C=C/C1=CC2=C(Cl)C(=O)[C@](C)(O)[C@H](O)[C@@H]2CO1
InChIInChI=1S/C14H15ClO5/c1-7(16)3-4-8-5-9-10(6-20-8)12(17)14(2,19)13(18)11(9)15/h3-5,10,12,17,19H,6H2,1-2H3/b4-3+/t10-,12-,14-/m1/s1
InChIKeyUJVLDBPBZYHNOB-ZMAPLJKYSA-N
Species of MetaboliteComponentSourceComments
Penicillium sclerotiorum (ncbitaxon:69788) - DOI (10.1039/c7ra13327h)
Roles Classification
Biological Role:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
Penicilazaphilone D (CHEBI:208539) is a azaphilone (CHEBI:50941)
IUPAC Name 
(7R,8R,8aS)-5-chloro-7,8-dihydroxy-7-methyl-3-[(E)-3-oxobut-1-enyl]-8,8a-dihydro-1H-isochromen-6-one
Manual XrefsDatabases
64808957ChemSpider