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CHEBI:207183 - Penazaphilone D

ChEBI IDCHEBI:207183
ChEBI NamePenazaphilone D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H31ClN2O5
Net Charge0
Average Mass474.985
Monoisotopic Mass474.19215
SMILESCC[C@H](C)C=C(C)C=CC1=CC2=C(Cl)C(=O)[C@@](C)(OC(C)=O)C(=O)C2=CN1CCCC(N)=O
InChIInChI=1S/C25H31ClN2O5/c1-6-15(2)12-16(3)9-10-18-13-19-20(14-28(18)11-7-8-21(27)30)23(31)25(5,33-17(4)29)24(32)22(19)26/h9-10,12-15H,6-8,11H2,1-5H3,(H2,27,30)/t15-,25-/m0/s1
InChIKeySXXGKYHZSMYCJR-MQNRADLISA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (30702881)
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)
Penazaphilone D (CHEBI:207183) is a azaphilone (CHEBI:50941)
IUPAC Name 
[(7S)-2-(4-amino-4-oxobutyl)-5-chloro-3-[(5S)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxoisoquinolin-7-yl] acetate