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CHEBI:218020 - Eupenicilazaphilone B

ChEBI IDCHEBI:218020
ChEBI NameEupenicilazaphilone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H27ClO6
Net Charge0
Average Mass386.872
Monoisotopic Mass386.14962
SMILESCC[C@H](C)[C@@H](O)[C@@](C)(O)/C=C/C1=CC2=C(Cl)C(=O)[C@](C)(O)[C@H](O)[C@H]2CO1
InChIInChI=1S/C19H27ClO6/c1-5-10(2)15(21)18(3,24)7-6-11-8-12-13(9-26-11)16(22)19(4,25)17(23)14(12)20/h6-8,10,13,15-16,21-22,24-25H,5,9H2,1-4H3/b7-6+/t10-,13-,15+,16+,18-,19+/m0/s1
InChIKeyCPMFRQHRPWPNMP-YXSIVKASSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies 6A-9 (ncbitaxon:1586111) - DOI (10.1016/j.tetlet.2018.06.057)
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)
Eupenicilazaphilone B (CHEBI:218020) is a azaphilone (CHEBI:50941)
IUPAC Name 
(7R,8R,8aR)-5-chloro-3-[(E,3S,4R,5S)-3,4-dihydroxy-3,5-dimethylhept-1-enyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one
Manual XrefsDatabases
71044340ChemSpider