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CHEBI:209970 - Falconensin Q

ChEBI IDCHEBI:209970
ChEBI NameFalconensin Q
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H23BrO7
Net Charge0
Average Mass479.323
Monoisotopic Mass478.06272
SMILESCC=CC1=CC2=CC(=O)[C@](C)(OC(=O)c3c(OC)cc(O)c(Br)c3C)[C@@H](O)[C@@H]2CO1
InChIInChI=1S/C22H23BrO7/c1-5-6-13-7-12-8-17(25)22(3,20(26)14(12)10-29-13)30-21(27)18-11(2)19(23)15(24)9-16(18)28-4/h5-9,14,20,24,26H,10H2,1-4H3/t14-,20+,22+/m1/s1
InChIKeyNCSVIJIOZBZEKQ-XDCJIHQESA-N
Species of MetaboliteComponentSourceComments
Aspergillus falconensis (ncbitaxon:1810910) - PubMed (32290208)
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)
Falconensin Q (CHEBI:209970) is a azaphilone (CHEBI:50941)
IUPAC Name 
[(7R,8S,8aS)-8-hydroxy-7-methyl-6-oxo-3-prop-1-enyl-8,8a-dihydro-1H-isochromen-7-yl] 3-bromo-4-hydroxy-6-methoxy-2-methylbenzoate