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CHEBI:205833 - Canescenin A

ChEBI IDCHEBI:205833
ChEBI NameCanescenin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H26O8
Net Charge0
Average Mass430.453
Monoisotopic Mass430.16277
SMILESCOc1c([C@H](CC(C)(C)O)OC(C)=O)ccc2c1Oc1c(O)cc(C)cc1COC2=O
InChIInChI=1S/C23H26O8/c1-12-8-14-11-29-22(26)16-7-6-15(18(30-13(2)24)10-23(3,4)27)20(28-5)21(16)31-19(14)17(25)9-12/h6-9,18,25,27H,10-11H2,1-5H3/t18-/m0/s1
InChIKeyROOKOBLAFUOGRQ-SFHVURJKSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (30835537)
ChEBI Ontology
Outgoing Relation(s)
Canescenin A (CHEBI:205833) is a aromatic ether (CHEBI:35618)
IUPAC Name 
[3-hydroxy-1-(4-hydroxy-6-methoxy-2-methyl-10-oxo-12H-benzo[b][1,5]benzodioxocin-7-yl)-3-methylbutyl] acetate