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CHEBI:197547 - Pestapyrone B

ChEBI IDCHEBI:197547
ChEBI NamePestapyrone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H10O6
Net Charge0
Average Mass238.195
Monoisotopic Mass238.04774
SMILESO=c1oc(CO)cc2cc(O)c(CO)c(O)c12
InChIInChI=1S/C11H10O6/c12-3-6-1-5-2-8(14)7(4-13)10(15)9(5)11(16)17-6/h1-2,12-15H,3-4H2
InChIKeySQMRHUJCVRSXIU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Neopestalotiopsis clavispora (ncbitaxon:289240) - DOI (10.1016/j.tetlet.2016.03.101)
ChEBI Ontology
Outgoing Relation(s)
Pestapyrone B (CHEBI:197547) is a isocoumarins (CHEBI:38758)
IUPAC Name 
6,8-dihydroxy-3,7-bis(hydroxymethyl)isochromen-1-one
Manual XrefsDatabases
58196701ChemSpider