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CHEBI:204147 - Pestalasin E

ChEBI IDCHEBI:204147
ChEBI NamePestalasin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H10O5
Net Charge0
Average Mass222.196
Monoisotopic Mass222.05282
SMILESCOc1cc(O)cc2cc(CO)c(=O)oc12
InChIInChI=1S/C11H10O5/c1-15-9-4-8(13)3-6-2-7(5-12)11(14)16-10(6)9/h2-4,12-13H,5H2,1H3
InChIKeyYANRQLWBCFNFLL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsisspecies (ncbitaxon:36460) - PubMed (19762244)
ChEBI Ontology
Outgoing Relation(s)
Pestalasin E (CHEBI:204147) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name 
6-hydroxy-3-(hydroxymethyl)-8-methoxychromen-2-one
Manual XrefsDatabases
24645968ChemSpider