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CHEBI:213627 - Penicimarin E

ChEBI IDCHEBI:213627
ChEBI NamePenicimarin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H12O6
Net Charge0
Average Mass264.233
Monoisotopic Mass264.06339
SMILESCC(=O)OCc1c(C)oc(=O)c2c(O)cc(O)cc12
InChIInChI=1S/C13H12O6/c1-6-10(5-18-7(2)14)9-3-8(15)4-11(16)12(9)13(17)19-6/h3-4,15-16H,5H2,1-2H3
InChIKeyFTNRNAIIBOEQPZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (23477451)
ChEBI Ontology
Outgoing Relation(s)
Penicimarin E (CHEBI:213627) is a isocoumarins (CHEBI:38758)
IUPAC Name 
(6,8-dihydroxy-3-methyl-1-oxoisochromen-4-yl)methyl acetate
Manual XrefsDatabases
30770826ChemSpider