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CHEBI:209355 - Peyronellone E

ChEBI IDCHEBI:209355
ChEBI NamePeyronellone E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O5
Net Charge0
Average Mass278.304
Monoisotopic Mass278.11542
SMILESCc1c(O)cc2c(C)c([C@H](C)[C@@H](C)O)oc(=O)c2c1O
InChIInChI=1S/C15H18O5/c1-6(9(4)16)14-7(2)10-5-11(17)8(3)13(18)12(10)15(19)20-14/h5-6,9,16-18H,1-4H3/t6-,9-/m1/s1
InChIKeyZOQIEVVEKPXOGV-HZGVNTEJSA-N
Species of MetaboliteComponentSourceComments
Didymella glomerata (ncbitaxon:749621) - PubMed (29738260)
ChEBI Ontology
Outgoing Relation(s)
Peyronellone E (CHEBI:209355) is a isocoumarins (CHEBI:38758)
IUPAC Name 
6,8-dihydroxy-3-[(2R,3R)-3-hydroxybutan-2-yl]-4,7-dimethylisochromen-1-one
Manual XrefsDatabases
78441684ChemSpider