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CHEBI:226237 - Aspergone

ChEBI IDCHEBI:226237
ChEBI NameAspergone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O5
Net Charge0
Average Mass278.304
Monoisotopic Mass278.11542
SMILESCCc1c(O)cc(CC(=O)OC)c2c1O[C@@H](C)CC2=O
InChIInChI=1S/C15H18O5/c1-4-10-11(16)6-9(7-13(18)19-3)14-12(17)5-8(2)20-15(10)14/h6,8,16H,4-5,7H2,1-3H3/t8-/m0/s1
InChIKeyLGGJRRSGBHBVGY-QMMMGPOBSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (28119517)
ChEBI Ontology
Outgoing Relation(s)
Aspergone (CHEBI:226237) is a chromones (CHEBI:23238)
IUPAC Name 
methyl 2-[(2S)-8-ethyl-7-hydroxy-2-methyl-4-oxo-2,3-dihydrochromen-5-yl]acetate
Manual XrefsDatabases
61708595ChemSpider