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CHEBI:198091 - Phellinone

ChEBI IDCHEBI:198091
ChEBI NamePhellinone
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SubmitterMetaboLights
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FormulaC15H20O3
Net Charge0
Average Mass248.322
Monoisotopic Mass248.14124
SMILESC[C@@H]1C(=O)CCC(C)(C)[C@H]1/C=C/C1=CC(=O)OC1
InChIInChI=1S/C15H20O3/c1-10-12(15(2,3)7-6-13(10)16)5-4-11-8-14(17)18-9-11/h4-5,8,10,12H,6-7,9H2,1-3H3/b5-4+/t10-,12-/m0/s1
InChIKeyRYWMKAMLWXSVJC-XVHVLHHCSA-N
Species of MetaboliteComponentSourceComments
Phellinus (ncbitaxon:40470) - DOI (10.1007/bf02993957)
ChEBI Ontology
Outgoing Relation(s)
Phellinone (CHEBI:198091) is a butenolide (CHEBI:50523)
IUPAC Name 
3-[(E)-2-[(1S,6S)-2,2,6-trimethyl-5-oxocyclohexyl]ethenyl]-2H-uran-5-one
Manual XrefsDatabases
78439576ChemSpider