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CHEBI:208024 - Phellilin A

ChEBI IDCHEBI:208024
ChEBI NamePhellilin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O3
Net Charge0
Average Mass248.322
Monoisotopic Mass248.14124
SMILESCC(=CC(=O)O)[C@@H]1CC2=C(C1)C(C)(C)CCC2=O
InChIInChI=1S/C15H20O3/c1-9(6-14(17)18)10-7-11-12(8-10)15(2,3)5-4-13(11)16/h6,10H,4-5,7-8H2,1-3H3,(H,17,18)/t10-/m1/s1
InChIKeyKWLZQMPOIJYXDR-SNVBAGLBSA-N
Species of MetaboliteComponentSourceComments
Tropicoporus linteus (ncbitaxon:1659895) - DOI (10.1016/j.tetlet.2013.04.027)
ChEBI Ontology
Outgoing Relation(s)
Phellilin A (CHEBI:208024) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
3-[(2S)-4,4-dimethyl-7-oxo-2,3,5,6-tetrahydro-1H-inden-2-yl]but-2-enoic acid