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CHEBI:203176 - Spiciferone C

ChEBI IDCHEBI:203176
ChEBI NameSpiciferone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H16O4
Net Charge0
Average Mass248.278
Monoisotopic Mass248.10486
SMILESCC[C@@]1(C)C(=O)C=Cc2c1oc(C)c(CO)c2=O
InChIInChI=1S/C14H16O4/c1-4-14(3)11(16)6-5-9-12(17)10(7-15)8(2)18-13(9)14/h5-6,15H,4,7H2,1-3H3/t14-/m0/s1
InChIKeyJUWRYWAZYBSNCI-AWEZNQCLSA-N
Species of MetaboliteComponentSourceComments
Curvulariaspeciescifera (ncbitaxon:145392) - DOI (10.1016/0031-9422(91)85101-5)
ChEBI Ontology
Outgoing Relation(s)
Spiciferone C (CHEBI:203176) is a pyranone (CHEBI:37963)
IUPAC Name 
8-ethyl-3-(hydroxymethyl)-2,8-dimethylchromene-4,7-dione
Manual XrefsDatabases
68023730ChemSpider