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CHEBI:211163 - Scirpyrone C

ChEBI IDCHEBI:211163
ChEBI NameScirpyrone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H16O6
Net Charge0
Average Mass244.243
Monoisotopic Mass244.09469
SMILESCOC1=CC(=O)O[C@H]([C@@H](O)CCOC(C)=O)C1
InChIInChI=1S/C11H16O6/c1-7(12)16-4-3-9(13)10-5-8(15-2)6-11(14)17-10/h6,9-10,13H,3-5H2,1-2H3/t9-,10-/m0/s1
InChIKeyLQQPRBZJTPLMFL-UWVGGRQHSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis scirpina (ncbitaxon:1158741) - DOI (10.1002/ejoc.201200007)
ChEBI Ontology
Outgoing Relation(s)
Scirpyrone C (CHEBI:211163) is a pyranone (CHEBI:37963)
IUPAC Name 
[(3S)-3-hydroxy-3-[(2S)-4-methoxy-6-oxo-2,3-dihydropyran-2-yl]propyl] acetate
Manual XrefsDatabases
78438511ChemSpider