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CHEBI:223984 - Pregaliellactone E

ChEBI IDCHEBI:223984
ChEBI NamePregaliellactone E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H16O4
Net Charge0
Average Mass212.245
Monoisotopic Mass212.10486
SMILESCCCC1=C[C@H](CCOC(C)=O)OC1=O
InChIInChI=1S/C11H16O4/c1-3-4-9-7-10(15-11(9)13)5-6-14-8(2)12/h7,10H,3-6H2,1-2H3/t10-/m0/s1
InChIKeyAXHUBCOBRUMJAI-JTQLQIEISA-N
ChEBI Ontology
Outgoing Relation(s)
Pregaliellactone E (CHEBI:223984) is a butenolide (CHEBI:50523)
IUPAC Name 
2-[(2S)-5-oxo-4-propyl-2H-uran-2-yl]ethyl acetate
Manual XrefsDatabases
78442325ChemSpider