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CHEBI:212806 - 3-epi-waol A

ChEBI IDCHEBI:212806
ChEBI Name3-epi-waol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H16O4
Net Charge0
Average Mass236.267
Monoisotopic Mass236.10486
SMILESC/C=C/[C@@H]1OC(=O)C2=C[C@H](O)[C@@H](/C=C/C)O[C@H]21
InChIInChI=1S/C13H16O4/c1-3-5-10-9(14)7-8-12(16-10)11(6-4-2)17-13(8)15/h3-7,9-12,14H,1-2H3/b5-3+,6-4+/t9-,10+,11-,12+/m0/s1
InChIKeyQXZDESIVIREXNJ-XYALPFSWSA-N
Species of MetaboliteComponentSourceComments
Libertella (ncbitaxon:280323) - DOI (10.1016/j.tetlet.2014.11.081)
ChEBI Ontology
Outgoing Relation(s)
3-epi-waol A (CHEBI:212806) is a furopyran (CHEBI:74927)
IUPAC Name 
(2R,3S,7S,7aR)-3-hydroxy-2,7-bis[(E)-prop-1-enyl]-2,3,7,7a-tetrahydrouro[3,4-b]pyran-5-one
Manual XrefsDatabases
78441930ChemSpider