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CHEBI:205429 - Chenopodolan B

ChEBI IDCHEBI:205429
ChEBI NameChenopodolan B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O4
Net Charge0
Average Mass224.256
Monoisotopic Mass224.10486
SMILESCOC1=C(C)OC2OC(C)=CC(C(C)O)=C12
InChIInChI=1S/C12H16O4/c1-6-5-9(7(2)13)10-11(14-4)8(3)16-12(10)15-6/h5,7,12-13H,1-4H3
InChIKeyCZCLDUKCZJEPOA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Didymella chenopodii (ncbitaxon:749820) - PubMed (24211132)
ChEBI Ontology
Outgoing Relation(s)
Chenopodolan B (CHEBI:205429) is a furopyran (CHEBI:74927)
IUPAC Name 
1-(3-methoxy-2,6-dimethyl-7aH-uro[2,3-b]pyran-4-yl)ethanol
Manual XrefsDatabases
78436042ChemSpider