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CHEBI:215870 - Chenopodolan D

ChEBI IDCHEBI:215870
ChEBI NameChenopodolan D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O4
Net Charge0
Average Mass250.294
Monoisotopic Mass250.12051
SMILESCOC1=C(C)O[C@H]2OC(C)=CC(C(C)=CCO)=C12
InChIInChI=1S/C14H18O4/c1-8(5-6-15)11-7-9(2)17-14-12(11)13(16-4)10(3)18-14/h5,7,14-15H,6H2,1-4H3/t14-/m1/s1
InChIKeyQPENODDIMKOTQK-CQSZACIVSA-N
Species of MetaboliteComponentSourceComments
Didymella chenopodii (ncbitaxon:749820) - PubMed (26226110)
ChEBI Ontology
Outgoing Relation(s)
Chenopodolan D (CHEBI:215870) is a furopyran (CHEBI:74927)
IUPAC Name 
3-(3-methoxy-2,6-dimethyl-7aH-uro[2,3-b]pyran-4-yl)but-2-en-1-ol
Manual XrefsDatabases
78436046ChemSpider