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CHEBI:211859 - Chenopodolan E

ChEBI IDCHEBI:211859
ChEBI NameChenopodolan E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O5
Net Charge0
Average Mass278.304
Monoisotopic Mass278.11542
SMILESCOC(=O)/C=C(\C)C1=C2C(OC)=C(C)O[C@H]2OC(C)=C1
InChIInChI=1S/C15H18O5/c1-8(6-12(16)17-4)11-7-9(2)19-15-13(11)14(18-5)10(3)20-15/h6-7,15H,1-5H3/b8-6+/t15-/m1/s1
InChIKeyZFLGIXPPHIPBBJ-PMGBHYCQSA-N
Species of MetaboliteComponentSourceComments
Didymella chenopodii (ncbitaxon:749820) - DOI (10.1016/j.tet.2016.11.024)
ChEBI Ontology
Outgoing Relation(s)
Chenopodolan E (CHEBI:211859) is a furopyran (CHEBI:74927)
IUPAC Name 
methyl (E)-3-[(7aR)-3-methoxy-2,6-dimethyl-7aH-uro[2,3-b]pyran-4-yl]but-2-enoate
Manual XrefsDatabases
78438533ChemSpider