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CHEBI:208824 - Chenopodolan A

ChEBI IDCHEBI:208824
ChEBI NameChenopodolan A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H20O5
Net Charge0
Average Mass268.309
Monoisotopic Mass268.13107
SMILESCOC1=C(C)OC2OC(C)=CC(C(C)(O)[C@@H](C)O)=C12
InChIInChI=1S/C14H20O5/c1-7-6-10(14(4,16)9(3)15)11-12(17-5)8(2)19-13(11)18-7/h6,9,13,15-16H,1-5H3/t9-,13?,14?/m1/s1
InChIKeyNOLPEUNAHMQEOP-BZFQTPOWSA-N
Species of MetaboliteComponentSourceComments
Didymella chenopodii (ncbitaxon:749820) - PubMed (24211132)
ChEBI Ontology
Outgoing Relation(s)
Chenopodolan A (CHEBI:208824) is a furopyran (CHEBI:74927)
IUPAC Name 
(3R)-2-(3-methoxy-2,6-dimethyl-7aH-uro[2,3-b]pyran-4-yl)butane-2,3-diol
Manual XrefsDatabases
78443393ChemSpider