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CHEBI:226119 - Clearanol F

ChEBI IDCHEBI:226119
ChEBI NameClearanol F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H16O6
Net Charge0
Average Mass268.265
Monoisotopic Mass268.09469
SMILESCOc1cc(O)c2c(c1C)[C@@](C)(O)[C@H](CO)OC2=O
InChIInChI=1S/C13H16O6/c1-6-8(18-3)4-7(15)10-11(6)13(2,17)9(5-14)19-12(10)16/h4,9,14-15,17H,5H2,1-3H3/t9-,13-/m0/s1
InChIKeyCUCFSOKADUSMPF-ZANVPECISA-N
Species of MetaboliteComponentSourceComments
Paraphoma radicina (ncbitaxon:437017) - PubMed (24833033)
ChEBI Ontology
Outgoing Relation(s)
Clearanol F (CHEBI:226119) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(3S,4R)-4,8-dihydroxy-3-(hydroxymethyl)-6-methoxy-4,5-dimethyl-3H-isochromen-1-one
Manual XrefsDatabases
78443457ChemSpider