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CHEBI:208112 - Fusaraisochromanone

ChEBI IDCHEBI:208112
ChEBI NameFusaraisochromanone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H16O5
Net Charge0
Average Mass252.266
Monoisotopic Mass252.09977
SMILESCOc1cc(O)c2c(c1C)[C@@](C)(O)[C@H](C)OC2=O
InChIInChI=1S/C13H16O5/c1-6-9(17-4)5-8(14)10-11(6)13(3,16)7(2)18-12(10)15/h5,7,14,16H,1-4H3/t7-,13-/m0/s1
InChIKeyQIWHCAJJZMZSLM-CPFSXVBKSA-N
Species of MetaboliteComponentSourceComments
Fusarium (ncbitaxon:5506) - DOI (10.1016/j.tetlet.2015.07.048)
ChEBI Ontology
Outgoing Relation(s)
Fusaraisochromanone (CHEBI:208112) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(3S,4R)-4,8-dihydroxy-6-methoxy-3,4,5-trimethyl-3H-isochromen-1-one
Manual XrefsDatabases
78438439ChemSpider