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CHEBI:2908 - athyriol

ChEBI IDCHEBI:2908
ChEBI Nameathyriol
Stars
DefinitionA member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 6 and 7 and a methoxy group at position 3.
Last Modified3 October 2014
DownloadsMolfile
FormulaC14H10O6
Net Charge0
Average Mass274.228
Monoisotopic Mass274.04774
SMILESCOc1cc(O)c2c(=O)c3cc(O)c(O)cc3oc2c1
InChIInChI=1S/C14H10O6/c1-19-6-2-10(17)13-12(3-6)20-11-5-9(16)8(15)4-7(11)14(13)18/h2-5,15-17H,1H3
InChIKeyIFNAQIAMTNJLIF-UHFFFAOYSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
athyriol (CHEBI:2908) has role plant metabolite (CHEBI:76924)
athyriol (CHEBI:2908) is a aromatic ether (CHEBI:35618)
athyriol (CHEBI:2908) is a polyphenol (CHEBI:26195)
athyriol (CHEBI:2908) is a xanthones (CHEBI:51149)
IUPAC Name 
1,6,7-trihydroxy-3-methoxy-9H-xanthen-9-one
Synonym  Source
3-Methoxy-1,6,7-trihydroxyxanthoneKEGG COMPOUND
Manual XrefsDatabases
C10052KEGG COMPOUND
C00002942KNApSAcK
Registry NumbersSources
Reaxys:1351022Reaxys
CAS:28283-84-3KEGG COMPOUND