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CHEBI:79493 - 2,3-dihydro-6-hydroxy-2-(4-hydroxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one

ChEBI IDCHEBI:79493
ChEBI Name2,3-dihydro-6-hydroxy-2-(4-hydroxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one
Stars
ASCII Name2,3-dihydro-6-hydroxy-2-(4-hydroxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one
DefinitionA dimethoxyflavanone that is flavanone substituted by methoxy groups at positions 5 and 7 and hydroxy groups at positions 6 and 4'.
Last Modified5 April 2018
DownloadsMolfile
FormulaC17H16O6
Net Charge0
Average Mass316.309
Monoisotopic Mass316.09469
SMILESCOc1cc2c(c(OC)c1O)C(=O)CC(c1ccc(O)cc1)O2
InChIInChI=1S/C17H16O6/c1-21-14-8-13-15(17(22-2)16(14)20)11(19)7-12(23-13)9-3-5-10(18)6-4-9/h3-6,8,12,18,20H,7H2,1-2H3
InChIKeyMWHNXEIHKZWYAX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2,3-dihydro-6-hydroxy-2-(4-hydroxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one (CHEBI:79493) has functional parent flavanone (CHEBI:5070)
2,3-dihydro-6-hydroxy-2-(4-hydroxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one (CHEBI:79493) is a 4'-hydroxyflavanones (CHEBI:140331)
2,3-dihydro-6-hydroxy-2-(4-hydroxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one (CHEBI:79493) is a dihydroxyflavanone (CHEBI:38749)
2,3-dihydro-6-hydroxy-2-(4-hydroxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one (CHEBI:79493) is a dimethoxyflavanone (CHEBI:38743)
IUPAC Name 
6-hydroxy-2-(4-hydroxyphenyl)-5,7-dimethoxy-2,3-dihydro-4H-chromen-4-one
Synonym  Source
4',6-Dihydroxy-5,7-dimethoxyflavanoneKEGG COMPOUND
Manual XrefsDatabases
C14969KEGG COMPOUND
Registry NumbersSources
Reaxys:319006Reaxys
CAS:6951-57-1ChemIDplus