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CHEBI:79572 - 7-hydroxy-3-(4-methoxyphenyl)-4-methylcoumarin

ChEBI IDCHEBI:79572
ChEBI Name7-hydroxy-3-(4-methoxyphenyl)-4-methylcoumarin
Stars
DefinitionA hydroxycoumarin that is coumarin substituted by a methyl group at position 4, a hydroxy group at position 7 and a p-methoxyphenyl group at position 3 respectively.
Last Modified17 February 2017
DownloadsMolfile
FormulaC17H14O4
Net Charge0
Average Mass282.295
Monoisotopic Mass282.08921
SMILESCOc1ccc(-c2c(C)c3ccc(O)cc3oc2=O)cc1
InChIInChI=1S/C17H14O4/c1-10-14-8-5-12(18)9-15(14)21-17(19)16(10)11-3-6-13(20-2)7-4-11/h3-9,18H,1-2H3
InChIKeyMJQHCKOMFMGCQG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7-hydroxy-3-(4-methoxyphenyl)-4-methylcoumarin (CHEBI:79572) has functional parent coumarin (CHEBI:28794)
7-hydroxy-3-(4-methoxyphenyl)-4-methylcoumarin (CHEBI:79572) is a hydroxycoumarin (CHEBI:37912)
7-hydroxy-3-(4-methoxyphenyl)-4-methylcoumarin (CHEBI:79572) is a monomethoxybenzene (CHEBI:25235)
IUPAC Name 
7-hydroxy-3-(4-methoxyphenyl)-4-methyl-2H-1-benzopyran-2-one
Manual XrefsDatabases
C15052KEGG COMPOUND
Registry NumbersSources
Reaxys:253332Reaxys