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CHEBI:79571 - 7-hydroxy-3-(4-methoxyphenyl)-4-propyl-2H-1-benzopyran-2-one

ChEBI IDCHEBI:79571
ChEBI Name7-hydroxy-3-(4-methoxyphenyl)-4-propyl-2H-1-benzopyran-2-one
Stars
ASCII Name7-hydroxy-3-(4-methoxyphenyl)-4-propyl-2H-1-benzopyran-2-one
DefinitionA hydroxycoumarin that is coumarin substituted by a hydroxy group at position 7, a propyl group at position 4 and a 4-methoxyphenyl group at position 3.
Last Modified23 June 2015
DownloadsMolfile
FormulaC19H18O4
Net Charge0
Average Mass310.349
Monoisotopic Mass310.12051
SMILESCCCc1c(-c2ccc(OC)cc2)c(=O)oc2cc(O)ccc12
InChIInChI=1S/C19H18O4/c1-3-4-16-15-10-7-13(20)11-17(15)23-19(21)18(16)12-5-8-14(22-2)9-6-12/h5-11,20H,3-4H2,1-2H3
InChIKeyFEMYLSRAIUUCNB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7-hydroxy-3-(4-methoxyphenyl)-4-propyl-2H-1-benzopyran-2-one (CHEBI:79571) has functional parent coumarin (CHEBI:28794)
7-hydroxy-3-(4-methoxyphenyl)-4-propyl-2H-1-benzopyran-2-one (CHEBI:79571) is a hydroxycoumarin (CHEBI:37912)
7-hydroxy-3-(4-methoxyphenyl)-4-propyl-2H-1-benzopyran-2-one (CHEBI:79571) is a monomethoxybenzene (CHEBI:25235)
IUPAC Name 
7-hydroxy-3-(4-methoxyphenyl)-4-propyl-2H-1-benzopyran-2-one
Synonym  Source
7-Hydroxy-3-(4-methoxyphenyl)-4-propylcoumarinKEGG COMPOUND
Manual XrefsDatabases
C15051KEGG COMPOUND
Registry NumbersSources
Reaxys:293682Reaxys
CAS:5219-18-1KEGG COMPOUND