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CHEBI:34403 - 4-ethyl-7-hydroxy-3-(p-methoxyphenyl)coumarin

ChEBI IDCHEBI:34403
ChEBI Name4-ethyl-7-hydroxy-3-(p-methoxyphenyl)coumarin
Stars
ASCII Name4-ethyl-7-hydroxy-3-(p-methoxyphenyl)coumarin
DefinitionA hydroxycoumarin that is coumarin substituted by an ethyl group at position 4, a hydroxy group at position 7 and a p-methoxyphenyl group at position 3 respectively.
Last Modified23 June 2015
DownloadsMolfile
FormulaC18H16O4
Net Charge0
Average Mass296.322
Monoisotopic Mass296.10486
SMILESCCc1c(-c2ccc(OC)cc2)c(=O)oc2cc(O)ccc12
InChIInChI=1S/C18H16O4/c1-3-14-15-9-6-12(19)10-16(15)22-18(20)17(14)11-4-7-13(21-2)8-5-11/h4-10,19H,3H2,1-2H3
InChIKeyOFVOGSOIXOYRRC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-ethyl-7-hydroxy-3-(p-methoxyphenyl)coumarin (CHEBI:34403) has functional parent coumarin (CHEBI:28794)
4-ethyl-7-hydroxy-3-(p-methoxyphenyl)coumarin (CHEBI:34403) is a hydroxycoumarin (CHEBI:37912)
4-ethyl-7-hydroxy-3-(p-methoxyphenyl)coumarin (CHEBI:34403) is a monomethoxybenzene (CHEBI:25235)
IUPAC Name 
4-ethyl-7-hydroxy-3-(4-methoxyphenyl)-2H-1-benzopyran-2-one
Manual XrefsDatabases
C14720KEGG COMPOUND
Registry NumbersSources
Reaxys:272991Reaxys
CAS:5219-17-0KEGG COMPOUND