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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-ethyl-7-hydroxy-3-(p-methoxyphenyl)coumarin
ChEBI ID CHEBI:34403
ChEBI ASCII Name 4-ethyl-7-hydroxy-3-(p-methoxyphenyl)coumarin
Definition A 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.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C18H16O4
Net Charge 0
Average Mass 296.31720
Monoisotopic Mass 296.10486
InChI InChI=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
InChIKey OFVOGSOIXOYRRC-UHFFFAOYSA-N
SMILES CCc1c(-c2ccc(OC)cc2)c(=O)oc2cc(O)ccc12
ChEBI Ontology
Outgoing 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 Xref Database
C14720 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
272991 Reaxys Registry Number Reaxys
5219-17-0 CAS Registry Number KEGG COMPOUND
Last Modified
23 June 2015