CHEBI:80369 - 7-hydroxy-2',4',5'-trimethoxyisoflavone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 7-hydroxy-2',4',5'-trimethoxyisoflavone
ChEBI ID CHEBI:80369
Definition A hydroxyisoflavone that is isoflavone substituted by a hydroxy group at position 7 and methoxy groups at the 2', 4' and 5' positions.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C18H16O6
Net Charge 0
Average Mass 328.31600
Monoisotopic Mass 328.09469
InChI InChI=1S/C18H16O6/c1-21-14-8-17(23-3)16(22-2)7-12(14)13-9-24-15-6-10(19)4-5-11(15)18(13)20/h4-9,19H,1-3H3
InChIKey IXZYJZHCXHSCDY-UHFFFAOYSA-N
SMILES COc1cc(OC)c(cc1OC)-c1coc2cc(O)ccc2c1=O
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 7-hydroxy-2',4',5'-trimethoxyisoflavone (CHEBI:80369) has functional parent isoflavone (CHEBI:18220)
7-hydroxy-2',4',5'-trimethoxyisoflavone (CHEBI:80369) has role plant metabolite (CHEBI:76924)
7-hydroxy-2',4',5'-trimethoxyisoflavone (CHEBI:80369) is a 4'-methoxyisoflavones (CHEBI:133959)
7-hydroxy-2',4',5'-trimethoxyisoflavone (CHEBI:80369) is a hydroxyisoflavone (CHEBI:38755)
IUPAC Name
7-hydroxy-3-(2,4,5-trimethoxyphenyl)-4H-1-benzopyran-4-one
Manual Xrefs Databases
C00009413 KNApSAcK
C16188 KEGG COMPOUND
View more database links
Last Modified
17 November 2016