CHEBI:85123 - 4'-O-methylbavachalcone

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ChEBI Name 4'-O-methylbavachalcone
ChEBI ID CHEBI:85123
ChEBI ASCII Name 4'-O-methylbavachalcone
Definition A member if the class of chalcones that is trans-chalcone substituted by a prenyl group at position 5', a hydroxy group at position 2' and methoxy groups at positions 4' and 4 respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C22H24O4
Net Charge 0
Average Mass 352.42360
Monoisotopic Mass 352.16746
InChI InChI=1S/C22H24O4/c1-15(2)5-9-17-13-19(21(24)14-22(17)26-4)20(23)12-8-16-6-10-18(25-3)11-7-16/h5-8,10-14,24H,9H2,1-4H3/b12-8+
InChIKey GCEGUTHXMYHGKF-XYOKQWHBSA-N
SMILES COc1ccc(\C=C\C(=O)c2cc(CC=C(C)C)c(OC)cc2O)cc1
Metabolite of Species Details
Centella asiatica (NCBI:txid48106) See: MetaboLights Study
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 4'-O-methylbavachalcone (CHEBI:85123) has role plant metabolite (CHEBI:76924)
4'-O-methylbavachalcone (CHEBI:85123) is a aromatic ether (CHEBI:35618)
4'-O-methylbavachalcone (CHEBI:85123) is a chalcones (CHEBI:23086)
4'-O-methylbavachalcone (CHEBI:85123) is a phenols (CHEBI:33853)
IUPAC Name
(2E)-1-[2-hydroxy-4-methoxy-5-(3-methylbut-2-en-1-yl)phenyl]-3-(4-methoxyphenyl)prop-2-en-1-one
Synonym Source
2'-hydroxy-5'-prenyl-4,4'-dimethoxychalcone ChEBI
Registry Number Type Source
21307944 Reaxys Registry Number Reaxys
Last Modified
06 March 2015