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CHEBI:70080 - 4-hydroxycordoin

ChEBI IDCHEBI:70080
ChEBI Name4-hydroxycordoin
Stars
DefinitionA member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at position 4 and 2' and a (3-methylbut-2-en-1-yl)oxy group at position 4'. It has been isolated from Lonchocarpus neuroscapha.
Last Modified2 June 2015
DownloadsMolfile
FormulaC20H20O4
Net Charge0
Average Mass324.376
Monoisotopic Mass324.13616
SMILESCC(C)=CCOc1ccc(C(=O)/C=C/c2ccc(O)cc2)c(O)c1
InChIInChI=1S/C20H20O4/c1-14(2)11-12-24-17-8-9-18(20(23)13-17)19(22)10-5-15-3-6-16(21)7-4-15/h3-11,13,21,23H,12H2,1-2H3/b10-5+
InChIKeySFXYAAFUXNWNQF-BJMVGYQFSA-N
Species of MetaboliteComponentSourceComments
Lonchocarpus neuroscapha (IPNI:503039-1) - PubMed (21158427)
Roles Classification
Biological Roles:
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application:
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
ChEBI Ontology
Outgoing Relation(s)
4-hydroxycordoin (CHEBI:70080) has parent hydride trans-chalcone (CHEBI:48965)
4-hydroxycordoin (CHEBI:70080) has role anti-inflammatory agent (CHEBI:67079)
4-hydroxycordoin (CHEBI:70080) has role antibacterial agent (CHEBI:33282)
4-hydroxycordoin (CHEBI:70080) has role plant metabolite (CHEBI:76924)
4-hydroxycordoin (CHEBI:70080) is a aromatic ether (CHEBI:35618)
4-hydroxycordoin (CHEBI:70080) is a chalcones (CHEBI:23086)
4-hydroxycordoin (CHEBI:70080) is a polyphenol (CHEBI:26195)
IUPAC Name 
(2E)-1-{2-hydroxy-4-[(3-methylbut-2-en-1-yl)oxy]phenyl}-3-(4-hydroxyphenyl)prop-2-en-1-one
Registry NumbersSources
Reaxys:2665335Reaxys
CAS:55524-25-9ChemIDplus
Citations