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CHEBI:71045 - bisdemethoxycurcumin

ChEBI IDCHEBI:71045
ChEBI Namebisdemethoxycurcumin
Stars
DefinitionA β-diketone that is methane in which two of the hydrogens are substituted by 4-hydroxycinnamoyl groups.
Last Modified3 August 2014
SubmitterKAX
DownloadsMolfile
FormulaC19H16O4
Net Charge0
Average Mass308.333
Monoisotopic Mass308.10486
SMILESO=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1ccc(O)cc1
InChIInChI=1S/C19H16O4/c20-16-7-1-14(2-8-16)5-11-18(22)13-19(23)12-6-15-3-9-17(21)10-4-15/h1-12,20-21H,13H2/b11-5+,12-6+
InChIKeyPREBVFJICNPEKM-YDWXAUTNSA-N
Roles Classification
Biological Roles:
EC 3.2.1.1 (alpha-amylase) inhibitor  An EC 3.2.1.* (glycosidase) inhibitor that interferes with the action of α-amylase (EC 3.2.1.1).
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
bisdemethoxycurcumin (CHEBI:71045) has functional parent 4-coumaric acid (CHEBI:36090)
bisdemethoxycurcumin (CHEBI:71045) has role EC 3.2.1.1 (α-amylase) inhibitor (CHEBI:50627)
bisdemethoxycurcumin (CHEBI:71045) has role metabolite (CHEBI:25212)
bisdemethoxycurcumin (CHEBI:71045) is a diarylheptanoid (CHEBI:78802)
bisdemethoxycurcumin (CHEBI:71045) is a enone (CHEBI:51689)
bisdemethoxycurcumin (CHEBI:71045) is a polyphenol (CHEBI:26195)
bisdemethoxycurcumin (CHEBI:71045) is a β-diketone (CHEBI:67265)
IUPAC Name 
(1E,6E)-1,7-bis(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione
Synonyms  Source
Curcumin IIIChemIDplus
Bis(p-hydroxycinnamoyl)methaneChemIDplus
DidemethoxycurcuminChemIDplus
Bis(4-hydroxycinnamoyl)methaneChemIDplus
1,7-Bis(4-hydroxyphenyl)-1,6-Heptadiene-3,5-dioneHMDB
UniProt Name  Source
bisdemethoxycurcuminUniProt
Manual XrefsDatabases
C17743KEGG COMPOUND
US2010048957Patent
US2006258752Patent
WO2007011674Patent
CPD-12188MetaCyc
Registry NumbersSources
Reaxys:3149384Reaxys
CAS:24939-16-0KEGG COMPOUND
CAS:33171-05-0ChemIDplus
CAS:24939-16-0ChemIDplus
Citations