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CHEBI:144745 - 3',4'-dihydroxyaurone

ChEBI IDCHEBI:144745
ChEBI Name3',4'-dihydroxyaurone
Stars
DefinitionA hydroxyaurone that is aurone which is substituted by hydroxy groups at the 3' and 4' positions; major species at pH 7.3. It shows inhibitory activity against several isoforms of the histone deacetylase complex (HDAC).
Last Modified5 September 2019
SubmitterAnne Morgat
DownloadsMolfile
FormulaC15H10O4
Net Charge0
Average Mass254.241
Monoisotopic Mass254.05791
SMILESO=C1/C(=C/c2ccc(O)c(O)c2)Oc2ccccc21
InChIInChI=1S/C15H10O4/c16-11-6-5-9(7-12(11)17)8-14-15(18)10-3-1-2-4-13(10)19-14/h1-8,16-17H/b14-8-
InChIKeyHCBULGQMULJTCM-ZSOIEALJSA-N
Roles Classification
Biological Role:
EC 3.5.1.98 (histone deacetylase) inhibitor  An EC 3.5.1.* (non-peptide linear amide C-N hydrolase) inhibitor that interferes with the function of histone deacetylase (EC 3.5.1.98).
ChEBI Ontology
Outgoing Relation(s)
3',4'-dihydroxyaurone (CHEBI:144745) has functional parent 2',3,4-trihydroxy-trans-chalcone (CHEBI:144742)
3',4'-dihydroxyaurone (CHEBI:144745) has role EC 3.5.1.98 (histone deacetylase) inhibitor (CHEBI:61115)
3',4'-dihydroxyaurone (CHEBI:144745) is a catechols (CHEBI:33566)
3',4'-dihydroxyaurone (CHEBI:144745) is a hydroxyaurone (CHEBI:85970)
IUPAC Name 
(2Z)-2-[(3,4-dihydroxyphenyl)methylidene]-1-benzofuran-3(2H)-one
UniProt Name  Source
3',4'-dihydroxyauroneUniProt
Citations