CHEBI:47414 - (Z)-3',5'-dibromo-2',4,4',6'-tetrahydroxyaurone

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ChEBI Name (Z)-3',5'-dibromo-2',4,4',6'-tetrahydroxyaurone
ChEBI ID CHEBI:47414
ChEBI ASCII Name (Z)-3',5'-dibromo-2',4,4',6'-tetrahydroxyaurone
Definition A hydroxyaurone that is aurone substituted by hydroxy groups at positions 2', 4, 4' and 6' and bromo groups at positions 3' and 5' respectively.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C15H8Br2O6
Net Charge 0
Average Mass 444.02800
Monoisotopic Mass 441.86876
InChI InChI=1S/C15H8Br2O6/c16-7-1-5(13(20)12(17)14(7)21)2-10-15(22)11-8(19)3-6(18)4-9(11)23-10/h1-4,18-21H/b10-2-
InChIKey BRPKBUNFOZFULQ-SGAXSIHGSA-N
SMILES Oc1cc2O\C(=C/c3cc(Br)c(O)c(Br)c3O)C(=O)c2c(O)c1
ChEBI Ontology
Outgoing (Z)-3',5'-dibromo-2',4,4',6'-tetrahydroxyaurone (CHEBI:47414) has functional parent aurone (CHEBI:47964)
(Z)-3',5'-dibromo-2',4,4',6'-tetrahydroxyaurone (CHEBI:47414) is a dibromobenzene (CHEBI:37147)
(Z)-3',5'-dibromo-2',4,4',6'-tetrahydroxyaurone (CHEBI:47414) is a hydroxyaurone (CHEBI:85970)
IUPAC Name
(2Z)-2-[(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]-4,6-dihydroxy-1-benzofuran-3(2H)-one
Manual Xref Database
FL9 PDBeChem
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Last Modified
09 June 2015