CHEBI:48967 - trans-2',3,4,4',6'-pentahydroxychalcone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name trans-2',3,4,4',6'-pentahydroxychalcone
ChEBI ID CHEBI:48967
ChEBI ASCII Name trans-2',3,4,4',6'-pentahydroxychalcone
Definition A 2',3,4,4',6'-pentahydroxychalcone with a trans configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H12O6
Net Charge 0
Average Mass 288.25220
Monoisotopic Mass 288.06339
InChI InChI=1S/C15H12O6/c16-9-6-13(20)15(14(21)7-9)11(18)4-2-8-1-3-10(17)12(19)5-8/h1-7,16-17,19-21H/b4-2+
InChIKey CRBYNQCDRNZCNX-DUXPYHPUSA-N
SMILES Oc1cc(O)c(C(=O)\C=C\c2ccc(O)c(O)c2)c(O)c1
ChEBI Ontology
Outgoing trans-2',3,4,4',6'-pentahydroxychalcone (CHEBI:48967) has functional parent trans-chalcone (CHEBI:48965)
trans-2',3,4,4',6'-pentahydroxychalcone (CHEBI:48967) is a 2',3,4,4',6'-pentahydroxychalcone (CHEBI:10836)
trans-2',3,4,4',6'-pentahydroxychalcone (CHEBI:48967) is a polyphenol (CHEBI:26195)
IUPAC Name
(2E)-3-(3,4-dihydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one
Synonym Source
2',3,4,4',6'-Pentahydroxychalcone KEGG COMPOUND
Manual Xrefs Databases
C00006973 KNApSAcK
C15525 KEGG COMPOUND
LMPK12120271 LIPID MAPS
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Registry Numbers Types Sources
2153776 Reaxys Registry Number Reaxys
2153776 Beilstein Registry Number Beilstein
3402248 Beilstein Registry Number Beilstein
Last Modified
28 July 2014