CHEBI:27618 - chalcone

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ChEBI Name chalcone
ChEBI ID CHEBI:27618
Definition A member of the class of chalcones that is acetophenone in which one of the methyl hydrogens has been replaced by a benzylidene group.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:3571, CHEBI:23085
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Formula C15H12O
Net Charge 0
Average Mass 208.25518
Monoisotopic Mass 208.08882
InChI InChI=1S/C15H12O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H
InChIKey DQFBYFPFKXHELB-UHFFFAOYSA-N
SMILES [H]C(=C([H])c1ccccc1)C(=O)c1ccccc1
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
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ChEBI Ontology
Outgoing chalcone (CHEBI:27618) has role plant metabolite (CHEBI:76924)
chalcone (CHEBI:27618) is a chalcones (CHEBI:23086)
chalcone (CHEBI:27618) is a styrenes (CHEBI:26799)
Incoming 2',3,4,4',6'-pentahydroxychalcone (CHEBI:10836) has functional parent chalcone (CHEBI:27618)
cis-chalcone (CHEBI:48966) is a chalcone (CHEBI:27618)
trans-chalcone (CHEBI:48965) is a chalcone (CHEBI:27618)
IUPAC Name
1,3-diphenylprop-2-en-1-one
Synonyms Sources
1,3-Diphenyl-2-propen-1-one KEGG COMPOUND
α-benzylideneacetophenone NIST Chemistry WebBook
Benzylideneacetophenone KEGG COMPOUND
β-benzoylstyrene NIST Chemistry WebBook
β-phenylacrylophenone NIST Chemistry WebBook
Chalcone KEGG COMPOUND
Chalkon ChEBI
styryl phenyl ketone NIST Chemistry WebBook
Manual Xrefs Databases
C01484 KEGG COMPOUND
Chalcone Wikipedia
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Registry Numbers Types Sources
29124 Gmelin Registry Number Gmelin
509985 Reaxys Registry Number Reaxys
509985 Beilstein Registry Number Beilstein
94-41-7 CAS Registry Number ChemIDplus
94-41-7 CAS Registry Number NIST Chemistry WebBook
Citation Waiting for Citations Type Source
24510324 PubMed citation Europe PMC
Last Modified
25 June 2014