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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:27655 - davidigenin
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ChEBI Ontology
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ChEBI Name
davidigenin
ChEBI ID
CHEBI:27655
Definition
A member of the class of dihydrochalcones that is dihydrochalcone substituted by hydroxy groups at positions 4, 2', and 4' respectively.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:4332, CHEBI:23562
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Formula
C15H14O4
Net Charge
0
Average Mass
258.26930
Monoisotopic Mass
258.08921
InChI
InChI=1S/C15H14O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-2,4-7,9,16-17,19H,3,8H2
InChIKey
UDGKKUWYNITJRX-UHFFFAOYSA-N
SMILES
Oc1ccc(CCC(=O)c2ccc(O)cc2O)cc1
Roles Classification
Chemical Role
(s):
antioxidant
A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application
(s):
anti-allergic agent
A drug used to treat allergic reactions.
anti-asthmatic agent
Any compound that has anti-asthmatic effects.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
davidigenin (
CHEBI:27655
)
has functional parent
dihydrochalcone (
CHEBI:71231
)
davidigenin (
CHEBI:27655
)
has role
anti-allergic agent (
CHEBI:50857
)
davidigenin (
CHEBI:27655
)
has role
anti-asthmatic agent (
CHEBI:65023
)
davidigenin (
CHEBI:27655
)
has role
antioxidant (
CHEBI:22586
)
davidigenin (
CHEBI:27655
)
has role
metabolite (
CHEBI:25212
)
davidigenin (
CHEBI:27655
)
is a
dihydrochalcones (
CHEBI:71230
)
davidigenin (
CHEBI:27655
)
is a
polyphenol (
CHEBI:26195
)
IUPAC Name
1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)propan-1-one
Synonyms
Sources
4,2',4'-Trihydroxydihydrochalcone
KEGG COMPOUND
Davidigenin
KEGG COMPOUND
Manual Xrefs
Databases
C00007926
KNApSAcK
C09618
KEGG COMPOUND
CN101022818
Patent
LMPK12120452
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
1982275
Reaxys Registry Number
Reaxys
23130-26-9
CAS Registry Number
KEGG COMPOUND
Citations
Types
Sources
10705748
PubMed citation
Europe PMC
11105563
PubMed citation
Europe PMC
20580662
PubMed citation
Europe PMC
21798321
PubMed citation
Europe PMC
Last Modified
28 July 2014