CHEBI:65499 - bipinnatone B

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ChEBI Name bipinnatone B
ChEBI ID CHEBI:65499
Definition A member of the class of dihydrochalones that is dihydrochalcone hydroxylated at C-2', C-4', C-6' and C-4 and substituted by a geranyl group at C-3. It is isolated from the aerial parts of Boronia bipinnata and exhibits antimalarial activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C25H30O5
Net Charge 0
Average Mass 410.50270
Monoisotopic Mass 410.20932
InChI InChI=1S/C25H30O5/c1-16(2)5-4-6-17(3)7-10-19-13-18(8-11-21(19)27)9-12-22(28)25-23(29)14-20(26)15-24(25)30/h5,7-8,11,13-15,26-27,29-30H,4,6,9-10,12H2,1-3H3/b17-7+
InChIKey NJIYMLLTXNGJHV-REZTVBANSA-N
SMILES CC(C)=CCC\C(C)=C\Cc1cc(CCC(=O)c2c(O)cc(O)cc2O)ccc1O
Metabolite of Species Details
Boronia bipinnata (IPNI:771577-1) Found in aerial part (BTO:0001658). See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
antimalarial
A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
Application(s): antimalarial
A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing bipinnatone B (CHEBI:65499) has role antimalarial (CHEBI:38068)
bipinnatone B (CHEBI:65499) has role metabolite (CHEBI:25212)
bipinnatone B (CHEBI:65499) is a dihydrochalcones (CHEBI:71230)
bipinnatone B (CHEBI:65499) is a polyphenol (CHEBI:26195)
IUPAC Name
3-{3-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-4-hydroxyphenyl}-1-(2,4,6-trihydroxyphenyl)propan-1-one
Registry Number Type Source
18863622 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
18662038 PubMed citation Europe PMC
Last Modified
26 November 2012