CHEBI:66558 - 8-lavandulylkaempferol

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ChEBI Name 8-lavandulylkaempferol
ChEBI ID CHEBI:66558
Definition A tetrahydroxyflavone that is kaempferol substituted by a lavandulyl group at position 8. Isolated from Sophora flavescens, it exhibits antioxidant activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB0259026, eMolecules:35875953, eMolecules:12800964, ZINC000031155604
Download Molfile XML SDF
Formula C25H26O6
Net Charge 0
Average Mass 422.47030
Monoisotopic Mass 422.17294
InChI InChI=1S/C25H26O6/c1-13(2)5-6-16(14(3)4)11-18-19(27)12-20(28)21-22(29)23(30)24(31-25(18)21)15-7-9-17(26)10-8-15/h5,7-10,12,16,26-28,30H,3,6,11H2,1-2,4H3
InChIKey RLJJIYPLHFCLRD-UHFFFAOYSA-N
SMILES CC(C)=CCC(Cc1c(O)cc(O)c2c1oc(-c1ccc(O)cc1)c(O)c2=O)C(C)=C
Metabolite of Species Details
Sophora flavescens (NCBI:txid49840) Found in root (BTO:0001188). See: PubMed
Roles Classification
Chemical Role(s): radical scavenger
A role played by a substance that can react readily with, and thereby eliminate, radicals.
Biological Role(s): EC 1.1.1.21 (aldehyde reductase) inhibitor
An EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD+ or NADP+ acceptor) inhibitor that interferes with the action of aldehyde reductase (EC 1.1.1.21).
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 8-lavandulylkaempferol (CHEBI:66558) has functional parent kaempferol (CHEBI:28499)
8-lavandulylkaempferol (CHEBI:66558) has role EC 1.1.1.21 (aldehyde reductase) inhibitor (CHEBI:48550)
8-lavandulylkaempferol (CHEBI:66558) has role metabolite (CHEBI:25212)
8-lavandulylkaempferol (CHEBI:66558) has role radical scavenger (CHEBI:48578)
8-lavandulylkaempferol (CHEBI:66558) is a flavonols (CHEBI:28802)
8-lavandulylkaempferol (CHEBI:66558) is a tetrahydroxyflavone (CHEBI:38684)
IUPAC Name
3,5,7-trihydroxy-2-(4-hydroxyphenyl)-8-[5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]-4H-chromen-4-one
Registry Number Type Source
15869811 Reaxys Registry Number Reaxys
Citations Types Sources
16392664 PubMed citation Europe PMC
20387235 PubMed citation Europe PMC
Last Modified
25 November 2013