6-methoxysakuranetin

Ligand id: 9111

Name: 6-methoxysakuranetin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 85.22
Molecular weight 316.09
XLogP 0.97
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
IUPAC Name
(2S)-5-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-2,3-dihydrochromen-4-one
Synonyms
compound 33 [PMID: 21650152]
Database Links
BindingDB Ligand 50384790
ChEMBL Ligand CHEMBL210692
GtoPdb PubChem SID 315661196
PubChem CID 44412004
Search Google for chemical match using the InChIKey DEOJMRBCCZJDEC-LBPRGKRZSA-N
Search Google for chemicals with the same backbone DEOJMRBCCZJDEC
Search UniChem for chemical match using the InChIKey DEOJMRBCCZJDEC-LBPRGKRZSA-N
Search UniChem for chemicals with the same backbone DEOJMRBCCZJDEC
Comments
6-methoxysakuranetin is a methoxylated flavanone compound with taste-modifying action. Reported to modify the response to saccharin at the human bitterness receptor TAS2R31 [1].