HuagongsheHuagongshe Chemistry Print Report · For research reference only
Kushenol C
Kushenol C · 2-(2,4-Dihydroxyphenyl)-3,5,7-trihydroxy-8-[(2R)-5-methyl-2-(1-methylethenyl)-4-hexenyl]-4H-1-benzopyran-4-one · 4H-1-Benzopyran-4-one, 2-(2,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-[(2R)-5-methyl-2-(1-methylethenyl)-4-hexen-1-yl]-
Identifiers & Physical Properties
| CAS No. | 99119-69-4 |
|---|---|
| Molecular formula | C25H26O7 |
| Average molar mass | 438.5 g/mol |
| Monoisotopic mass | 438.16785316 g/mol |
| SMILES | C=C(C)[C@H](CC=C(C)C)Cc1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3O)oc12 |
| InChIKey | WAAPHYJTKSTXSX-CQSZACIVSA-N |
| PubChem CID | 5481237 |
Chemical & Physical Properties
| XLogP | 5.3 |
|---|---|
| Topological polar surface area | 127 |
| Hydrogen bond donors | 5 |
| Hydrogen bond acceptors | 7 |
| Rotatable bonds | 6 |
| Heavy atoms | 32 |
| Formal charge | 0 |
| Complexity | 781 |
| Lipids | Polyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211] |
| Solubility | Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc. |
| Physical state | powder |
| Color | Yellow |
| GHS pictogram | GHS07 |
| Signal word | Warning |
| GHS hazard statements | H302-H315-H319-H335 |
| GHS precautionary statements | P280-P305+P351+P338 |
Safety & Regulations
| Signal word | Warning |
|---|---|
| GHS pictogram | GHS07 |
| GHS hazard statements | H302-H315-H319-H335 |
| GHS precautionary statements | P280-P305+P351+P338 |
Applications & Uses
Uses
Kushenol C, isolated from the roots of Sophora flavescens, shows anti-Inflammatory and anti-oxidative stress activities. Kushenol C inhibits BACE1 (β-site APP cleaving enzyme 1) with an IC50 of 5.45 μM[1][2].