[CAS NO. 486-60-2] Bergaptol
PRODUCTS SPECIFICATIONS [486-60-2]
DESCRIPTION [486-60-2]
Overview
| MDL | MFCD00210479 |
|---|---|
| Molecular Weight | 202.16 |
| Molecular Formula | C11H6O4 |
| SMILES | O=C1C=CC(C(O1)=C2)=C(O)C3=C2OC=C3 |
Summary
Bergaptol is a hydroxylated psoralen that acts as a potent inhibitors of debenzylation activity of CYP3A4 enzyme with an IC50 value of 24.92 uM. Recent studies suggest that it may have antiproliferative and anticancer properties. target: CYP3A4 [1] IC50: 24.92 [1] For in vivo enzyme activity analysis, 100 μM bergaptol was added to the cultures for an additional 24 h at 37°C. After centrifugation, the supernatant was used to measure the bergapten yield by high performance liquid chromatography (HPLC).[2]
Appearance
Solid
Source
Shipping
Room temperature in continental US; may vary elsewhere.
Storage
| Powder | -20°C | 3 years |
|---|---|---|
| 4°C | 2 years | |
| In solvent | -80°C | 6 months |
| -20°C | 1 month |
Solvent & Solubility
DMSO : ≥ 50 mg/mL ( 247.33 mM )
H 2 O : < 0.1 mg/mL (ultrasonic) (insoluble)
* "≥" means soluble, but saturation unknown.
Stock Solutions
| Concentration Solvent Mass | 1 mg | 5 mg | 10 mg |
|---|
| 1 mM | 4.9466 mL | 24.7329 mL | 49.4658 mL |
| 5 mM | 0.9893 mL | 4.9466 mL | 9.8932 mL |
| 10 mM | 0.4947 mL | 2.4733 mL | 4.9466 mL |
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1.
References
- [1] Basavaraj Girennavar et al. Radical scavenging and cytochrome P450 3A4 inhibitory activity of bergaptol and geranylcoumarin from grapefruit. Bioorganic & Medicinal Chemistry.June 2007, Pages 3684-3691
- [2] Yucheng Zhao et al. Cloning, Functional Characterization, and Catalytic Mechanism of a Bergaptol O-Methyltransferase from Peucedanum praeruptorum Dunn. Front Plant Sci, 2016, 7: 722.
Synonyms