Theophylline-triazole-estrone
Theophylline-triazole-estrone is an α-glucosidase inhibitor with an IC50 of 123.9 μM. Theophylline-triazole-estrone interacts with the catalytic site of α-glucosidase and binds to the anti-apoptotic protein BCL-2. Theophylline-triazole-estrone reduces cancer cell viability and can be used in research related to type 2 diabetes and breast cancer.
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- Fòrmula: C31H39N7O4
- Peso molecular:573.69
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Almacenamiento:
Please store the product under the recommended conditions in the Certificate of Analysis.
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Actividad biológica
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α‑glucosidase 123.9 μM (IC50) |
Theophylline-triazole-estrone (compound 4) (15.6-250 μM; 15 min) inhibits α-glucosidase, with an IC50 of 123.9 μM and an inhibition rate of 84.4% at a concentration of 250 μM[1].
Theophylline-triazole-estrone (7.8-250 μM; 48 h) reduces the viability of MCF-7 cells by 21%[1].
Theophylline-triazole-estrone binds to α-glucosidase via specific residue interactions with a binding energy of -10.8 kcal/mol; it also binds to BCL-2 isoform 1 with a binding energy of -8.3 kcal/mol[1].
MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.
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Cell Line:MCF-7 human breast adenocarcinoma cells
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Concentration:7.8, 15.6, 31.2, 62.5, 125, 250 μM
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Incubation Time:48 h
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Result:Showed a concentration-dependent antiproliferative trend.
Reduced average cell viability by 21% at 250 μM.
Chemical Information
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Peso molecular 573.69
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Fòrmula C31H39N7O4
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SMILES
CN(C1=O)C(C2=C(N(C=N2)CCCN3N=NC(COC(C=C4)=CC(CC[C@@]5([H])[C@]6([H])CC7)=C4[C@@]5([H])CC[C@]6(C)C7=O)C3)N1C)=O
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Envío
Room temperature in continental US; may vary elsewhere.
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Almacenamiento
Please store the product under the recommended conditions in the Certificate of Analysis.
Pureza y Documentación
Referencias
Calculators
Concentration (start) × Volume (start) = Concentration (final) × Volume (final)
Theophylline-triazole-estrone Related Classifications
HY-187715 Related Classifications
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