4'-Acetyl Simvastatin

CAS: 145576-25-6

Ref. TR-A187795

Información del producto

• Nombre: 4'-Acetyl Simvastatin
• Sinónimos: Acetyl Simvastatin, (1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-(Acetyloxy)-6-oxotetrahydro-2H-pyran-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-Dimethylbutanoate, Simvastatin Acetate Ester, Simvastatin Impurity B,(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-(Acetyloxy)-6-oxotetrahydro-2H-pyran-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-Dimethylbutanoate (Simvastatin Acetate Ester), Simvastatin Imp. B (EP), (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-(acetyloxy)-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate

Descripción

Impurity Simvastatin EP Impurity B
Applications 4'-Acetyl Simvastatin (Simvastatin EP Impurity B) is a Simvastatin (S485000) impurity.
References Shioi, A., et al.: J. Phys. Chem., 99, 4750 (1995), Wang, L., et al.: J. Pharm. Biomed. Anal., 21, 1243 (2000), Vuletic, M., et al.: J. Pharm. Biomed. Anal., 37, 715 (2005),

• Marca: TRC

Propiedades químicas

• Peso molecular: 460.60
• Fórmula: C₂₇H₄₀O₆
• Color/Forma: White To Off-White
• InChI: InChI=1S/C27H40O6/c1-7-27(5,6)26(30)33-23-13-16(2)12-19-9-8-17(3)22(25(19)23)11-10-20-14-21(31-18(4)28)15-24(29)32-20/h8-9,12,16-17,20-23,25H,7,10-11,13-15H2,1-6H3/t16-,17-,20+,21+,22-,23-,25-/m0/s1
• Clave InChI: InChIKey=OHVWRJDVJRNCPE-BIKFJBPRSA-N
• SMILES: CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](OC(C)=O)CC(=O)O3)[C@H]21