(3S,5S)-Dihydroxy Simvastatin

CAS: 159143-77-8

Ref. TR-D895450

Informação sobre produto

• Nome: (3S,5S)-Dihydroxy Simvastatin
• Sinónimos: Butanoic acid, 2,2-dimethyl-, 1,2,3,4,6,7,8,8a-octahydro-4,6-dihydroxy-3,7-dimethyl-8-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-1-naphthalenyl ester, [1S-[1a,3a,4ß,6a,7ß,8ß(2S*,4S*),8aß]]- (9CI)
• CAS: 159143-77-8

Descrição

Applications (3S,5S)-Dihydroxy Simvastatin is a derivtive of Simvastatin (S485000). Simvastatin is a synthetic derivative of a fermentation product of Aspergillus terreus. A competitive inhibitor of HMG-CoA reductase. A synthetic analog of Lovastatin. Antilipemic. Simvastatin, the drug, is sold under the trade name Zocor.
References Hoffman, W.F., et al.: J. Med. Chem., 29, 849 (1986), Mol, M.J., et al.: Lancet, 2, 936 (1986)

• Marca: TRC

Propriedades químicas

• Peso molecular: 452.581
• Fórmula: C₂₅H₄₀O₇
• Cor/forma: Neat
• InChI: InChI=1S/C25H40O7/c1-6-25(4,5)24(30)32-20-9-13(2)23(29)18-12-19(27)14(3)17(22(18)20)8-7-16-10-15(26)11-21(28)31-16/h12-17,19-20,22-23,26-27,29H,6-11H2,1-5H3/t13-,14-,15-,16-,17+,19-,20+,22-,23+/m1/s1
• Chave InChI: InChIKey=MRCKOKWQDZYFLT-RWKWUWFSSA-N
• SMILES: CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)[C@H](O)C2=C[C@@H](O)[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@H]21