(1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-Hexahydro-3,7-dimethyl-8-[2-[(2R)-tetrahydro-4,6-dioxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl 2,2-Dimethylbutanoate

CAS: 1426939-44-7

Ref. TR-H291180

Produktinformation

• Name: (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-Hexahydro-3,7-dimethyl-8-[2-[(2R)-tetrahydro-4,6-dioxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl 2,2-Dimethylbutanoate
• Synonyme: Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-[(2R)-tetrahydro-4,6-dioxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl ester
• CAS: 1426939-44-7

Beschreibung

Applications This compound is the oxidation product of simvastatin (S485000) using cetyltrimethylammonium dichromate.
References Sahoo, Prangya Rani, et al.: Inter. J. of Chem. Kin., 45(4), 236-242 (2013)

• Marke: TRC

Chemische Eigenschaften

• Molekulargewicht: 416.55
• Formel: C₂₅H₃₆O₅
• Farbe/Form: Neat
• InChl: InChI=1S/C25H36O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,19-21,23H,6,9-10,12-14H2,1-5H3/t15-,16-,19+,20-,21-,23-/m0/s1
• InChI Key: InChIKey=CLXCPFFIPHNUED-ZROCIVKTSA-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]3CC(=O)CC(=O)O3)[C@H]21