CAS 130468-11-0

(1S,7S,8S,8aS)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-6-oxo-1,2,6,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate

Description:

The chemical substance with the name "(1S,7S,8S,8aS)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-6-oxo-1,2,6,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate" and CAS number "130468-11-0" is a complex organic compound characterized by its multi-ring structure and specific stereochemistry. It features a hexahydronaphthalene core, which is substituted at various positions with functional groups, including a ketone and an ester. The presence of a tetrahydropyran moiety indicates potential biological activity, as such structures are often found in natural products and pharmaceuticals. The stereochemical descriptors (1S, 7S, 8S, 8aS) suggest that the molecule has multiple chiral centers, which can significantly influence its reactivity and interactions with biological systems. This compound may exhibit properties such as solubility in organic solvents, potential lipophilicity due to its hydrophobic regions, and specific binding affinities, making it of interest in medicinal chemistry and drug development. Further studies would be necessary to elucidate its precise biological activity and applications.

Formula: C₂₅H₃₆O₆

InChI: InChI=1/C25H36O6/c1-6-25(4,5)24(29)31-21-10-14(2)9-16-11-20(27)15(3)19(23(16)21)8-7-18-12-17(26)13-22(28)30-18/h9,11,15,17-19,21,23,26H,6-8,10,12-13H2,1-5H3/t15-,17+,18+,19+,21-,23+/m0/s1

Synonyms:

• 6-Oxo SiMvastatin
• Simvastatin Impurity 8
• (1R,7R,8R,8aR)-8-(2-((2R,4R)
• Butanoic acid, 2,2-dimethyl-, (1S,7R,8R,8aR)-1,2,6,7,8,8a-hexahydro-3,7-dimethyl-6-oxo-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl ester
• SiMvastatin 6-Oxo IsoMer
• L669
• Simvastatin Impurity 5
• L-669
• 2,2-Dimethylbutyric acid [(1S)-1,2,6,7,8,8aα-hexahydro-3,7α-dimethyl-6-oxo-8α-[2-[[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran]-2-yl]ethyl]naphthalen]-1β-yl ester
• L 669262
• L 669
• 2,2-DiMethylbutanoic Acid (1S,7R,8R,8aR)-1,2,6,7,8,8a-Hexahydro-3,7-diMethyl-
• 6-oxo-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl Ester
• [(1S,7S,8S,8aS)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-6-oxo-2,7,8,8a-tetrahydro-1H-naphthalen-1-yl] 2,2-dimethylbutanoate
• Simvastatin Impurity 18

6-Oxo-Simvastatin

CAS: 130468-11-0

Formula: C₂₅H₃₆O₆

Color and Shape: White To Off-White Solid

Molecular weight: 432.56

Ref: 4Z-S-129

6-Oxo Simvastatin

Controlled Product

CAS: 130468-11-0

Applications 6-Oxo Simvastatin is an analog of Simvastatin (S485000), a HMG-CoA reductase inhibitor.
References Joshua, H., et al.: J. Antibiot., 44, 366 (1991),

Formula: C₂₅H₃₆O₆

Color and Shape: Neat

Molecular weight: 432.55

Ref: TR-O862300

6-Oxo Simvastatin

CAS: 130468-11-0

Formula: C₂₅H₃₆O₆

Molecular weight: 432.56

Ref: ST-EA-CP-S4018

L 669262

CAS: 130468-11-0

L 669262 is a potent inhibitor of HMG-CoA reductase.

Formula: C₂₅H₃₆O₆

Color and Shape: Solid

Molecular weight: 432.55

Ref: TM-T24323

6-Oxo simvastatin

CAS: 130468-11-0

6-Oxo simvastatin is a homolog of the cholesterol synthesis inhibitor simvastatin. It inhibits the enzyme HMG-CoA reductase, which is involved in the production of cholesterol. 6-Oxo simvastatin can be extracted from microbial cultures and has been shown to inhibit microbial transformation of 3-hydroxy-3-methylglutaryl coenzyme A (HMG CoA) into mevalonic acid during growth. 6-Oxo simvastatin has been shown to have potent inhibitory effects on HMG CoA reductase in subspecies that are resistant to other inhibitors such as lovastatin and pravastatin.

Formula: C₂₅H₃₆O₆

Purity: Min. 95%

Molecular weight: 432.5 g/mol

Ref: 3D-FFA46811