Products 198818-02-9

CAS 198818-02-9 appears in our catalog under these names: 3’,5’-Dihydrodiol Simvastatin(Mixture of Diastereomers), >95% (HPLC), 3’,5’-Dihydrodiol Simvastatin (Mixture of Diastereomers). Offered by: TRC, Biosynth. Available pack sizes: 100mg, 10mg, 50mg, 2mg, 1mg, 5mg.

3’,5’-Dihydrodiol Simvastatin(Mixture of Diastereomers), >95% (HPLC)
TRC
  • size: 100mg, 10mg, 50mg
  • Variants: 3
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3’,5’-Dihydrodiol Simvastatin (Mixture of Diastereomers)
Biosynth
  • size: 2mg, 1mg, 5mg
  • Variants: 3
View product
Structural formula: {0} (CAS {1})

[(1S,3R,7R,8S,8aR)-4,6-dihydroxy-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] 2,2-dimethylbutanoate (CAS 198818-02-9) is a chemical compound with the molecular formula C25H40O7 and a molecular weight of 452.6 g/mol. IUPAC name: [(1S,3R,7R,8S,8aR)-4,6-dihydroxy-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] 2,2-dimethylbutanoate. InChIKey: MRCKOKWQDZYFLT-IHHACARCSA-N.

Identity
Molecular formulaC25H40O7
Molecular weight452.6 g/mol
IUPAC name[(1S,3R,7R,8S,8aR)-4,6-dihydroxy-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] 2,2-dimethylbutanoate
InChIKeyMRCKOKWQDZYFLT-IHHACARCSA-N
SMILESCCC(C)(C)C(=O)O[C@H]1C[C@H](C(C2=CC([C@@H]([C@@H]([C@@H]12)CC[C@@H]3C[C@H](CC(=O)O3)O)C)O)O)C

Computed by PubChem (NCBI)

Synonyms: Simvastatin impurity 29, 3',5'-Dihydrodiol Simvastatin (Mixture of Diastereomers), Dihydrosimvastatin-3',5'-diol, 3`,5`-Dihydrodiol Simvastatin
Related forms of this compound
[(1S,3R,7R,8S,8aR)-4,6-dihydroxy-8-[2-[(4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] 2,2-dimethylbutanoate C25H40O7