Simvastatin Impurity 45

cas: 159143-77-8 — see every product listed under this CAS number, including other names

Simvastatin Impurity 45 (CAS 159143-77-8) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-S132245
cas159143-77-8
sizeon request
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[(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 (CAS 159143-77-8) 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-[(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-GBCWWPGNSA-N.

Identity
Molecular formulaC25H40O7
Molecular weight452.6 g/mol
IUPAC name[(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
InChIKeyMRCKOKWQDZYFLT-GBCWWPGNSA-N
SMILESCCC(C)(C)C(=O)O[C@H]1C[C@H](C(C2=CC([C@@H]([C@@H]([C@@H]12)CCC3C[C@H](CC(=O)O3)O)C)O)O)C

Computed by PubChem (NCBI)

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