Simvastatin Impurity 59

cas: 1246815-38-2 — see every product listed under this CAS number, including other names

Simvastatin Impurity 59 (CAS 1246815-38-2) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-S132259
cas1246815-38-2
sizeon request
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Structural formula: {0} (CAS {1})

[(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbut-3-enoate (CAS 1246815-38-2) is a chemical compound with the molecular formula C25H36O5 and a molecular weight of 416.5 g/mol. IUPAC name: [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbut-3-enoate. InChIKey: PHAXMMMKRGSDIV-HGQWONQESA-N.

Identity
Molecular formulaC25H36O5
Molecular weight416.5 g/mol
IUPAC name[(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbut-3-enoate
InChIKeyPHAXMMMKRGSDIV-HGQWONQESA-N
SMILESC[C@@H]1C[C@@H]([C@@H]2[C@H]([C@H](C=CC2=C1)C)CC[C@@H]3C[C@H](CC(=O)O3)O)OC(=O)C(C)(C)C=C

Computed by PubChem (NCBI)