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6'-Hydroxymethyl Simvastatin Acid Sodium Salt

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For Research Use Only | Not For Clinical Use
CATAPS134452134
CAS134452-13-4
IUPAC Namesodium;(3R,5R)-7-[(1S,2S,6R,8S,8aR)-8-(2,2-dimethylbutanoyloxy)-6-(hydroxymethyl)-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate
Molecular Weight474.56
Molecular FormulaC25H39O7.Na
Canonical SMILES[Na+].CCC(C)(C)C(=O)O[C@H]1C[C@@H](CO)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(=O)[O-])[C@@H]12
InChIInChI=1S/C25H40O7.Na/c1-5-25(3,4)24(31)32-21-11-16(14-26)10-17-7-6-15(2)20(23(17)21)9-8-18(27)12-19(28)13-22(29)30
Accurate Mass474.2593
FormatNeat
SubcategoryChiral molecules, Statins and related drugs
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