4-tert-Butyldimethylsilyl-4a'-hydroxy simvastatin

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Catalog Number
ACM125142167
Product Name
4-tert-Butyldimethylsilyl-4a'-hydroxy simvastatin
Structure
Structure
CAS
125142-16-7
Category
Heterocyclic Organic Compound
Synonyms
2,2-Dimethyl-butanoic Acid [1S-[1α,3α,4aα,7β,8β(2S*,4S*),8aβ]]-8-[2-[4-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]tetrahydro-6-oxo-2H-pyran-2-yl]ethyl]-1,2,3,4,4a,7,8,8a-octahydro-4a-hydroxy-3,7-dimethyl-1-naphthalenyl Ester
IUPAC Name
[(1S,3R,4aS,7S,8S,8aS)-8-[2-[(2R,4R)-4-[tert-butyl(dimethyl)silyl]oxy-6-oxooxan-2-yl]ethyl]-4a-hydroxy-3,7-dimethyl-2,3,4,7,8,8a-hexahydro-1H-naphthalen-1-yl] 2,2-dimethylbutanoate
Molecular Weight
550.84
Molecular Formula
C31H54O6Si
Canonical SMILES
CCC(C)(C)C(=O)OC1CC(CC2(C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O[Si](C)(C)C(C)(C)C)O)C
InChI Key
PNTVVZJLRPNFKC-OMHVBIQFSA-N
Boiling Point
592.305ºC at 760 mmHg
Flash Point
312.015ºC
Density
1.055g/cm³
Appearance
White Solid
Exact Mass
550.36900
H-Bond Acceptor
6
H-Bond Donor
1
MSDS
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COA
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Spec Sheet
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