CAS
114880-31-8 Purity
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114880-31-8 Purity
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6'-Hydroxymethyl simvastatin
CAS
114883-29-3
Catalog Number
ACM114883293
Category
Other Products
Molecular Weight
434.57
Molecular Formula
C25H38O6
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Specification
Synonyms
2,2-Dimethylbutanoic Acid [1S-[1α,3α,7α,8β(2S*,4S*),8aβ]]-1,2,3,7,8,8a
-hexahydro-3-(hydroxymethyl)-7-methyl-8-[2-(tetrahydro-4-hydroxy
-6-oxo-2H-pyran-2-yl)ethyl]-1-naphthalenyl Ester
-hexahydro-3-(hydroxymethyl)-7-methyl-8-[2-(tetrahydro-4-hydroxy
-6-oxo-2H-pyran-2-yl)ethyl]-1-naphthalenyl Ester
IUPAC Name
[(1S,3R,7S,8S,8aR)-3-(hydroxymethyl)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate
Canonical SMILES
CCC(C)(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O)CO
InChI Key
ATPFRGQBOVFFQM-HGQWONQESA-N
Appearance
Pale Orange Solid
Exact Mass
434.26700
H-Bond Acceptor
6
H-Bond Donor
2
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