(1S,3R,7S,8S,8aR)-3,7-Dimethyl-8-[2-[(2R)-6-oxo-3,6-dihydro-2H-pyran-2-yl]ethyl]-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-Dimethylbutanoate (Anhydrosimvastatin)
Product Code
MM0158.03
CAS Number
EP Description
Simvastatin Impurity C
Product Format
Neat
Molecular Formula
C25 H36 O4
Molecular Weight
400.55
API Family
SimvastatinProduct Categories
Mikromol, Cardiac drugs and beta blockers, Statins and related drugs, Impurity Reference Materials
Product Type
ImpurityDrug Type
Antihyperlipidemics
Documentation
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Product Information
Analyte Data
Analyte Name
Anhydro Simvastatin
CAS Number
210980-68-0
Molecular Formula
C25 H36 O4
Molecular Weight
400.55
Accurate Mass
400.2614
SMILES
CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3CC=CC(=O)O3)[C@@H]12
InChI
InChI=1S/C25H36O4/c1-6-25(4,5)24(27)29-21-15-16(2)14-18-11-10-17(3)20(23(18)21)13-12-19-8-7-9-22(26)28-19/h7,9-11,14,16-17,19-21,23H,6,8,12-13,15H2,1-5H3/t16-,17-,19-,20-,21-,23-/m0/s1
IUPAC
[(1S,3R,7S,8S,8aR)-3,7-dimethyl-8-[2-[(2R)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate
Product Data
Storage Temperature
-18°C
Shipping Temperature
Ice pack (-20°C)
Country of Origin
GERMANY
Tariff Code
29322090
Product Type
Impurity
Product Format
Neat
Impurity Type
By-Product
API Family
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