Ethyl (3R,5R)-7-[(1S,2S,6R,8S,8aR)-8-[(2,2-Dimethylbutanoyl)oxy]-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate
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- structure.search.product.name Ethyl (3R,5R)-7-[(1S,2S,6R,8S,8aR)-8-[(2,2-Dimethylbutanoyl)oxy]-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate
- Product Code: MM0158.21-0025
- CAS Number: 864357-87-9
- Brand: Mikromol
Product Overview
Product Code
MM0158.21-0025
CAS Number
Product Format
Neat
Molecular Formula
C27 H44 O6
Molecular Weight
464.63
API Family
SimvastatinProduct Categories
Impurity Reference Materials , Cardiac drugs and beta blockers, Mikromol
Product Type
ImpurityDocumentation
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Product Information
Analyte Data
Analyte Name
Simvastatin Hydroxy Acid Ethyl Ester
CAS Number
864357-87-9
Molecular Formula
C27 H44 O6
Molecular Weight
464.63
Accurate Mass
464.3138
SMILES
CCOC(=O)C[C@H](O)C[C@H](O)CC[C@H]1[C@@H](C)C=CC2=C[C@H](C)C[C@H](OC(=O)C(C)(C)CC)[C@H]12
InChI
InChI=1S/C27H44O6/c1-7-27(5,6)26(31)33-23-14-17(3)13-19-10-9-18(4)22(25(19)23)12-11-20(28)15-21(29)16-24(30)32-8-2/h9-10,13,17-18,20-23,25,28-29H,7-8,11-12,14-16H2,1-6H3/t17-,18-,20+,21+,22-,23-,25-/m0/s1
IUPAC
ethyl (3R,5R)-7-[(1S,2S,6R,8S,8aR)-8-(2,2-dimethylbutanoyloxy)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate
Product Data
Storage Temperature
-18°C
Shipping Temperature
Ice pack (-20°C)
Country of Origin
GERMANY
Product Format
Neat
API Family