Rosuvastatin Acyl-b-D-glucuronide
Product Code
TRC-R700525
CAS Number
Product Format
Neat
Molecular Formula
C28 H36 F N3 O12 S
Molecular Weight
657.66
Product Categories
Documentation
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Product Information
Chemical Data
Analyte Name
Rosuvastatin Acyl-beta-D-glucuronide
CAS Number
503610-44-4
Molecular Formula
C28 H36 F N3 O12 S
Molecular Weight
657.66
Accurate Mass
657.2004
SMILES
CC(C)c1nc(nc(c1\C=C\[C@@H](O)C[C@@H](O)CC(=O)O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)c3ccc(F)cc3)N(C)S(=O)(=O)C
InChI
InChI=1S/C28H36FN3O12S/c1-13(2)20-18(21(14-5-7-15(29)8-6-14)31-28(30-20)32(3)45(4,41)42)10-9-16(33)11-17(34)12-19(35)43-27-24(38)22(36)23(37)25(44-27)26(39)40/h5-10,13,16-17,22-25,27,33-34,36-38H,11-12H2,1-4H3,(H,39,40)/b10-9+/t16-,17-,22+,23+,24-,25+,27-/m1/s1
IUPAC
(2S,3S,4S,5R,6S)-6-[(E,3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)amino]-6-propan-2-ylpyrimidin-5-yl]-3,5-dihydroxyhept-6-enoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Product Data
Storage Temperature
-86°C
Shipping Temperature
Dry ice
Country of Origin
CANADA
Product Format
Neat