Rosuvastatin-[d6]

General Information
Catalog: BLP-004162
CAS: 2070009-40-2
Molecular Formula: C22H22D6FN3O6S
Molecular Weight: 487.58
Related CAS: 287714-41-4 (unlabelled)
Description Rosuvastatin-[d6] is a labelled form of Rosuvastatin. Rosuvastatin, also called as ZD 4522 or Crestor, a synthetic statin, in the phase III HYDRA trial for Hypercholesterolaemia, is a competitive inhibitor of HMG-CoA reductase (IC50 = 11 nM).
Synonyms (3S,5R,6E)-7-[4-(4-fluorophenyl)-2-(N-methylmethanesulfonamido)-6-[(1,1,1,3,3,3-D6)propan-2-yl]pyrimidin-5-yl]-3,5-dihydroxyhept-6-enoic acid; 7-[4-(4-Fluorophenyl)-6-(1-methylethyl-d6)-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl]-3,5-dihydroxy-6-heptenoic Acid
IUPAC Name (E,3R,5S)-7-[4-(4-fluorophenyl)-6-(1,1,1,3,3,3-hexadeuteriopropan-2-yl)-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl]-3,5-dihydroxyhept-6-enoic acid
Canonical SMILES CC(C)C1=NC(=NC(=C1C=CC(CC(CC(=O)O)O)O)C2=CC=C(C=C2)F)N(C)S(=O)(=O)C
InChI InChI=1S/C22H28FN3O6S/c1-13(2)20-18(10-9-16(27)11-17(28)12-19(29)30)21(14-5-7-15(23)8-6-14)25-22(24-20)26(3)33(4,31)32/h5-10,13,16-17,27-28H,11-12H2,1-4H3,(H,29,30)/b10-9+/t16-,17-/m1/s1/i1D3,2D3
InChI Key BPRHUIZQVSMCRT-ZPYIEOOESA-N
Purity >98%

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