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CAS 917805-85-7

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6-Heptenoic acid, 7-[4-(4-fluorophenyl)-6-(1-methylethyl)-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl]-3,5-dihydroxy-, (3R,5S,6E)-, compd. with 2,4,4-trimethyl-2-pentanamine (1:1)

Description:
6-Heptenoic acid, 7-[4-(4-fluorophenyl)-6-(1-methylethyl)-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl]-3,5-dihydroxy-, (3R,5S,6E)-, compd. with 2,4,4-trimethyl-2-pentanamine (1:1) is a complex organic compound characterized by its unique structural features, including a heptenoic acid backbone and a pyrimidine ring substituted with various functional groups. The presence of a fluorophenyl group and a methylsulfonylamino moiety suggests potential biological activity, possibly influencing its pharmacological properties. The compound exhibits stereochemistry, indicated by the (3R,5S,6E) configuration, which may affect its interaction with biological targets. Additionally, the inclusion of 2,4,4-trimethyl-2-pentanamine indicates a potential for enhanced solubility or bioavailability. This compound may be of interest in medicinal chemistry, particularly in the development of therapeutics, due to its diverse functional groups and structural complexity. Its CAS number, 917805-85-7, allows for precise identification in chemical databases and literature. Overall, this compound represents a significant area of study for researchers exploring novel chemical entities with potential applications in drug development.
Formula:C30H47FN4O6S
InChI:InChI=1S/C22H28FN3O6S.C8H19N/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;1-7(2,3)6-8(4,5)9/h5-10,13,16-17,27-28H,11-12H2,1-4H3,(H,29,30);6,9H2,1-5H3/b10-9+;/t16-,17-;/m1./s1
InChI key:InChIKey=NQTASEKZJLHSQU-DHMAKVBVSA-N
SMILES:C(=C/[C@H](C[C@H](CC(O)=O)O)O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2.C(C(C)(C)C)C(C)(C)N
Synonyms:
  • 6-Heptenoic acid, 7-[4-(4-fluorophenyl)-6-(1-methylethyl)-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl]-3,5-dihydroxy-, (3R,5S,6E)-, compd. with 2,4,4-trimethyl-2-pentanamine (1:1)
  • 2,4,4-trimethylpentan-2-aminium (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl}-3,5-dihydroxyhept-6-enoate
  • Rosuvastatin TMBA Salt
  • Rosuvastatin t-octylammonium salt
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