HIT ID: HIT212666664
Cas No: 1422954-11-7
分子式: C22H26FN3O5S
分子量: 463.52
常用名: (3R,5R)-Rosuvastatin Lactone
氢键受体数 (HBA): 6
氢键供体数 (HBD): 1
LogP: 2.5874317
IUPAC: N-[4-(4-fluorophenyl)-5-[(1E)-2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethenyl]-6-(propan-2-yl)pyrimidin-2-yl]-N-methylmethanesulfonamide
IUPAC: N-[4-(4-fluorophenyl)-5-[(1E)-2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethenyl]-6-(propan-2-yl)pyrimidin-2-yl]-N-methylmethanesulfonamide
SMILES: CC(C)c1nc(nc(-c2ccc(F)cc2)c1\C=C\[C@H]1C[C@@H](O)CC(=O)O1)N(C)S(C)(=O)=O
SMILES: CC(C)c1nc(nc(-c2ccc(F)cc2)c1\C=C\[C@H]1C[C@@H](O)CC(=O)O1)N(C)S(C)(=O)=O
InChI key: SOEGVMSNJOCVHT-WMXNSBIJSA-N
