3-羟基辛伐他汀(134523-09-4)名称与标识符
名称
中文别名:
2,2-二甲基-丁酸 1,2,3,7,8,8a-六氢-3-羟基-3,7-二甲基-8-[2-(四氢-4-羟基-6-氧代-2H-吡喃-2-基)乙基]-1-萘基酯;3-羟基辛伐他汀;
英文别名:
Butanoic acid,2,2-dimethyl-,1,2,3,7,8,8a-hexahydro-3-hydroxy-3,7-dimethyl-8-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-1-naphthalenylester;6’-HYDROXY SIMVASTATIN DISCONTINUED;6'-HYDROXY SIMVASTATIN;6Hydroxy SimvastatinDiscontinued;134523-09-4;[(1S,7S,8S,8Ar)-3-hydroxy-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-2,7,8,8a-tetrahydro-1H-naphthalen-1-yl] 2,2-dimethylbutanoate;3-Hydroxy Simvastatin;
标识符
InChIKey:
WJKSTNFUSXHVRJ-KWPXGIBLSA-N
Inchi:
1S/C25H38O6/c1-6-24(3,4)23(28)31-20-14-25(5,29)13-16-8-7-15(2)19(22(16)20)10-9-18-11-17(26)12-21(27)30-18/h7-8,13,15,17-20,22,26,29H,6,9-12,14H2,1-5H3/t15-,17+,18+,19-,20-,22-,25?/m0/s1
SMILES:
O(C(C(C)(C)CC)=O)[C@H]1CC(C)(C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@H](CC(=O)O3)O)[C@@H]12)O