125206-31-7

英文名称 6Carboxy Simvastatin

CAS 125206-31-7

分子式 C25H36O7

分子量 448.55

MOL 文件 125206-31-7.mol

125206-31-7 结构式

基本信息物理化学性质

基本信息

英文别名

6Carboxy Simvastatin
Caprylic Acid Impurity 20
6-Carboxy -5',4',5,6-SiMvastatin
6-Carboxy delta-5’,4’,5,6-simvastatin
[4S-[4a,4a,5(2S*,4S*),6]]-4(2,2-Dimethyl-1-oxobutoxy)-3,4,4a,5,6,7-hexahydro-6-methyl-5-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-2-naphthalenecarboxylic Acid
[4S-[4a,4ab,5b(2S*,4S*),6b]]-4(2,2-Dimethyl-1-oxobutoxy)-3,4,4a,5,6,7-hexahydro-6-methyl-5-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-2-naphthalenecarboxylic Acid
([4S-[4 ,4a ,5 (2S*,4S*),6 ]]-4(2,2-Dimethyl-1-oxobutoxy)-3,4,4a,5,6,7-hexahydro-6-methyl-5-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-2-naphthalenecarboxylic Acid)
2-Naphthalenecarboxylic acid, 4-(2,2-dimethyl-1-oxobutoxy)-3,4,4a,5,6,7-hexahydro-6-methyl-5-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-, [4S-[4α,4aβ,5β(2S*,4S*),6β]]- (9CI)

物理化学性质

熔点175-179°C

沸点642.790±55.00 °C(Press: 760.00 Torr)(predicted)

密度1.213±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)

储存条件-20°C Freezer

溶解度DMSO, methanol

酸度系数(pKa)4.564±0.70(predicted)

形态Solid

颜色Off-White