534-67-8
534-67-8 结构式
基本信息
中文别名
R-百脉根苷化合物 T32887
英文别名
LOTAUSTRALIN(R)-Lotaustralin
2-(-D-Glucopyranosyloxy)-2-methylbutyronitrile
2-(b-D-Glucopyranosyloxy)-2-methylbutyronitrile
2-(BETA-D-GLUCOPYRANOSYLOXY)-2-METHYLBUTYRONITRILE
(2R)-2-(β-D-Glucopyranosyloxy)-2-methylbutanenitrile
Butanenitrile, 2-(β-D-glucopyranosyloxy)-2-methyl-, (2R)-
(2R)-2-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanenitrile
(2R)-2-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-butanenitrile
(2R)-2-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-butyronitrile
物理化学性质
熔点106 - 109°C
沸点479.066±45.00 °C(Press: 760.00 Torr)(predicted)
密度1.364±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
储存条件Refrigerator
溶解度DMSO（轻微）、甲醇（轻微）、水（轻微、加热、超声处理）
酸度系数(pKa)12.727±0.70(predicted)
形态固体
颜色白色至淡黄色
稳定性吸湿性
主要应用metabolomics
vitamins, nutraceuticals, and natural products
vitamins, nutraceuticals, and natural products
InChI1S/C11H19NO6/c1-3-11(2,5-12)18-10-9(16)8(15)7(14)6(4-13)17-10/h6-10,13-16H,3-4H2,1-2H3/t6-,7-,8+,9-,10+,11/m1/s1
InChIKeyWEWBWVMTOYUPHH-GXUZYPEDSA-N
SMILESO[C@@H]1[C@H]([C@@H](O[C@@H]([C@H]1O)CO)OC(C#N)(CC)C)O
CAS 数据库534-67-8