41847-55-6 (β-D-山梨吡喃糖,beta-D-sorbopyranose)

快速询单

结构式：

β-D-山梨吡喃糖MOL文件

CAS号：

41847-55-6

中文名称：

β-D-山梨吡喃糖

英文名称：

beta-D-sorbopyranose

分子式：

C₆H₁₂O₆

分子量：

180.155882835388

β-D-山梨吡喃糖(41847-55-6)名称与标识符

名称

英文别名：

beta-D-sorbopyranose;

标识符

InChIKey：

LKDRXBCSQODPBY-JGWLITMVSA-N

Inchi：

1S/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2/t3-,4+,5-,6-/m1/s1

SMILES：

O1C[C@H]([C@@H]([C@H]([C@]1(CO)O)O)O)O

β-D-山梨吡喃糖(41847-55-6)物化性质

计算特性

精确分子量 : 180.06338810g/mol
氢键供体数量 : 5
氢键受体数量 : 6
可旋转化学键数量 : 1
同位素质量 : 180.06338810g/mol
重原子数量 : 12
复杂度 : 162
同位素原子数量 : 0
确定原子立构中心数量 : 4
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : -2.8
拓扑分子极性表面积 : 110Å²

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41847-55-6 (β-D-山梨吡喃糖,beta-D-sorbopyranose)

β-D-山梨吡喃糖(41847-55-6)名称与标识符

名称

标识符

β-D-山梨吡喃糖(41847-55-6)物化性质

计算特性

β-D-山梨吡喃糖(41847-55-6)相关文献

目录