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D-Gluconic acid, O-a-D-galactopyranosyl-(1®6)-O-a-D-galactopyranosyl-(1®6)-, monopotassium salt (9CI) | 122871-01-6

D-Gluconic acid, O-a-D-galactopyranosyl-(1®6)-O-a-D-galactopyranosyl-(1®6)-, monopotassium salt (9CI)结构式图片|122871-01-6结构式图片
D-Gluconic acid, O-a-D-galactopyranosyl-(1®6)-O-a-D-galactopyranosyl-(1®6)-, monopotassium salt (9CI)
122871-01-6
C18H31O17-.K+
558.52684
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:D-Gluconic acid, O-a-D-galactopyranosyl-(1®6)-O-a-D-galactopyranosyl-(1®6)-, monopotassium salt (9CI)结构式
23693552
名称和标识符
InChIKey JDHOBIWORAZQQR-WDKREWJJSA-M
Inchi InChI=1S/C18H32O17.K/c19-1-4(22)7(23)14(34-17-12(28)10(26)8(24)5(2-20)32-17)15(16(30)31)35-18-13(29)11(27)9(25)6(3-21)33-18;/h4-15,17-29H,1-3H2,(H,30,31);/q;+1/p-1/t4-,5-,6-,7-,8+,9+,10+,11+,12-,13-,14+,15-,17-,18-;/m1./s1
SMILES [K+].OC[C@H]([C@H]([C@@H]([C@@H](O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)C([O-])=O)O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)O)O
别名信息
- 中文别名 -
- 英文别名 -
  • manninotrionate
  • potassium,(2R,3S,4R,5R)-4,5,6-trihydroxy-2,3-bis[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]hexanoate
  • 6)-, monopotassium salt (9CI)
  • 6)-O-a-D-galactopyranosyl-(1&reg
  • alpha-D-Galactopyranosyl-(1-6)-alpha-D-galactopyranosyl-(1-6)-D-gluconate
  • D-Gluconic acid, O-alpha-D-galactopyranosyl-(1-6)-O-alpha-D-galactopyranosyl-(1-6)-, monopotassium salt
  • O-alpha-D-Galactopyranosyl-(1-6)-O-alpha-D-galactopyranosyl-(1-6)-D-gluconic acid monopotassium salt
  • potassium (2R,3S,4R,5R)-4,5,6-trihydroxy-2,3-bis{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}hexanoate (
  • DTXSID70153759
  • potassium
  • (2R,3S,4R,5R)-4,5,6-trihydroxy-2,3-bis[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]hexanoate
  • 122871-01-6
  • Manninotrionate
物化性质
实验特性
PSA 299.58
计算特性
精确分子量 558.11973
氢键供体数量 11
氢键受体数量 17
可旋转化学键数量 11
同位素质量 558.11983100g/mol
重原子数量 36
复杂度 674
同位素原子数量 0
确定原子立构中心数量 14
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 2
拓扑分子极性表面积 300Ų
国际标准相关数据
EINECS
专业数据库参考
PubChemId 23693552
参考资料
Reaxys RN
D-Gluconic acid, O-a-D-galactopyranosyl-(1®6)-O-a-D-galactopyranosyl-(1®6)-, monopotassium salt (9CI)推荐生产厂家
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