103301-73-1 (鸟苷5’-(三氢二磷酸),对’-D-吡喃甘露糖酯,二钠盐(9CI),Guanosine5'-(trihydrogen diphosphate), P'-D-mannopyranosyl ester, disodium salt (9CI))

CAS号:
103301-73-1
中文名称:
鸟苷5’-(三氢二磷酸),对’-D-吡喃甘露糖酯,二钠盐(9CI)
英文名称:
Guanosine5'-(trihydrogen diphosphate), P'-D-mannopyranosyl ester, disodium salt (9CI)
分子式:
C16H23N5Na2O16P2
分子量:
649.304787874222

鸟苷5’-(三氢二磷酸),对’-D-吡喃甘露糖酯,二钠盐(9CI)(103301-73-1)名称与标识符

名称

中文别名:
GDP-D-甘露糖二钠盐;
英文别名:
Guanosine5'-(trihydrogen diphosphate), P'-D-mannopyranosyl ester, disodium salt (9CI);GDP-ALPHA-D-MANNOSE, DISODIUM SALT;Guanosine 5′-diphospho-D-mannose sodium salt from Saccharomyces cerevisiae;GDP-α-D-MANNOSE, DISODIUM SALT;GDP-Man;GDP-MAN, NA2;GDP-Man, GDP-mannose;GUANOSINE 5'-DIPHOSPHO-D-MANNOSE*DISODIU M;GUANOSINE 5'-DIPHOSPHO-D-MANNOSE SODIUM SALT;GUANOSINE-5'-DIPHOSPHATE-ALPHA-D-MANNOSE, 2NA;GUANOSINE 5'-DIPHOSPHO-D-MANNOSE*TYPE I SODIUM;Guanosine-5''-diphospho-D-mannose disodium salt;GUANOSINE-5'-DIPHOSPHO-ALPHA-D-MANNOSE, DISODIUM;GDP-D-mannose disodium salt;E75151;((2R,3S,4R,5R)-5-(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl ((2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)diphosphate Sodium Salt (1:2);103301-73-1;Guanosine 5'-diphospho-a-D-mannose disodium salt;Gdp-alpha-D-mannose,disodium salt;DTXSID60468728;Guanosine 5'-diphospho-D-mannose sodium salt from Saccharomyces cerevisiae;Gdp-man sodium salt type i;Guanosine 5'-diphospho-alpha-D-mannose disodium salt, >=95.0% (HPLC);148296-46-2;GDP-Mannose disodium salt;disodium;[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] phosphate;1ST170040Na;GDP-D-Man.2Na; [[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] phosphate; Gdp-man sodium salt type i; Gdp-alpha-D-mannose,disodium salt;GDP-D-mannose;DISODIUM GDP-?-D-MANNOSE(2-);GDP-alpha-D-mannose disodium;

标识符

MDL:
MFCD00799981
InChIKey:
XOAGKSFNHBWACO-RAUZPKMFSA-L
Inchi:
1S/C16H25N5O16P2.2Na/c17-16-19-12-6(13(28)20-16)18-3-21(12)14-10(26)8(24)5(34-14)2-33-38(29,30)37-39(31,32)36-15-11(27)9(25)7(23)4(1-22)35-15;;/h3-5,7-11,14-15,22-27H,1-2H2,(H,29,30)(H,31,32)(H3,17,19,20,28);;/q;2*+1/p-2/t4-,5-,7-,8-,9+,10-,11+,14-,15-;;/m1../s1
SMILES:
P(=O)([O-])(OP(=O)([O-])O[C@@H]1[C@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)OC[C@@H]1[C@H]([C@H]([C@H](N2C=NC3C(NC(N)=NC2=3)=O)O1)O)O.[Na+].[Na+]

鸟苷5’-(三氢二磷酸),对’-D-吡喃甘露糖酯,二钠盐(9CI)(103301-73-1)物化性质

实验特性

  • LogP : -3.17090
  • PSA : 357.00000

计算特性

  • 精确分子量 : 649.04100
  • 氢键供体数量 : 8
  • 氢键受体数量 : 18
  • 可旋转化学键数量 : 9
  • 同位素质量 : 649.04104222g/mol
  • 重原子数量 : 41
  • 复杂度 : 1040
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 9
  • 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 : 3
  • 拓扑分子极性表面积 : 333Ų

鸟苷5’-(三氢二磷酸),对’-D-吡喃甘露糖酯,二钠盐(9CI)(103301-73-1)安全信息

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