56983-24-5 (Ap5G,Guanosine 5'-(hexahydrogen pentaphosphate), P''''→5'-ester with adenosine)

结构式:
CAS号:
56983-24-5
中文名称:
Ap5G
英文名称:
Guanosine 5'-(hexahydrogen pentaphosphate), P''''→5'-ester with adenosine
分子式:
C20H29N10O23P5
分子量:
932.36626791954

Ap5G(56983-24-5)名称与标识符

名称

英文别名:
[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] hydrogen phosphate;[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hyd;P1-(5'-ADENOSYL)-P5-(5'-GUANOSYL) PENTAPHOSPHATE;Guanosine pentaphosphate adenosine;G5P;Ap5G;2f3r;Q27460561;guanosine 5'-(hexahydrogen pentaphosphate),P''?5'-ester with adenosine;{[(2R,3S,4R,5R)-5-(2-amino-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}[({[({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl)ox;CID 135441208;Guanosine 5'-(hexahydrogen pentaphosphate), P''''→5'-ester with adenosine;{[(2R,3S,4R,5R)-5-(2-amino-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}[({[({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl)oxy]phosphinic acid;56983-24-5;SCHEMBL6438242;Guanosine 5'-(hexahydrogen pentaphosphate), P''''->5'-ester with adenosine;DTXSID90425869;;P1-(5'-ADENOSYL)-P5-(5'-GUANOSYL) PENTAPHOSPHATE;

标识符

InChIKey:
CNMILLPGDWDFCZ-INFSMZHSSA-N
Inchi:
1S/C20H29N10O23P5/c21-14-8-15(24-3-23-14)29(4-25-8)18-12(33)10(31)6(48-18)1-46-54(36,37)50-56(40,41)52-58(44,45)53-57(42,43)51-55(38,39)47-2-7-11(32)13(34)19(49-7)30-5-26-9-16(30)27-20(22)28-17(9)35/h3-7,10-13,18-19,31-34H,1-2H2,(H,36,37)(H,38,39)(H,40,41)(H,42,43)(H,44,45)(H2,21,23,24)(H3,22,27,28,35)/t6-,7-,10-,11-,12-,13-,18-,19-/m1/s1
SMILES:
P(=O)(O)(OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@H](N2C=NC3C(N)=NC=NC2=3)O1)O)O)OC[C@@H]1[C@H]([C@H]([C@H](N2C=NC3C(NC(N)=NC2=3)=O)O1)O)O

Ap5G(56983-24-5)物化性质

计算特性

  • 精确分子量 : 932.00951220g/mol
  • 氢键供体数量 : 12
  • 氢键受体数量 : 29
  • 可旋转化学键数量 : 16
  • 同位素质量 : 932.00951220g/mol
  • 重原子数量 : 58
  • 复杂度 : 1840
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 8
  • 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) : -10.2
  • 拓扑分子极性表面积 : 496

Ap5G(56983-24-5)推荐厂家 更多厂家(2)

公司名称手机号/电话联系人QQ微信询单
上海楷森生物科技有限公司 17558870519
175-58870519
赵经理 3003926540
询单
上海甄准生物科技有限公司 13816009161
021-68920155
姜经理13816009161 3001086693
询单

Ap5G(56983-24-5)合成路线

合成路线:1 步
反应条件:
参考文献:
Specific synthesis of adenosine(5')tetraphospho(5')nucleoside and adenosine(5')oligophospho(5')adenosine (n > 4) catalyzed by firefly luciferase
By Ortiz, Begona et al, European Journal of Biochemistry, 1993, 212(1), 263-70