32452-17-8 ([[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-[(oxi do-phosphonatooxy-phosphoryl)oxymethyl]tetrahydrofuran-3-yl]oxy-o xido-phosphoryl] phosphate,[[(2r,3s,4r,5r)-5-(2-amino-6-oxo-1h-purin-9-yl)-4-hydroxy-2-[(oxi Do-phosphonatooxy-phosphoryl)oxymethyl]tetrahydrofuran-3-yl]oxy-o Xido-phosphoryl] Phosphate)

CAS号:
32452-17-8
中文名称:
[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-[(oxi do-phosphonatooxy-phosphoryl)oxymethyl]tetrahydrofuran-3-yl]oxy-o xido-phosphoryl] phosphate
英文名称:
[[(2r,3s,4r,5r)-5-(2-amino-6-oxo-1h-purin-9-yl)-4-hydroxy-2-[(oxi Do-phosphonatooxy-phosphoryl)oxymethyl]tetrahydrofuran-3-yl]oxy-o Xido-phosphoryl] Phosphate
分子式:
C10H17N5O17P4
分子量:
603.16032576561

[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-[(oxi do-phosphonatooxy-phosphoryl)oxymethyl]tetrahydrofuran-3-yl]oxy-o xido-phosphoryl] phosphate(32452-17-8)名称与标识符

名称

中文别名:
鸟苷 3'-(三氢二磷酸酯), 5'-(三氢二磷酸酯);5'-二磷酰鸟苷 3'-二磷酸酯;
英文别名:
[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-[(oxi do-phosphonatooxy-phosphoryl)oxymethyl]tetrahydrofuran-3-yl]oxy-o xido-phosphoryl] phosphate;Guanosine-5'-diphosphate-3'-diphosphate;O3',O5'-Di-p-toluoyl-thymidin;O3',O5'-di-p-toluoyl-thymidine;Guanosin-3',5'-Bisdiphosphat;O3',O5'-bis-trihydroxydiphosphoryl-guanosine;3',5'-di-O-toluoylthymidine;Guanosin-3'-diphosphat-5'-diphosphat;O3',O5'-bis-(4-methyl-benzoyl)-thymidine;Guanosin-3',5'-dipyrophosphat;Guanosine 3',5'-bispyrophosphate;Guanosine 3',5'-dipyrophosphate;Guanosine 3'-diphosphate 5'-diphosphate;Guanosine 5',3'-bisdiphosphate;Guanosine 5'-diphosphate 3'-diphosphate;Guanosine tetraphosphate;Magic Spot I;guanosine 5'-diphosphate,3'-diphosphate;[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] phosphono hydrogen phosphate;DTXSID50955132;3'-Diphosphate 5'-Diphosphate, Guanosine;guanosine tetraphosphate;ppGpp;C01228;GUANOSINE-5',3'-TETRAPHOSPHATE;DB04022;33503-72-9;Guanosine 5'-(trihydrogen diphosphate), mono(trihydrogen diphosphate) (ester);SCHEMBL234673;G4P;32452-17-8;guanosine 3',5'-bis(diphosphate);guanosine 3',5'-bis(trihydrogen diphosphate);CHEBI:17633;9-{3,5-Bis-O-[hydroxy(phosphonooxy)phosphoryl]pentofuranosyl}-2-imino-3,9-dihydro-2H-purin-6-ol;NS00070408;Q27102490;Guanosine 3',5'-bisdiphosphate;

标识符

InChIKey:
BUFLLCUFNHESEH-UUOKFMHZSA-N
Inchi:
1S/C10H17N5O17P4/c11-10-13-7-4(8(17)14-10)12-2-15(7)9-5(16)6(30-36(26,27)32-34(21,22)23)3(29-9)1-28-35(24,25)31-33(18,19)20/h2-3,5-6,9,16H,1H2,(H,24,25)(H,26,27)(H2,18,19,20)(H2,21,22,23)(H3,11,13,14,17)/t3-,5-,6-,9-/m1/s1
SMILES:
P(=O)(O)(OP(=O)(O)O)O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@H]([C@@H]1O)N1C=NC2C(N=C(N)NC1=2)=O

[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-[(oxi do-phosphonatooxy-phosphoryl)oxymethyl]tetrahydrofuran-3-yl]oxy-o xido-phosphoryl] phosphate(32452-17-8)物化性质

实验特性

  • 溶解度 : Very 微溶 (0.97 g/L) (25 ºC),
  • 密度 : 2.85±0.1 g/cm3 (20 ºC 760 Torr),

计算特性

  • 精确分子量 : 602.95699208g/mol
  • 氢键供体数量 : 9
  • 氢键受体数量 : 18
  • 可旋转化学键数量 : 10
  • 同位素质量 : 602.95699208g/mol
  • 重原子数量 : 36
  • 复杂度 : 1090
  • 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) : -7.7
  • 拓扑分子极性表面积 : 341Ų

[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-[(oxi do-phosphonatooxy-phosphoryl)oxymethyl]tetrahydrofuran-3-yl]oxy-o xido-phosphoryl] phosphate(32452-17-8)推荐厂家 更多厂家(2)

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金锦乐(湖南)化学有限公司 金锦乐 1226360695
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杭州六可生物科技有限公司 15658003402
0086-571-86912261
Susan 3671025517
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[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-[(oxi do-phosphonatooxy-phosphoryl)oxymethyl]tetrahydrofuran-3-yl]oxy-o xido-phosphoryl] phosphate(32452-17-8)相关文献