494870-49-4 ((Cytidine 5'-(tetrahydrogen triphosphate), 5-hydroxy-)

CAS号:
494870-49-4
英文名称:
Cytidine 5'-(tetrahydrogen triphosphate), 5-hydroxy-
分子式:
C9H16N3O15P3
分子量:
499.155725479126

Cytidine 5'-(tetrahydrogen triphosphate), 5-hydroxy-(494870-49-4)名称与标识符

名称

英文别名:
Cytidine 5'-(tetrahydrogen triphosphate), 5-hydroxy-;Cytidine 5'-(tetrahydrogen triphosphate), 5-hydroxy- (9CI);

标识符

InChIKey:
DMFODUNDODUQKK-UAKXSSHOSA-N
Inchi:
1S/C9H16N3O15P3/c10-7-3(13)1-12(9(16)11-7)8-6(15)5(14)4(25-8)2-24-29(20,21)27-30(22,23)26-28(17,18)19/h1,4-6,8,13-15H,2H2,(H,20,21)(H,22,23)(H2,10,11,16)(H2,17,18,19)/t4-,5-,6-,8-/m1/s1
SMILES:
C(OP(=O)(O)OP(O)(=O)OP(O)(O)=O)[C@H]1O[C@@H](N2C=C(O)C(N)=NC2=O)[C@H](O)[C@@H]1O

Cytidine 5'-(tetrahydrogen triphosphate), 5-hydroxy-(494870-49-4)物化性质

实验特性

  • PSA : 288.43
  • 沸点 : 879.0±75.0 °C(Predicted)
  • 酸度系数(pKa) : 0.97±0.50(Predicted)
  • 密度 : 2.62±0.1 g/cm3(Predicted)

计算特性

  • 精确分子量 : 498.97948