2567941-52-8 ((Biotin-16-dCTP)

CAS号:
2567941-52-8
英文名称:
Biotin-16-dCTP
分子式:
C32H51N8O17P3S
分子量:
944.777029275894

Biotin-16-dCTP(2567941-52-8)名称与标识符

名称

英文别名:
Biotin-16-dCTP;

标识符

InChIKey:
ZASUZJWVLSBCNG-AYPTXYQFSA-N
Inchi:
1S/C32H51N8O17P3S/c33-30-20(17-40(32(46)39-30)28-16-22(41)23(55-28)18-54-59(50,51)57-60(52,53)56-58(47,48)49)8-6-14-35-27(44)12-7-15-36-25(42)10-2-1-5-13-34-26(43)11-4-3-9-24-29-21(19-61-24)37-31(45)38-29/h17,21-24,28-29,41H,1-5,7,9-16,18-19H2,(H,34,43)(H,35,44)(H,36,42)(H,50,51)(H,52,53)(H2,33,39,46)(H2,37,38,45)(H2,47,48,49)/t21-,22-,23+,24-,28+,29-/m0/s1
SMILES:
C([C@@H]1SC[C@]2([H])NC(N[C@@]21[H])=O)CCCC(=O)NCCCCCC(=O)NCCCC(=O)NCC#CC1C(=NC(N([C@H]2C[C@@H]([C@H](O2)COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O)C=1)=O)N

Biotin-16-dCTP(2567941-52-8)物化性质

实验特性

  • 酸度系数(pKa) : 0.973±0.50(predicted)
  • 密度 : 1.771±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)