β-烟酰胺腺嘌呤二核苷酸磷酸钠盐(1184-16-3)红外图谱(IR1)
分子式:C21H29N7NaO17P3
分子量: 767.41
InChI:InChI=1/C21H28N7O17P3.Na/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32;/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39);/q;+1/p-1/t10-,11-,13-,14-,15-,16-,20-,21-;/s3
InChIKey: JNUMDLCHLVUHFS-MYYNGNHWNA-M
Smiles:[C@H]1(O[C@H](COP([O-])(=O)OP([O-])(=O)OC[C@@H]2[C@@H](O)[C@@H](O)[C@H]([N+]3C=CC=C(C(=O)N)C=3)O2)[C@@H](O)[C@H]1OP(=O)(O)O)N1C=NC2C(N)=NC=NC1=2.[Na+] |&1:0,2,14,15,17,19,30,32,r|