Molecular Formula: C23H20N6NaO12P3--
Molecular weight: 688.348953
InChi: InChI=1S/C23H23N6O12P3.Na/c24-22-21-14(7-8-15-4-3-6-17(28-15)16-5-1-2-9-25-16)11-29(23(21)27-13-26-22)20-10-18(30)19(39-20)12-38-43(34,35)41-44(36,37)40-42(31,32)33;/h1-6,9,11,13,18-20,30H,10,12H2,(H,34,35)(H,36,37)(H2,24,26,27)(H2,31,32,33);/q;+1/p-3/t18-,19+,20+;/m0./s1
InChi Key: QBSPZHCNAMBQAA-WUHLWKCASA-K
SMILES: c12n([C@@H]3O[C@@H]([C@H](C3)O)COP(=O)(OP(=O)(OP(=O)(O)[O-])[O-])[O-])cc(c1c(ncn2)N)C#Cc1nc(c2ncccc2)ccc1.[Na+]
Chemical Name
sodium 7-[(2'',2'''-bipyridin-6''-yl)ethynyl]-7-deaza-2'-deoxyadenosine 5'-O-triphosphate
sodium 7-[(2'',2'''-bipyridin-6''-yl)ethynyl]-7-deaza-2'-deoxyadenosine 5'-O-triphosphate