Pyridinium, 3-(aminocarbonyl)-1-[5-O-[hydroxy(phosphonooxy)phosphinyl]-I(2)-D-ribofuranosyl]-, inner salt, Pa(2)a5a(2)-ester with 3-(2-O-phosphono-I(2)-D-ribofuranosyl)-3H-imidazo[2,1-i]purine, monosodium salt

化合物标识与属性

CAS

104809-28-1

PubChem CID

177839238

SMILES

C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C4N=CN6C5=NC=C6)OP(=O)(O)O)O)O)O)C(=O)N.[Na]

Canonical SMILES

NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)([O-])OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c4ncn4ccnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.[Na]