Adenosine 5'-(trihydrogen diphosphate), cyclic 2',3'-(hydrogen phosphate), 5'-5'-ester with 3-(aminocarbonyl)-1-beta-D-ribofuranosylpyridinium hydroxide, inner salt

化合物标识与属性

CAS

62640-02-2

PubChem CID

124201496

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]4[C@H]([C@@H](O3)N5C=NC6=C(N=CN=C65)N)OP(=O)(O4)O)O)O)C(=O)N

Canonical SMILES

NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)([O-])OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@@H]4OP(=O)(O)O[C@@H]43)[C@@H](O)[C@H]2O)c1