2',3'-O-[(1r,6r)-2,4,6-Trinitrocyclohexa-2,4-Diene-1,1-Diyl]adenosine 5'-(Trihydrogen Diphosphate)

化合物标识与属性

PubChem CID

44629628

SMILES

C1=C(C=C([C@]2(C1[N+](=O)[O-])O[C@@H]3[C@H](O[C@H]([C@@H]3O2)N4C=NC5=C(N=CN=C54)N)COP(=O)(O)OP(=O)(O)O)[N+](=O)[O-])[N+](=O)[O-]

Canonical SMILES

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@H]2O[C@]3(O[C@H]21)C([N+](=O)[O-])=CC([N+](=O)[O-])=CC3[N+](=O)[O-]