8-Azido-9-{5-O-[hydroxy({hydroxy[(hydroxyphosphinato)oxy]phosphoryl}oxy)phosphoryl]-2,3-O-(2,3,5-trinitrocyclohexa-2,4-diene-1,1-diyl)pentofuranosyl}-9H-purin-6-amine

化合物标识与属性

CAS

120218-67-9

PubChem CID

138397606

SMILES

C1C(=CC(=C(C12O[C@@H]3[C@H](O[C@H]([C@@H]3O2)N4C5=NC=NC(=C5N=C4N=[N+]=[N-])N)COP(=O)(O)OP(=O)(O)OP(=O)(O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Canonical SMILES

[N-]=[N+]=Nc1nc2c(N)ncnc2n1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)([O-])O)[C@H]2OC3(CC([N+](=O)[O-])=CC([N+](=O)[O-])=C3[N+](=O)[O-])O[C@H]21