PD131703

Compound Identifiers & Properties

PubChem CID

163323626

SMILES

[2H]C([2H])([2H])C(CC(=O)O)(CC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)([O-])[O-])O)O.[NH4+].[NH4+].[NH4+].[NH4+]

Canonical SMILES

[2H]C([2H])([2H])C(O)(CC(=O)O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[NH4+]