| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C2N=C1N(C(=C(N=C1C(=O)N2)C)C)CC(O)C(O)C(O)CO |
| SMILES_CANONICAL | CACTVS | 3.341 | CC1=C(C)N(C[C@H](O)[C@H](O)[C@H](O)CO)C2=NC(=O)NC(=O)C2=N1 |
| SMILES | CACTVS | 3.341 | CC1=C(C)N(C[CH](O)[CH](O)[CH](O)CO)C2=NC(=O)NC(=O)C2=N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1=C(N(C2=NC(=O)NC(=O)C2=N1)C[C@@H]([C@@H]([C@@H](CO)O)O)O)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1=C(N(C2=NC(=O)NC(=O)C2=N1)CC(C(C(CO)O)O)O)C |
| InChI | InChI | 1.03 | InChI=1S/C13H18N4O6/c1-5-6(2)17(3-7(19)10(21)8(20)4-18)11-9(14-5)12(22)16-13(23)15-11/h7-8,10,18-21H,3-4H2,1-2H3,(H,16,22,23)/t7-,8+,10-/m0/s1 |
| InChIKey | InChI | 1.03 | SXDXRJZUAJBNFL-XKSSXDPKSA-N |
