| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(c1ncn(c1O)C2OC(C(O)C2O)CO)N |
| InChI | InChI | 1.03 | InChI=1S/C9H13N3O6/c10-7(16)4-8(17)12(2-11-4)9-6(15)5(14)3(1-13)18-9/h2-3,5-6,9,13-15,17H,1H2,(H2,10,16)/t3-,5-,6-,9-/m1/s1 |
| InChIKey | InChI | 1.03 | HZQDCMWJEBCWBR-UUOKFMHZSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1O |
| SMILES | CACTVS | 3.370 | NC(=O)c1ncn([CH]2O[CH](CO)[CH](O)[CH]2O)c1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | c1nc(c(n1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)N |
| SMILES | OpenEye OEToolkits | 1.7.2 | c1nc(c(n1C2C(C(C(O2)CO)O)O)O)C(=O)N |
