| PDB CCD ID: | 0G0 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C12 H14 F N5 O6 |
| InChI: | InChI=1S/C12H14FN5O6/c13-6-3-17(12(23)14-10(6)22)1-5-2-18(16-15-5)11-9(21)8(20)7(4-19)24-11/h2-3,7-9,11,19-21H,1,4H2,(H,14,22,23)/t7-,8-,9+,11+/m0/s1 |
| InChIKey: | MGDQWTKSRPEJPQ-WYOJIJJFSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.370 | OC[CH]1O[CH]([CH](O)[CH]1O)n2cc(CN3C=C(F)C(=O)NC3=O)nn2 | | OpenEye OEToolkits 1.7.6 | c1c(nnn1C2C(C(C(O2)CO)O)O)CN3C=C(C(=O)NC3=O)F | | ACDLabs 12.01 | FC1=CN(C(=O)NC1=O)Cc2nnn(c2)C3OC(C(O)C3O)CO | | OpenEye OEToolkits 1.7.6 | c1c(nnn1[C@H]2[C@@H]([C@H]([C@@H](O2)CO)O)O)CN3C=C(C(=O)NC3=O)F | | CACTVS 3.370 | OC[C@@H]1O[C@H]([C@H](O)[C@H]1O)n2cc(CN3C=C(F)C(=O)NC3=O)nn2 |
|
| Name: | 1-{[1-(alpha-L-arabinofuranosyl)-1H-1,2,3-triazol-4-yl]methyl}-5-fluoro-2,4-dioxo-1,2,3,4-tetrahydropyrimidine |
| ZINC: | ZINC000095884381 |
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