Glycoside
GD037641
Name:
1-{[1-(alpha-l-arabinofuranosyl)-1h-1,2,3-triazol-4-yl]methyl}-5-fluoro-2,4-dioxo-1,2,3,4-tetrahydropyrimidineFormula:
C12H14O6N5FSmiles:
O=c1[nH]c(=O)n(Cc2cn([C@H]3O[C@H](CO)[C@H](O)[C@@H]3O)nn2)cc1FAglycone:
O=c1[nH]c(=O)n(CC2=C[N]N=N2)cc1FSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -3.07 | Num_rotatable_bonds: | 4 |
| MolWt: | 343.27 | Num_heavy_atoms: | 24 |
| TPSA: | 155.49 | NumAromaticRings: | 2 |
Unique Aglycone
AD19554
Formula: C7H5O2N5F
Smiles:
O=c1[nH]c(=O)n(CC2=C[N]N=N2)cc1F| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 2 |
| MolWt: | 210.15 | Num_heavy_atoms: | 15 |
| TPSA: | 93.68 | NumAromaticRings: | 1 |
