Glycoside
GD040529
Name:
(2r,3r,4s,5r)-2-(3-amino-5-methyl-1,4,5,6,8-pentaazaacenaphthylen-1(5h)-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diolFormula:
C13H16O4N6Smiles:
CN1N=C(N)c2cn([C@H]3O[C@H](CO)[C@H](O)[C@@H]3O)c3ncnc1c23Aglycone:
CN1N=C(N)C2=C[N]c3ncnc1c32Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -1.89 | Num_rotatable_bonds: | 2 |
| MolWt: | 320.31 | Num_heavy_atoms: | 23 |
| TPSA: | 142.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD01721
Formula: C8H7N6
Smiles:
CN1N=C(N)C2=C[N]c3ncnc1c32| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 187.19 | Num_heavy_atoms: | 14 |
| TPSA: | 81.5 | NumAromaticRings: | 1 |
