Glycoside
GD082623
Name:
NoneFormula:
C17H18O7N6Smiles:
O=c1[nH]cnc2c1nc(/N=N/Cc1ccc(O)cc1O)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
O=c1[nH]cnc2c1N=C(N=NCc1ccc(O)cc1O)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 5 |
| MolWt: | 418.37 | Num_heavy_atoms: | 30 |
| TPSA: | 198.67 | NumAromaticRings: | 3 |
Unique Aglycone
AD37085
Formula: C12H9O3N6
Smiles:
O=c1[nH]cnc2c1N=C(N=NCc1ccc(O)cc1O)[N]2| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.08 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 2 |
| MolWt: | 285.24 | Num_heavy_atoms: | 21 |
| TPSA: | 137.39 | NumAromaticRings: | 2 |
