Glycoside
GD065090
Name:
NoneFormula:
C15H17O7N3Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cnc2ccccn2c1=OAglycone:
NC(=O)c1cnc2ccccn2c1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -2.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 351.32 | Num_heavy_atoms: | 25 |
| TPSA: | 153.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD31301
Formula: C9H7O2N3
Smiles:
NC(=O)c1cnc2ccccn2c1=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 1 |
| MolWt: | 189.17 | Num_heavy_atoms: | 14 |
| TPSA: | 77.46 | NumAromaticRings: | 2 |
