Glycoside
GD029683
Name:
NoneFormula:
C13H17O7N3Smiles:
O=C(Nc1ccccn1)C(=O)N[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
NC(=O)C(=O)Nc1ccccn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -3.06 | Num_rotatable_bonds: | 3 |
| MolWt: | 327.29 | Num_heavy_atoms: | 23 |
| TPSA: | 161.24 | NumAromaticRings: | 1 |
Unique Aglycone
AD19285
Formula: C7H7O2N3
Smiles:
NC(=O)C(=O)Nc1ccccn1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.49 | Num_rotatable_bonds: | 1 |
| MolWt: | 165.15 | Num_heavy_atoms: | 12 |
| TPSA: | 85.08 | NumAromaticRings: | 1 |
