Glycoside
GD081493
Name:
NoneFormula:
C19H25O8N3Smiles:
O=C(Nc1cccnc1)[C@@H]1C[C@H]2OCC[C@H]2N(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)C1Aglycone:
O=C(Nc1cccnc1)C1CNC2CCOC2C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -2.33 | Num_rotatable_bonds: | 7 |
| MolWt: | 423.42 | Num_heavy_atoms: | 30 |
| TPSA: | 169.52 | NumAromaticRings: | 1 |
Unique Aglycone
AD36688
Formula: C13H17O2N3
Smiles:
O=C(Nc1cccnc1)C1CNC2CCOC2C1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 2 |
| MolWt: | 247.3 | Num_heavy_atoms: | 18 |
| TPSA: | 63.25 | NumAromaticRings: | 1 |
