Glycoside
GD066454
Name:
NoneFormula:
C15H21O7N3Smiles:
O=C(Nc1ncccc1N1CCOCC1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1ncccc1N1CCOCC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -2.5 | Num_rotatable_bonds: | 7 |
| MolWt: | 355.35 | Num_heavy_atoms: | 25 |
| TPSA: | 152.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD31822
Formula: C9H13ON3
Smiles:
Nc1ncccc1N1CCOCC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 1 |
| MolWt: | 179.22 | Num_heavy_atoms: | 13 |
| TPSA: | 51.38 | NumAromaticRings: | 1 |
