Glycoside
GD003998
Name:
NoneFormula:
C23H47O9N7Smiles:
CN[C@H]1[C@H](O[C@@H]2O[C@H](CN)CC[C@H]2N)[C@@H](N)C[C@@H](NC(=O)[C@H](O)CCN)[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](N)[C@H]1OAglycone:
CNC1C(O)C(NC(=O)C(O)CCN)CC(N)C1OC1OC(CN)CCC1NSugarmoiety:
NC1C(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 3 |
| HBD: | 16 | FractionCSP3: | 0.96 |
| AlogP: | -6.17 | Num_rotatable_bonds: | 11 |
| MolWt: | 565.67 | Num_heavy_atoms: | 39 |
| TPSA: | 289.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD03555
Formula: C17H36O5N6
Smiles:
CNC1C(O)C(NC(=O)C(O)CCN)CC(N)C1OC1OC(CN)CCC1N| HBA: | 11 | RingCount: | 2 |
| HBD: | 12 | FractionCSP3: | 0.94 |
| AlogP: | -3.96 | Num_rotatable_bonds: | 8 |
| MolWt: | 404.51 | Num_heavy_atoms: | 28 |
| TPSA: | 204.13 | NumAromaticRings: | 0 |
