Glycoside
GD022809
Name:
NoneFormula:
C24H50O9N8Smiles:
NCCN[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:
NCCNC1C(O)C(NC(=O)C(O)CCN)CC(N)C1OC1OC(CN)CCC1NSugarmoiety:
NC1C(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 3 |
| HBD: | 18 | FractionCSP3: | 0.96 |
| AlogP: | -6.84 | Num_rotatable_bonds: | 13 |
| MolWt: | 594.71 | Num_heavy_atoms: | 41 |
| TPSA: | 315.09 | NumAromaticRings: | 0 |
Unique Aglycone
AD15415
Formula: C18H39O5N7
Smiles:
NCCNC1C(O)C(NC(=O)C(O)CCN)CC(N)C1OC1OC(CN)CCC1N| HBA: | 12 | RingCount: | 2 |
| HBD: | 14 | FractionCSP3: | 0.94 |
| AlogP: | -4.63 | Num_rotatable_bonds: | 10 |
| MolWt: | 433.55 | Num_heavy_atoms: | 30 |
| TPSA: | 230.15 | NumAromaticRings: | 0 |
