Glycoside
GD089499
Name:
NoneFormula:
C22H31O6N4Smiles:
CN1CCN(c2cc(Nc3ccc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3)cc[nH+]2)CC1Aglycone:
CN1CCN(c2cc(Nc3ccc(O)cc3)cc[nH+]2)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 6 |
| MolWt: | 447.51 | Num_heavy_atoms: | 32 |
| TPSA: | 132.03 | NumAromaticRings: | 2 |
Unique Aglycone
AD39047
Formula: C16H21ON4
Smiles:
CN1CCN(c2cc(Nc3ccc(O)cc3)cc[nH+]2)CC1| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.31 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 3 |
| MolWt: | 285.37 | Num_heavy_atoms: | 21 |
| TPSA: | 52.88 | NumAromaticRings: | 2 |
