Glycoside
GD082605
Name:
NoneFormula:
C20H29O7N3Smiles:
CC(=O)N[C@@H]1[C@H](Oc2ccc(N3CCN(C(C)=O)CC3)cc2)O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CC(=O)N1CCN(c2ccc(O)cc2)CC1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -1.32 | Num_rotatable_bonds: | 5 |
| MolWt: | 423.47 | Num_heavy_atoms: | 30 |
| TPSA: | 131.8 | NumAromaticRings: | 1 |
Unique Aglycone
AD37080
Formula: C12H16O2N2
Smiles:
CC(=O)N1CCN(c2ccc(O)cc2)CC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.42 |
| AlogP: | 1.06 | Num_rotatable_bonds: | 1 |
| MolWt: | 220.27 | Num_heavy_atoms: | 16 |
| TPSA: | 43.78 | NumAromaticRings: | 1 |
