Glycoside
GD098917
Name:
NoneFormula:
C23H33O6N4Smiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccc2ccc(N3CC[NH+](CC4CC4)CC3)n2c1Aglycone:
NC(=O)c1ccc2ccc(N3CC[NH+](CC4CC4)CC3)n2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.61 |
| AlogP: | -2.42 | Num_rotatable_bonds: | 6 |
| MolWt: | 461.54 | Num_heavy_atoms: | 33 |
| TPSA: | 131.34 | NumAromaticRings: | 2 |
Unique Aglycone
AD42085
Formula: C17H23ON4
Smiles:
NC(=O)c1ccc2ccc(N3CC[NH+](CC4CC4)CC3)n2c1| HBA: | 5 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | 0.15 | Num_rotatable_bonds: | 4 |
| MolWt: | 299.4 | Num_heavy_atoms: | 22 |
| TPSA: | 55.18 | NumAromaticRings: | 2 |
