Glycoside
GD071402
Name:
NoneFormula:
C20H30O6N2Smiles:
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1N(C)C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
CNC1CN(Cc2ccccc2)CCC1CSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -1.0 | Num_rotatable_bonds: | 8 |
| MolWt: | 394.47 | Num_heavy_atoms: | 28 |
| TPSA: | 121.54 | NumAromaticRings: | 1 |
Unique Aglycone
AD33577
Formula: C14H22N2
Smiles:
CNC1CN(Cc2ccccc2)CCC1C| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.57 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 218.34 | Num_heavy_atoms: | 16 |
| TPSA: | 15.27 | NumAromaticRings: | 1 |
