Glycoside
GD090376
Name:
NoneFormula:
C23H27O6N3Smiles:
O=C(C(=O)N1CCN=C1CN(Cc1ccccc1)c1ccccc1)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 10 |
| MolWt: | 441.48 | Num_heavy_atoms: | 32 |
| TPSA: | 133.9 | NumAromaticRings: | 2 |
Unique Aglycone
AD39330
Formula: C17H19N3
Smiles:
c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.24 |
| AlogP: | 2.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 265.36 | Num_heavy_atoms: | 20 |
| TPSA: | 27.63 | NumAromaticRings: | 2 |
