Glycoside
GD088243
Name:
NoneFormula:
C21H26O7N4Smiles:
O=C(Nc1cncnc1[C@@H]1CN(Cc2ccccc2)CCO1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1cncnc1C1CN(Cc2ccccc2)CCO1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 9 |
| MolWt: | 446.46 | Num_heavy_atoms: | 32 |
| TPSA: | 165.34 | NumAromaticRings: | 2 |
Unique Aglycone
AD38623
Formula: C15H18ON4
Smiles:
Nc1cncnc1C1CN(Cc2ccccc2)CCO1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.63 | Num_rotatable_bonds: | 3 |
| MolWt: | 270.34 | Num_heavy_atoms: | 20 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
