Glycoside
GD059789
Name:
NoneFormula:
C16H18O6N2Smiles:
Cc1ccc2cccnc2c1NC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
Cc1ccc2cccnc2c1NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.31 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 6 |
| MolWt: | 334.33 | Num_heavy_atoms: | 24 |
| TPSA: | 139.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD29559
Formula: C10H10N2
Smiles:
Cc1ccc2cccnc2c1N| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 0 |
| MolWt: | 158.2 | Num_heavy_atoms: | 12 |
| TPSA: | 38.91 | NumAromaticRings: | 2 |
