Glycoside
GD083622
Name:
NoneFormula:
C21H23O6N3Smiles:
O=C(NCc1nc2ccccc2n1Cc1ccccc1)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
NCc1nc2ccccc2n1Cc1ccccc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 9 |
| MolWt: | 413.43 | Num_heavy_atoms: | 30 |
| TPSA: | 144.91 | NumAromaticRings: | 3 |
Unique Aglycone
AD37297
Formula: C15H15N3
Smiles:
NCc1nc2ccccc2n1Cc1ccccc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 2.54 | Num_rotatable_bonds: | 3 |
| MolWt: | 237.31 | Num_heavy_atoms: | 18 |
| TPSA: | 43.84 | NumAromaticRings: | 3 |
