Glycoside
GD073343
Name:
NoneFormula:
C17H22O7N4Smiles:
O=C(Nc1ccc2nnc(C3CCOCC3)n2c1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1ccc2nnc(C3CCOCC3)n2c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 7 |
| MolWt: | 394.38 | Num_heavy_atoms: | 28 |
| TPSA: | 166.51 | NumAromaticRings: | 2 |
Unique Aglycone
AD34023
Formula: C11H14ON4
Smiles:
Nc1ccc2nnc(C3CCOCC3)n2c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 1 |
| MolWt: | 218.26 | Num_heavy_atoms: | 16 |
| TPSA: | 65.44 | NumAromaticRings: | 2 |
