Glycoside
GD081883
Name:
NoneFormula:
C19H24O7N4Smiles:
Cn1ncc2c1CN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)C[C@H]2COc1cccnc1Aglycone:
Cn1ncc2c1CNCC2COc1cccnc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -2.04 | Num_rotatable_bonds: | 8 |
| MolWt: | 420.42 | Num_heavy_atoms: | 30 |
| TPSA: | 158.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD36788
Formula: C13H16ON4
Smiles:
Cn1ncc2c1CNCC2COc1cccnc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.38 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 3 |
| MolWt: | 244.3 | Num_heavy_atoms: | 18 |
| TPSA: | 51.97 | NumAromaticRings: | 2 |
