Glycoside
GD066298
Name:
NoneFormula:
C15H20O6N4Smiles:
CCc1nnc2ccc(CNC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)cn12Aglycone:
CCc1nnc2ccc(CN)cn12Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -2.45 | Num_rotatable_bonds: | 8 |
| MolWt: | 352.35 | Num_heavy_atoms: | 25 |
| TPSA: | 157.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD31772
Formula: C9H12N4
Smiles:
CCc1nnc2ccc(CN)cn12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.75 | Num_rotatable_bonds: | 2 |
| MolWt: | 176.22 | Num_heavy_atoms: | 13 |
| TPSA: | 56.21 | NumAromaticRings: | 2 |
