Glycoside
GD022772
Name:
NoneFormula:
C11H13O6N5Smiles:
NC(=O)c1nn(C2O[C@H](CO)[C@H](O)[C@H]2O)c2nc[nH]c(=O)c12Aglycone:
NC(=O)C1=N[N]c2nc[nH]c(=O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | -3.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 311.25 | Num_heavy_atoms: | 22 |
| TPSA: | 176.58 | NumAromaticRings: | 2 |
Unique Aglycone
AD15401
Formula: C6H4O2N5
Smiles:
NC(=O)C1=N[N]c2nc[nH]c(=O)c21| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 1 |
| MolWt: | 178.13 | Num_heavy_atoms: | 13 |
| TPSA: | 115.3 | NumAromaticRings: | 1 |
