Glycoside
GD002768
Name:
NoneFormula:
C9H12O5N3ISmiles:
NC(=O)c1nn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1IAglycone:
NC(=O)C1=N[N]C=C1ISugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.8 | Num_rotatable_bonds: | 3 |
| MolWt: | 369.12 | Num_heavy_atoms: | 18 |
| TPSA: | 130.83 | NumAromaticRings: | 1 |
Unique Aglycone
AD02604
Formula: C4H3ON3I
Smiles:
NC(=O)C1=N[N]C=C1I| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 1 |
| MolWt: | 235.99 | Num_heavy_atoms: | 9 |
| TPSA: | 69.55 | NumAromaticRings: | 0 |
