Glycoside
GD004953
Name:
NoneFormula:
C9H11O6N2ISmiles:
O=C(O)c1nn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1IAglycone:
O=C(O)C1=N[N]C=C1ISugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -1.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 370.1 | Num_heavy_atoms: | 18 |
| TPSA: | 125.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD04260
Formula: C4H2O2N2I
Smiles:
O=C(O)C1=N[N]C=C1I| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 1 |
| MolWt: | 236.98 | Num_heavy_atoms: | 9 |
| TPSA: | 63.76 | NumAromaticRings: | 0 |
