Glycoside
GD078771
Name:
NoneFormula:
C16H15O7N5Smiles:
O=[N+]([O-])c1cccc(Oc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
O=[N+]([O-])c1cccc(Oc2ncnc3c2N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.31 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 5 |
| MolWt: | 389.32 | Num_heavy_atoms: | 28 |
| TPSA: | 165.89 | NumAromaticRings: | 3 |
Unique Aglycone
AD36203
Formula: C11H6O3N5
Smiles:
O=[N+]([O-])c1cccc(Oc2ncnc3c2N=C[N]3)c1| HBA: | 8 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 256.2 | Num_heavy_atoms: | 19 |
| TPSA: | 104.61 | NumAromaticRings: | 2 |
