Glycoside
GD077180
Name:
NoneFormula:
C17H17O6N5Smiles:
O=[N+]([O-])c1ccc(Cc2ncnc3c2ncn3[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1Aglycone:
O=[N+]([O-])c1ccc(Cc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.35 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 387.35 | Num_heavy_atoms: | 28 |
| TPSA: | 156.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD35459
Formula: C12H8O2N5
Smiles:
O=[N+]([O-])c1ccc(Cc2ncnc3c2N=C[N]3)cc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.08 |
| AlogP: | 1.88 | Num_rotatable_bonds: | 3 |
| MolWt: | 254.23 | Num_heavy_atoms: | 19 |
| TPSA: | 95.38 | NumAromaticRings: | 2 |
