Glycoside
GD002470
Name:
NoneFormula:
C18H20O6N6Smiles:
Cc1c(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cccc1[N+](=O)[O-]Aglycone:
Cc1c(CNc2ncnc3c2N=C[N]3)cccc1[N+](=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.39 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 6 |
| MolWt: | 416.39 | Num_heavy_atoms: | 30 |
| TPSA: | 168.69 | NumAromaticRings: | 3 |
Unique Aglycone
AD02358
Formula: C13H11O2N6
Smiles:
Cc1c(CNc2ncnc3c2N=C[N]3)cccc1[N+](=O)[O-]| HBA: | 8 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.15 |
| AlogP: | 2.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 283.27 | Num_heavy_atoms: | 21 |
| TPSA: | 107.41 | NumAromaticRings: | 2 |
