Glycoside
GD092261
Name:
NoneFormula:
C18H18O5N7ClSmiles:
Nc1nc2c(nc(/N=N/Cc3ccc(Cl)cc3)n2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)[nH]1Aglycone:
Nc1nc2c(c(=O)[nH]1)N=C(N=NCc1ccc(Cl)cc1)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | 0.25 | Num_rotatable_bonds: | 5 |
| MolWt: | 435.83 | Num_heavy_atoms: | 30 |
| TPSA: | 184.23 | NumAromaticRings: | 3 |
Unique Aglycone
AD40263
Formula: C13H9ON7Cl
Smiles:
Nc1nc2c(c(=O)[nH]1)N=C(N=NCc1ccc(Cl)cc1)[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.08 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 2 |
| MolWt: | 302.7 | Num_heavy_atoms: | 21 |
| TPSA: | 122.95 | NumAromaticRings: | 2 |
