Glycoside
GD000165
Name:
NoneFormula:
C19H19O5N8ClSmiles:
COc1ccc(Cl)c(CNc2nc(N=[N+]=[N-])nc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c1Aglycone:
COc1ccc(Cl)c(CNc2nc(N=[N+]=[N-])nc3c2N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.39 |
| AlogP: | 1.65 | Num_rotatable_bonds: | 7 |
| MolWt: | 462.85 | Num_heavy_atoms: | 32 |
| TPSA: | 183.54 | NumAromaticRings: | 3 |
Unique Aglycone
AD00201
Formula: C14H10ON8Cl
Smiles:
COc1ccc(Cl)c(CNc2nc(N=[N+]=[N-])nc3c2N=C[N]3)c1| HBA: | 9 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.15 |
| AlogP: | 3.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 329.73 | Num_heavy_atoms: | 23 |
| TPSA: | 122.26 | NumAromaticRings: | 2 |
