Glycoside
GD001955
Name:
NoneFormula:
C19H21O5N5Smiles:
Cc1ccc(-c2c(C(N)=O)c3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1Aglycone:
Cc1ccc(C2=C(C(N)=O)c3c(N)ncnc3[N]2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.32 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 399.41 | Num_heavy_atoms: | 29 |
| TPSA: | 169.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD01904
Formula: C14H12ON5
Smiles:
Cc1ccc(C2=C(C(N)=O)c3c(N)ncnc3[N]2)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.07 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 2 |
| MolWt: | 266.28 | Num_heavy_atoms: | 20 |
| TPSA: | 108.99 | NumAromaticRings: | 2 |
