Glycoside
GD083793
Name:
NoneFormula:
C18H22O7N4Smiles:
COC(=O)c1cc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)ccc1CAglycone:
COC(=O)c1cc(NC2=C(C(N)=O)N=C[N]2)ccc1CSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.39 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 6 |
| MolWt: | 406.4 | Num_heavy_atoms: | 29 |
| TPSA: | 169.16 | NumAromaticRings: | 2 |
Unique Aglycone
AD37360
Formula: C13H13O3N4
Smiles:
COC(=O)c1cc(NC2=C(C(N)=O)N=C[N]2)ccc1C| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.15 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 273.27 | Num_heavy_atoms: | 20 |
| TPSA: | 107.88 | NumAromaticRings: | 1 |
