Glycoside
GD091299
Name:
NoneFormula:
C18H21O7N4ClSmiles:
COCOc1ccc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1ClAglycone:
COCOc1ccc(NC2=C(C(N)=O)N=C[N]2)cc1ClSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.41 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 8 |
| MolWt: | 428.83 | Num_heavy_atoms: | 29 |
| TPSA: | 161.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD39824
Formula: C13H12O3N4Cl
Smiles:
COCOc1ccc(NC2=C(C(N)=O)N=C[N]2)cc1Cl| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | 1.04 | Num_rotatable_bonds: | 6 |
| MolWt: | 295.71 | Num_heavy_atoms: | 20 |
| TPSA: | 100.04 | NumAromaticRings: | 1 |
