Glycoside
GD090644
Name:
NoneFormula:
C19H22O6N5ClSmiles:
CN(C)C(=O)c1cc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)ccc1ClAglycone:
CN(C)C(=O)c1cc(NC2=C(C(N)=O)N=C[N]2)ccc1ClSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.39 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 439.86 | Num_heavy_atoms: | 30 |
| TPSA: | 163.17 | NumAromaticRings: | 2 |
Unique Aglycone
AD39443
Formula: C14H13O2N5Cl
Smiles:
CN(C)C(=O)c1cc(NC2=C(C(N)=O)N=C[N]2)ccc1Cl| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.15 |
| AlogP: | 0.75 | Num_rotatable_bonds: | 4 |
| MolWt: | 306.73 | Num_heavy_atoms: | 21 |
| TPSA: | 101.89 | NumAromaticRings: | 1 |
