Glycoside
GD077144
Name:
NoneFormula:
C16H18O6N5ClSmiles:
COc1nccc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1ClAglycone:
COc1nccc(NC2=C(C(N)=O)N=C[N]2)c1ClSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | -0.61 | Num_rotatable_bonds: | 6 |
| MolWt: | 399.79 | Num_heavy_atoms: | 27 |
| TPSA: | 164.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD35443
Formula: C11H9O2N5Cl
Smiles:
COc1nccc(NC2=C(C(N)=O)N=C[N]2)c1Cl| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.1 |
| AlogP: | 0.46 | Num_rotatable_bonds: | 4 |
| MolWt: | 266.67 | Num_heavy_atoms: | 18 |
| TPSA: | 103.7 | NumAromaticRings: | 1 |
