Glycoside
GD092239
Name:
NoneFormula:
C19H22O7N6Smiles:
CCOc1ccc(C/N=N/c2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(O)c1Aglycone:
CCOc1ccc(CN=NC2=Nc3c(nc[nH]c3=O)[N]2)c(O)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 7 |
| MolWt: | 446.42 | Num_heavy_atoms: | 32 |
| TPSA: | 187.67 | NumAromaticRings: | 3 |
Unique Aglycone
AD40261
Formula: C14H13O3N6
Smiles:
CCOc1ccc(CN=NC2=Nc3c(nc[nH]c3=O)[N]2)c(O)c1| HBA: | 9 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 4 |
| MolWt: | 313.3 | Num_heavy_atoms: | 23 |
| TPSA: | 126.39 | NumAromaticRings: | 2 |
