Glycoside
GD082941
Name:
NoneFormula:
C18H22O5N6Smiles:
Cc1ccc(CNc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
Cc1ccc(CNC2=Nc3c(nc(N)[nH]c3=O)[N]2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.39 |
| AlogP: | -0.77 | Num_rotatable_bonds: | 5 |
| MolWt: | 402.41 | Num_heavy_atoms: | 29 |
| TPSA: | 171.54 | NumAromaticRings: | 3 |
Unique Aglycone
AD37133
Formula: C13H13ON6
Smiles:
Cc1ccc(CNC2=Nc3c(nc(N)[nH]c3=O)[N]2)cc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.15 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 2 |
| MolWt: | 269.29 | Num_heavy_atoms: | 20 |
| TPSA: | 110.26 | NumAromaticRings: | 2 |
