Glycoside
GD014051
Name:
NoneFormula:
C23H23O7N6BrSmiles:
O=C1C(=NNc2ccc(Br)cc2)c2ccccc2N1Cc1cn(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)nn1Aglycone:
O=C1C(=NNc2ccc(Br)cc2)c2ccccc2N1Cc1cn(O)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 7 |
| MolWt: | 575.38 | Num_heavy_atoms: | 37 |
| TPSA: | 174.79 | NumAromaticRings: | 3 |
Unique Aglycone
AD10402
Formula: C17H13O2N6Br
Smiles:
O=C1C(=NNc2ccc(Br)cc2)c2ccccc2N1Cc1cn(O)nn1| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 2.64 | Num_rotatable_bonds: | 4 |
| MolWt: | 413.24 | Num_heavy_atoms: | 26 |
| TPSA: | 95.64 | NumAromaticRings: | 3 |
