Glycoside
GD056044
Name:
NoneFormula:
C9H12O6N3BrSmiles:
O=C(Nc1ccnn1Br)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1ccnn1BrSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -2.38 | Num_rotatable_bonds: | 6 |
| MolWt: | 338.11 | Num_heavy_atoms: | 19 |
| TPSA: | 144.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD28206
Formula: C3H4N3Br
Smiles:
Nc1ccnn1Br| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 0 |
| MolWt: | 161.99 | Num_heavy_atoms: | 7 |
| TPSA: | 43.84 | NumAromaticRings: | 1 |
