Glycoside
GD083478
Name:
NoneFormula:
C15H16O6N3BrSmiles:
O=C(Nc1ccnn1-c1cccc(Br)c1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1ccnn1-c1cccc(Br)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.27 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 7 |
| MolWt: | 414.21 | Num_heavy_atoms: | 25 |
| TPSA: | 144.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD37256
Formula: C9H8N3Br
Smiles:
Nc1ccnn1-c1cccc(Br)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.22 | Num_rotatable_bonds: | 1 |
| MolWt: | 238.09 | Num_heavy_atoms: | 13 |
| TPSA: | 43.84 | NumAromaticRings: | 2 |
