Glycoside
GD091586
Name:
NoneFormula:
C15H17O8N2BrSmiles:
COc1cc(-c2noc(C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)n2)cc(Br)c1OCAglycone:
COc1cc(-c2ncon2)cc(Br)c1OCSugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -0.23 | Num_rotatable_bonds: | 8 |
| MolWt: | 433.21 | Num_heavy_atoms: | 26 |
| TPSA: | 155.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD39954
Formula: C10H9O3N2Br
Smiles:
COc1cc(-c2ncon2)cc(Br)c1OC| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.2 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 285.1 | Num_heavy_atoms: | 16 |
| TPSA: | 57.38 | NumAromaticRings: | 2 |
