Glycoside
GD091540
Name:
NoneFormula:
C15H17O8N2BrSmiles:
COc1cc(-c2noc([C@H]3O[C@@H](O)[C@H](O)[C@@H](O)[C@H]3O)n2)cc(Br)c1OCAglycone:
COc1cc(-c2ncon2)cc(Br)c1OCSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 433.21 | Num_heavy_atoms: | 26 |
| TPSA: | 147.53 | 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 |
