Glycoside
GD083921
Name:
NoneFormula:
C16H21O6N2BrSmiles:
CC(=O)N1CCc2cc(Br)cc(N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c21Aglycone:
CC(=O)N1CCc2cc(Br)cc(N)c21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 3 |
| MolWt: | 417.26 | Num_heavy_atoms: | 25 |
| TPSA: | 122.49 | NumAromaticRings: | 1 |
Unique Aglycone
AD37427
Formula: C10H11ON2Br
Smiles:
CC(=O)N1CCc2cc(Br)cc(N)c21| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 1.94 | Num_rotatable_bonds: | 0 |
| MolWt: | 255.11 | Num_heavy_atoms: | 14 |
| TPSA: | 46.33 | NumAromaticRings: | 1 |
