Glycoside
GD083682
Name:
NoneFormula:
C15H21O6N2BrSmiles:
CC(C)N(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)c1cc(Br)ccc1NAglycone:
CC(C)Nc1cc(Br)ccc1NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.47 |
| AlogP: | -0.58 | Num_rotatable_bonds: | 7 |
| MolWt: | 405.25 | Num_heavy_atoms: | 24 |
| TPSA: | 144.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD37309
Formula: C9H13N2Br
Smiles:
CC(C)Nc1cc(Br)ccc1N| HBA: | 2 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 2.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 229.12 | Num_heavy_atoms: | 12 |
| TPSA: | 38.05 | NumAromaticRings: | 1 |
