Glycoside
GD078673
Name:
NoneFormula:
C15H22O5NBrSmiles:
CC(C)c1cc(Br)cc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
CC(C)c1cc(N)cc(Br)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 4 |
| MolWt: | 376.25 | Num_heavy_atoms: | 22 |
| TPSA: | 102.18 | NumAromaticRings: | 1 |
Unique Aglycone
AD36154
Formula: C9H12NBr
Smiles:
CC(C)c1cc(N)cc(Br)c1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 3.15 | Num_rotatable_bonds: | 1 |
| MolWt: | 214.11 | Num_heavy_atoms: | 11 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
