Glycoside
GD073902
Name:
NoneFormula:
C13H22O6N3BrSmiles:
CC(C)(Br)c1cn(CCO[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1Aglycone:
CC(C)(Br)c1cn(CCO)nn1Sugarmoiety:
OCC1OC(O)(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.85 |
| AlogP: | -1.27 | Num_rotatable_bonds: | 7 |
| MolWt: | 396.24 | Num_heavy_atoms: | 23 |
| TPSA: | 130.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD34194
Formula: C7H12ON3Br
Smiles:
CC(C)(Br)c1cn(CCO)nn1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.71 |
| AlogP: | 0.9 | Num_rotatable_bonds: | 3 |
| MolWt: | 234.1 | Num_heavy_atoms: | 12 |
| TPSA: | 50.94 | NumAromaticRings: | 1 |
