Glycoside
GD074566
Name:
NoneFormula:
C12H18O6N3BrSmiles:
Cc1nn(CC(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cc1BrAglycone:
Cc1nn(CC(N)=O)cc1BrSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -2.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 380.2 | Num_heavy_atoms: | 22 |
| TPSA: | 137.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD34471
Formula: C6H8ON3Br
Smiles:
Cc1nn(CC(N)=O)cc1Br| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.44 | Num_rotatable_bonds: | 2 |
| MolWt: | 218.05 | Num_heavy_atoms: | 11 |
| TPSA: | 60.91 | NumAromaticRings: | 1 |
