Glycoside
GD088678
Name:
NoneFormula:
C15H25O6N4BrSmiles:
CC(=O)N[C@H]1[C@H](OCCn2cc(C(C)(C)Br)nn2)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CC(C)(Br)c1cn(CCO)nn1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.8 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 7 |
| MolWt: | 437.29 | Num_heavy_atoms: | 26 |
| TPSA: | 138.96 | 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 |
