Glycoside
GD108057
Name:
NoneFormula:
C22H26O11NBrSmiles:
CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)C(=O)Nc1ccc(Br)cc1Aglycone:
Nc1ccc(Br)cc1Sugarmoiety:
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(=O)OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 1.68 | Num_rotatable_bonds: | 11 |
| MolWt: | 560.35 | Num_heavy_atoms: | 35 |
| TPSA: | 160.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD17437
Formula: C6H6NBr
Smiles:
Nc1ccc(Br)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 172.03 | Num_heavy_atoms: | 8 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
