Glycoside
GD099247
Name:
NoneFormula:
C12H12O7NCl2S2BrSmiles:
O=C[C@H](NS(=O)(=O)c1c(Cl)sc(Cl)c1Br)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
NS(=O)(=O)c1c(Cl)sc(Cl)c1BrSugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 8 |
| MolWt: | 473.15 | Num_heavy_atoms: | 23 |
| TPSA: | 144.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD40940
Formula: C6H2O2NCl2S2Br
Smiles:
NS(=O)(=O)c1c(Cl)sc(Cl)c1Br| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 1 |
| MolWt: | 311.01 | Num_heavy_atoms: | 12 |
| TPSA: | 60.16 | NumAromaticRings: | 1 |
