Glycoside
GD058882
Name:
2-(4-bromophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C12H15O6BrSmiles:
OC[C@H]1O[C@@H](Oc2ccc(Br)cc2)[C@H](O)[C@@H](O)[C@@H]1OAglycone:
Oc1ccc(Br)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 3 |
| MolWt: | 335.15 | Num_heavy_atoms: | 19 |
| TPSA: | 99.38 | NumAromaticRings: | 1 |
Unique Aglycone
AD08767
Formula: C6H5OBr
Smiles:
Oc1ccc(Br)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.15 | Num_rotatable_bonds: | 0 |
| MolWt: | 173.01 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
