Glycoside
GD004693
Name:
NoneFormula:
C14H17O6BrSmiles:
CO[C@@H]1O[C@H](CBr)[C@H](OC(=O)c2ccccc2)[C@H](O)[C@H]1OAglycone:
O=C(O)c1ccccc1Sugarmoiety:
COC1OC(CBr)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.7 | Num_rotatable_bonds: | 4 |
| MolWt: | 361.19 | Num_heavy_atoms: | 21 |
| TPSA: | 85.22 | NumAromaticRings: | 1 |
Unique Aglycone
AD00002
Formula: C7H6O2
Smiles:
O=C(O)c1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 1 |
| MolWt: | 122.12 | Num_heavy_atoms: | 9 |
| TPSA: | 37.3 | NumAromaticRings: | 1 |
