Glycoside
GD077323
Name:
NoneFormula:
C16H15O7BrSmiles:
O=C(O)[C@H]1O[C@@H](Oc2ccc3cc(Br)ccc3c2)[C@H](O)[C@@H](O)[C@@H]1OAglycone:
Oc1ccc2cc(Br)ccc2c1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.31 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 399.19 | Num_heavy_atoms: | 24 |
| TPSA: | 116.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD08664
Formula: C10H7OBr
Smiles:
Oc1ccc2cc(Br)ccc2c1| HBA: | 1 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 3.31 | Num_rotatable_bonds: | 0 |
| MolWt: | 223.07 | Num_heavy_atoms: | 12 |
| TPSA: | 20.23 | NumAromaticRings: | 2 |
