Glycoside
GD015057
Name:
NoneFormula:
C24H30O11NBrSmiles:
CC(=O)N[C@@H]1[C@H](Oc2ccc3cc(Br)ccc3c2)O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H]1OAglycone:
Oc1ccc2cc(Br)ccc2c1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.54 |
| AlogP: | -1.25 | Num_rotatable_bonds: | 7 |
| MolWt: | 588.4 | Num_heavy_atoms: | 37 |
| TPSA: | 187.4 | 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 |
