Glycoside
GD034838
Name:
NoneFormula:
C22H28O9N2SSmiles:
COc1cccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)c1-c1cccc(NS(C)(=O)=O)c1Aglycone:
COc1cccc(O)c1-c1cccc(NS(C)(=O)=O)c1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | 0.06 | Num_rotatable_bonds: | 8 |
| MolWt: | 496.54 | Num_heavy_atoms: | 34 |
| TPSA: | 163.65 | NumAromaticRings: | 2 |
Unique Aglycone
AD22095
Formula: C14H15O4NS
Smiles:
COc1cccc(O)c1-c1cccc(NS(C)(=O)=O)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 2.44 | Num_rotatable_bonds: | 4 |
| MolWt: | 293.34 | Num_heavy_atoms: | 20 |
| TPSA: | 75.63 | NumAromaticRings: | 2 |
