Glycoside
GD096083
Name:
NoneFormula:
C20H23O9NSSmiles:
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)cc1Aglycone:
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | -0.13 | Num_rotatable_bonds: | 7 |
| MolWt: | 453.47 | Num_heavy_atoms: | 31 |
| TPSA: | 162.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD40863
Formula: C14H13O4NS
Smiles:
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 2.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 291.33 | Num_heavy_atoms: | 20 |
| TPSA: | 83.47 | NumAromaticRings: | 2 |
