Glycoside
GD102226
Name:
NoneFormula:
C22H23O9NSSmiles:
CC(=O)C(=O)Oc1ccccc1C(=O)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)cc1Aglycone:
CC(=O)C(=O)Oc1ccccc1C(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 0.33 | Num_rotatable_bonds: | 7 |
| MolWt: | 477.49 | Num_heavy_atoms: | 33 |
| TPSA: | 162.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD43263
Formula: C16H13O4NS
Smiles:
CC(=O)C(=O)Oc1ccccc1C(=O)Nc1ccc(S)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.06 |
| AlogP: | 2.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 315.35 | Num_heavy_atoms: | 22 |
| TPSA: | 72.47 | NumAromaticRings: | 2 |
