Glycoside
GD102418
Name:
NoneFormula:
C20H23O8NS2Smiles:
CS(=O)(=O)c1ccc(C(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)cc1Aglycone:
CS(=O)(=O)c1ccc(C(=O)Nc2ccc(S)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 6 |
| MolWt: | 469.54 | Num_heavy_atoms: | 31 |
| TPSA: | 153.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD43349
Formula: C14H13O3NS2
Smiles:
CS(=O)(=O)c1ccc(C(=O)Nc2ccc(S)cc2)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.63 | Num_rotatable_bonds: | 3 |
| MolWt: | 307.4 | Num_heavy_atoms: | 20 |
| TPSA: | 63.24 | NumAromaticRings: | 2 |
