Glycoside
GD102560
Name:
NoneFormula:
C23H27O8NSSmiles:
COc1cccc2c1OC[C@H](C(=O)Nc1ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)cc1)C2Aglycone:
COc1cccc2c1OCC(C(=O)Nc1ccc(S)cc1)C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 6 |
| MolWt: | 477.54 | Num_heavy_atoms: | 33 |
| TPSA: | 137.71 | NumAromaticRings: | 2 |
Unique Aglycone
AD43412
Formula: C17H17O3NS
Smiles:
COc1cccc2c1OCC(C(=O)Nc1ccc(S)cc1)C2| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.24 |
| AlogP: | 3.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 315.39 | Num_heavy_atoms: | 22 |
| TPSA: | 47.56 | NumAromaticRings: | 2 |
