Glycoside
GD090908
Name:
NoneFormula:
C19H25O8NSSmiles:
CC1(C)OC(=O)C[C@@H]1C(=O)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
CC1(C)OC(=O)CC1C(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 5 |
| MolWt: | 427.48 | Num_heavy_atoms: | 29 |
| TPSA: | 145.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD39578
Formula: C13H15O3NS
Smiles:
CC1(C)OC(=O)CC1C(=O)Nc1ccc(S)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.38 |
| AlogP: | 2.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 265.33 | Num_heavy_atoms: | 18 |
| TPSA: | 55.4 | NumAromaticRings: | 1 |
