Glycoside
GD078433
Name:
NoneFormula:
C18H25O6NSSmiles:
CC1(C)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)CC1C(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 5 |
| MolWt: | 383.47 | Num_heavy_atoms: | 26 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD36016
Formula: C12H15ONS
Smiles:
CC1(C)CC1C(=O)Nc1ccc(S)cc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.42 |
| AlogP: | 2.96 | Num_rotatable_bonds: | 2 |
| MolWt: | 221.33 | Num_heavy_atoms: | 15 |
| TPSA: | 29.1 | NumAromaticRings: | 1 |
