Glycoside
GD000030
Name:
NoneFormula:
C16H25O7NSSmiles:
CO[C@@H]1O[C@H](CNS(=O)(=O)c2c(C)cc(C)cc2C)[C@H](O)[C@H](O)[C@H]1OAglycone:
CNS(=O)(=O)c1c(C)cc(C)cc1CSugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 5 |
| MolWt: | 375.44 | Num_heavy_atoms: | 25 |
| TPSA: | 125.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD00041
Formula: C10H15O2NS
Smiles:
CNS(=O)(=O)c1c(C)cc(C)cc1C| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 1.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 213.3 | Num_heavy_atoms: | 14 |
| TPSA: | 46.17 | NumAromaticRings: | 1 |
