Glycoside
GD054954
Name:
NoneFormula:
C12H21O8NSSmiles:
CN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)C1CCS(=O)(=O)CC1Aglycone:
CNC1CCS(=O)(=O)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.83 |
| AlogP: | -3.33 | Num_rotatable_bonds: | 6 |
| MolWt: | 339.37 | Num_heavy_atoms: | 22 |
| TPSA: | 152.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD27925
Formula: C6H13O2NS
Smiles:
CNC1CCS(=O)(=O)CC1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 1 |
| MolWt: | 163.24 | Num_heavy_atoms: | 10 |
| TPSA: | 46.17 | NumAromaticRings: | 0 |
