Glycoside
GD067181
Name:
NoneFormula:
C10H19O9NS2Smiles:
CO[C@H]1OC[C@@H](OS(C)(=O)=O)[C@@H](NC(C)=O)[C@H]1OS(C)(=O)=OAglycone:
CS(=O)(=O)O.CS(=O)(=O)OSugarmoiety:
COC1OCC(O)C(NC(C)=O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.9 |
| AlogP: | -1.82 | Num_rotatable_bonds: | 6 |
| MolWt: | 361.39 | Num_heavy_atoms: | 22 |
| TPSA: | 134.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD00013
Formula: CH4O3S
Smiles:
CS(=O)(=O)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 0 |
| MolWt: | 96.11 | Num_heavy_atoms: | 5 |
| TPSA: | 54.37 | NumAromaticRings: | 0 |
