Glycoside
GD085520
Name:
4,5-bis(acetyloxy)-6-(benzenesulfonyl)oxan-3-yl acetateFormula:
C17H20O9SSmiles:
CC(=O)O[C@H]1[C@H](OC(C)=O)[C@H](OC(C)=O)CO[C@@H]1S(=O)(=O)c1ccccc1Aglycone:
O=[S](=O)c1ccccc1Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.47 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 5 |
| MolWt: | 400.41 | Num_heavy_atoms: | 27 |
| TPSA: | 122.27 | NumAromaticRings: | 1 |
Unique Aglycone
AD04951
Formula: C6H5O2S
Smiles:
O=[S](=O)c1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 0.92 | Num_rotatable_bonds: | 1 |
| MolWt: | 141.17 | Num_heavy_atoms: | 9 |
| TPSA: | 34.14 | NumAromaticRings: | 1 |
