Glycoside
GD017246
Name:
NoneFormula:
C13H18O7SSmiles:
CO[C@@H]1O[C@H](CS(=O)(=O)c2ccccc2)[C@H](O)[C@H](O)[C@H]1OAglycone:
CS(=O)(=O)c1ccccc1Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | -1.09 | Num_rotatable_bonds: | 4 |
| MolWt: | 318.35 | Num_heavy_atoms: | 21 |
| TPSA: | 113.29 | NumAromaticRings: | 1 |
Unique Aglycone
AD12328
Formula: C7H8O2S
Smiles:
CS(=O)(=O)c1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 1.09 | Num_rotatable_bonds: | 1 |
| MolWt: | 156.21 | Num_heavy_atoms: | 10 |
| TPSA: | 34.14 | NumAromaticRings: | 1 |
