Glycoside
GD062253
Name:
NoneFormula:
C15H18O6SSmiles:
CC(=O)O[C@@H]1CO[C@H](Sc2ccccc2)[C@H](OC(C)=O)[C@@H]1OAglycone:
Sc1ccccc1Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.47 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 4 |
| MolWt: | 326.37 | Num_heavy_atoms: | 22 |
| TPSA: | 82.06 | NumAromaticRings: | 1 |
Unique Aglycone
AD07729
Formula: C6H6S
Smiles:
Sc1ccccc1| HBA: | 0 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.98 | Num_rotatable_bonds: | 0 |
| MolWt: | 110.18 | Num_heavy_atoms: | 7 |
| TPSA: | 0.0 | NumAromaticRings: | 1 |
