Glycoside
GD022827
Name:
NoneFormula:
C16H18O8SSmiles:
COC(=O)c1cc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2s1Aglycone:
COC(=O)c1cc2ccc(O)cc2s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -0.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 370.38 | Num_heavy_atoms: | 25 |
| TPSA: | 125.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD15427
Formula: C10H8O3S
Smiles:
COC(=O)c1cc2ccc(O)cc2s1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 2.39 | Num_rotatable_bonds: | 1 |
| MolWt: | 208.24 | Num_heavy_atoms: | 14 |
| TPSA: | 46.53 | NumAromaticRings: | 2 |
