Glycoside
GD007410
Name:
NoneFormula:
C16H18O5SSmiles:
COc1ccc(-c2cccs2)cc1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
COc1ccc(-c2cccs2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 1.58 | Num_rotatable_bonds: | 4 |
| MolWt: | 322.38 | Num_heavy_atoms: | 22 |
| TPSA: | 79.15 | NumAromaticRings: | 2 |
Unique Aglycone
AD06038
Formula: C11H10OS
Smiles:
COc1ccc(-c2cccs2)cc1| HBA: | 1 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.09 |
| AlogP: | 3.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 190.27 | Num_heavy_atoms: | 13 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
