Glycoside
GD021696
Name:
NoneFormula:
C13H18O6SSmiles:
[O-][S+](Cc1ccccc1)[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
[O-][S+]Cc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | -1.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 302.35 | Num_heavy_atoms: | 20 |
| TPSA: | 113.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD14785
Formula: C7H7OS
Smiles:
[O-][S+]Cc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 2 |
| MolWt: | 139.2 | Num_heavy_atoms: | 9 |
| TPSA: | 23.06 | NumAromaticRings: | 1 |
