Glycoside
...
GD081119

Name:
None

Formula:
C17H25O9NS

Smiles:
O=S(=O)(Nc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1)C1CCOCC1

Aglycone:
O=S(=O)(Nc1ccc(O)cc1)C1CCOCC1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 5 FractionCSP3: 0.65
AlogP: -1.21 Num_rotatable_bonds: 6
MolWt: 419.45 Num_heavy_atoms: 28
TPSA: 154.78 NumAromaticRings: 1

Unique Aglycone
AD36578
Formula: C11H15O4NS

Smiles:
O=S(=O)(Nc1ccc(O)cc1)C1CCOCC1
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 0.45
AlogP: 1.31 Num_rotatable_bonds: 3
MolWt: 257.31 Num_heavy_atoms: 17
TPSA: 75.63 NumAromaticRings: 1

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O