Glycoside
...
GD098574

Name:
None

Formula:
C18H23O9NS3

Smiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2cc(S(=O)(=O)c3ccccc3)cs2)[C@@H](O)[C@H](O)[C@@H]1O

Aglycone:
O=S(=O)(NCCO)c1cc(S(=O)(=O)c2ccccc2)cs1

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 4 FractionCSP3: 0.44
AlogP: -0.3 Num_rotatable_bonds: 8
MolWt: 493.58 Num_heavy_atoms: 31
TPSA: 159.46 NumAromaticRings: 2

Unique Aglycone
AD41920
Formula: C12H13O5NS3

Smiles:
O=S(=O)(NCCO)c1cc(S(=O)(=O)c2ccccc2)cs1
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.17
AlogP: 0.85 Num_rotatable_bonds: 6
MolWt: 347.44 Num_heavy_atoms: 21
TPSA: 100.54 NumAromaticRings: 2

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O