Glycoside
...
GD025052

Name:
None

Formula:
C22H25O8N2F3S

Smiles:
CC(=O)N[C@@H]1[C@H](Oc2cccc(C(F)(F)F)c2-c2cccc(NS(C)(=O)=O)c2)O[C@H](CO)[C@H](O)[C@H]1O

Aglycone:
CS(=O)(=O)Nc1cccc(-c2c(O)cccc2C(F)(F)F)c1

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 5 FractionCSP3: 0.41
AlogP: 1.07 Num_rotatable_bonds: 7
MolWt: 534.51 Num_heavy_atoms: 36
TPSA: 154.42 NumAromaticRings: 2

Unique Aglycone
AD16656
Formula: C14H12O3NF3S

Smiles:
CS(=O)(=O)Nc1cccc(-c2c(O)cccc2C(F)(F)F)c1
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.14
AlogP: 3.45 Num_rotatable_bonds: 3
MolWt: 331.31 Num_heavy_atoms: 22
TPSA: 66.4 NumAromaticRings: 2

Sugarmoiety
SD00014

CC(=O)NC1C(O)OC(CO)C(O)C1O