Glycoside
...
GD033708

Name:
None

Formula:
C22H25O8N2F3S

Smiles:
Cc1cccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(=O)C(F)(F)F)c1-c1cccc(NS(C)(=O)=O)c1

Aglycone:
Cc1cccc(O)c1-c1cccc(NS(C)(=O)=O)c1.NC(=O)C(F)(F)F

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

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 5 FractionCSP3: 0.41
AlogP: 0.9 Num_rotatable_bonds: 7
MolWt: 534.51 Num_heavy_atoms: 36
TPSA: 154.42 NumAromaticRings: 2

Unique Aglycone
AD01445
Formula: C2H2ONF3

Smiles:
NC(=O)C(F)(F)F
HBA: 2 RingCount: 0
HBD: 2 FractionCSP3: 0.5
AlogP: 0.03 Num_rotatable_bonds: 0
MolWt: 113.04 Num_heavy_atoms: 7
TPSA: 43.09 NumAromaticRings: 0
AD19956
Formula: C14H15O3NS

Smiles:
Cc1cccc(O)c1-c1cccc(NS(C)(=O)=O)c1
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.14
AlogP: 2.74 Num_rotatable_bonds: 3
MolWt: 277.35 Num_heavy_atoms: 19
TPSA: 66.4 NumAromaticRings: 2

Sugarmoiety
SD00003

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