Glycoside
...
GD026200

Name:
None

Formula:
C16H15O5F17

Smiles:
OCC(O)C(O)C(O)COCC=CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

Aglycone:
CC=CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

Sugarmoiety:
OCC(O)C(O)C(O)COO

Other Identifiers

Properties
HBA: 5 RingCount: 0
HBD: 4 FractionCSP3: 0.88
AlogP: 3.64 Num_rotatable_bonds: 14
MolWt: 610.26 Num_heavy_atoms: 38
TPSA: 90.15 NumAromaticRings: 0

Unique Aglycone
AD17288
Formula: C11H5F17

Smiles:
CC=CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
HBA: 0 RingCount: 0
HBD: 0 FractionCSP3: 0.82
AlogP: 6.57 Num_rotatable_bonds: 7
MolWt: 460.13 Num_heavy_atoms: 28
TPSA: 0.0 NumAromaticRings: 0

Sugarmoiety
SD01184

OCC(O)C(O)C(O)COO