Glycoside
...
GD026045

Name:
None

Formula:
C14H15O5F13

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)F

Aglycone:
CC=CC(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: 0.86
AlogP: 2.37 Num_rotatable_bonds: 12
MolWt: 510.24 Num_heavy_atoms: 32
TPSA: 90.15 NumAromaticRings: 0

Unique Aglycone
AD17201
Formula: C9H5F13

Smiles:
CC=CC(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: 0.78
AlogP: 5.3 Num_rotatable_bonds: 5
MolWt: 360.11 Num_heavy_atoms: 22
TPSA: 0.0 NumAromaticRings: 0

Sugarmoiety
SD01184

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