Glycoside
...
GD110020

Name:
None

Formula:
C22H16O8F6

Smiles:
O=C(COC(=O)[C@@H](O)[C@@H](O)C(=O)OCC(=O)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1

Aglycone:
CC(=O)c1ccc(C(F)(F)F)cc1.CC(=O)c1ccc(C(F)(F)F)cc1

Sugarmoiety:
O=C(OO)C(O)C(O)C(=O)OO

Other Identifiers

Properties
HBA: 8 RingCount: 2
HBD: 2 FractionCSP3: 0.27
AlogP: 2.6 Num_rotatable_bonds: 9
MolWt: 522.35 Num_heavy_atoms: 36
TPSA: 127.2 NumAromaticRings: 2

Unique Aglycone
AD22112
Formula: C9H7OF3

Smiles:
CC(=O)c1ccc(C(F)(F)F)cc1
HBA: 1 RingCount: 1
HBD: 0 FractionCSP3: 0.22
AlogP: 2.91 Num_rotatable_bonds: 1
MolWt: 188.15 Num_heavy_atoms: 13
TPSA: 17.07 NumAromaticRings: 1

Sugarmoiety
SD00741

O=C(OO)C(O)C(O)C(=O)OO