Glycoside
...
GD014745

Name:
None

Formula:
C28H22O8N2F2

Smiles:
O=C(O[C@H](C(=O)O)[C@H](OC(=O)c1cccn1Cc1ccc(F)cc1)C(=O)O)c1cccn1Cc1ccc(F)cc1

Aglycone:
O=Cc1cccn1Cc1ccc(F)cc1.O=Cc1cccn1Cc1ccc(F)cc1

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

Other Identifiers

Properties
HBA: 10 RingCount: 4
HBD: 2 FractionCSP3: 0.14
AlogP: 3.58 Num_rotatable_bonds: 11
MolWt: 552.49 Num_heavy_atoms: 40
TPSA: 137.06 NumAromaticRings: 4

Unique Aglycone
AD08258
Formula: C12H10ONF

Smiles:
O=Cc1cccn1Cc1ccc(F)cc1
HBA: 2 RingCount: 2
HBD: 0 FractionCSP3: 0.08
AlogP: 2.49 Num_rotatable_bonds: 3
MolWt: 203.22 Num_heavy_atoms: 15
TPSA: 22.0 NumAromaticRings: 2

Sugarmoiety
SD00296

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