Glycoside
...
GD103906

Name:
None

Formula:
C22H23O8N2F

Smiles:
C[C@@H](Oc1ccc(Oc2ccc(C#N)cc2F)cc1)C(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O

Aglycone:
CC(Oc1ccc(Oc2ccc(C#N)cc2F)cc1)C(N)=O

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

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 5 FractionCSP3: 0.36
AlogP: 0.17 Num_rotatable_bonds: 7
MolWt: 462.43 Num_heavy_atoms: 33
TPSA: 161.5 NumAromaticRings: 2

Unique Aglycone
AD43935
Formula: C16H13O3N2F

Smiles:
CC(Oc1ccc(Oc2ccc(C#N)cc2F)cc1)C(N)=O
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 0.12
AlogP: 2.74 Num_rotatable_bonds: 5
MolWt: 300.29 Num_heavy_atoms: 22
TPSA: 85.34 NumAromaticRings: 2

Sugarmoiety
SD00003

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