Glycoside
...
GD035509

Name:
None

Formula:
C28H30O11NF3

Smiles:
COc1ccc(-c2cc(=O)c3c(OC)c([C@@H]4O[C@H](C(=O)N[C@H](C)C(F)(F)F)[C@H](O)[C@H](O)[C@H]4O)c(OC)cc3o2)cc1OC

Aglycone:
CC(NC=O)C(F)(F)F.COc1cc(OC)c2c(=O)cc(-c3ccc(OC)c(OC)c3)oc2c1

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 4 FractionCSP3: 0.43
AlogP: 2.08 Num_rotatable_bonds: 8
MolWt: 613.54 Num_heavy_atoms: 43
TPSA: 166.15 NumAromaticRings: 3

Unique Aglycone
AD16103
Formula: C19H18O6

Smiles:
COc1cc(OC)c2c(=O)cc(-c3ccc(OC)c(OC)c3)oc2c1
HBA: 6 RingCount: 3
HBD: 0 FractionCSP3: 0.21
AlogP: 3.49 Num_rotatable_bonds: 5
MolWt: 342.35 Num_heavy_atoms: 25
TPSA: 67.13 NumAromaticRings: 3
AD22458
Formula: C4H6ONF3

Smiles:
CC(NC=O)C(F)(F)F
HBA: 2 RingCount: 0
HBD: 1 FractionCSP3: 0.75
AlogP: 0.68 Num_rotatable_bonds: 2
MolWt: 141.09 Num_heavy_atoms: 9
TPSA: 29.1 NumAromaticRings: 0

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O