Glycoside
...
GD005086

Name:
None

Formula:
C32H36O14N2F2

Smiles:
CC(=O)OC[C@@H]1O[C@H](ON=C2C[C@H](O)[C@H](O)[C@@H]3[C@H]2CC[C@@H]2C(=O)N(c4ccc(F)cc4F)C(=O)[C@@H]23)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
COC(C)=O.O=C1C2CCC3C(=NO)CC(O)C(O)C3C2C(=O)N1c1ccc(F)cc1F

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 16 RingCount: 5
HBD: 2 FractionCSP3: 0.59
AlogP: 0.68 Num_rotatable_bonds: 8
MolWt: 710.64 Num_heavy_atoms: 50
TPSA: 213.86 NumAromaticRings: 1

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD04353
Formula: C18H18O5N2F2

Smiles:
O=C1C2CCC3C(=NO)CC(O)C(O)C3C2C(=O)N1c1ccc(F)cc1F
HBA: 7 RingCount: 4
HBD: 3 FractionCSP3: 0.5
AlogP: 1.05 Num_rotatable_bonds: 1
MolWt: 380.35 Num_heavy_atoms: 27
TPSA: 110.43 NumAromaticRings: 1

Sugarmoiety
SD00012

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O