Glycoside
...
GD004841

Name:
None

Formula:
C36H49O10N2F3

Smiles:
CO[C@@H]1C=CC(=O)O[C@H](C)CC=CC=C[C@H](O)[C@H](C)C[C@H](CC=O)[C@H]1O[C@@H]1O[C@H](C)[C@H](OC(=O)Nc2ccc(C(F)(F)F)cc2)[C@H](N(C)C)[C@H]1O

Aglycone:
COC1C=CC(=O)OC(C)CC=CC=CC(O)C(C)CC(CC=O)C1O.O=C(O)Nc1ccc(C(F)(F)F)cc1

Sugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 3 FractionCSP3: 0.58
AlogP: 4.65 Num_rotatable_bonds: 8
MolWt: 726.79 Num_heavy_atoms: 51
TPSA: 153.09 NumAromaticRings: 1

Unique Aglycone
AD04178
Formula: C20H30O6

Smiles:
COC1C=CC(=O)OC(C)CC=CC=CC(O)C(C)CC(CC=O)C1O
HBA: 6 RingCount: 1
HBD: 2 FractionCSP3: 0.6
AlogP: 1.96 Num_rotatable_bonds: 3
MolWt: 366.45 Num_heavy_atoms: 26
TPSA: 93.06 NumAromaticRings: 0
AD04179
Formula: C8H6O2NF3

Smiles:
O=C(O)Nc1ccc(C(F)(F)F)cc1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.12
AlogP: 2.8 Num_rotatable_bonds: 1
MolWt: 205.13 Num_heavy_atoms: 14
TPSA: 49.33 NumAromaticRings: 1

Sugarmoiety
SD00048

CC1OC(O)C(O)C(N(C)C)C1O