Glycoside
...
GD016133

Name:
None

Formula:
C40H55O13N2F3

Smiles:
CO[C@H]1[C@H](OC(C)=O)CC(=O)O[C@@H](C)CC=CC=C[C@@H](OC(C)=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(OC(C)=O)CC(=O)OC(C)CC=CC=CC(OC(C)=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: 15 RingCount: 3
HBD: 2 FractionCSP3: 0.62
AlogP: 4.99 Num_rotatable_bonds: 10
MolWt: 828.88 Num_heavy_atoms: 58
TPSA: 185.46 NumAromaticRings: 1

Unique Aglycone
AD01717
Formula: C24H36O9

Smiles:
COC1C(OC(C)=O)CC(=O)OC(C)CC=CC=CC(OC(C)=O)C(C)CC(CC=O)C1O
HBA: 9 RingCount: 1
HBD: 1 FractionCSP3: 0.67
AlogP: 2.3 Num_rotatable_bonds: 5
MolWt: 468.54 Num_heavy_atoms: 33
TPSA: 125.43 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