Glycoside
...
GD107245

Name:
[5-(acetyloxy)-1-{[4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]-3-hydroxyoxan-2-yl]oxy}-1H,4aH,5H,7aH-cyclopenta[c]pyran-7-yl]methyl acetate

Formula:
C25H32O14

Smiles:
CC(=O)OCC1=C[C@@H](OC(C)=O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3O)[C@@H]12

Aglycone:
CC(=O)OCC1=CC(OC(C)=O)C2C=COC(O)C12.COC(C)=O

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

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 1 FractionCSP3: 0.64
AlogP: 0.05 Num_rotatable_bonds: 9
MolWt: 556.52 Num_heavy_atoms: 39
TPSA: 179.42 NumAromaticRings: 0

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
AD44225
Formula: C13H16O6

Smiles:
CC(=O)OCC1=CC(OC(C)=O)C2C=COC(O)C12
HBA: 6 RingCount: 2
HBD: 1 FractionCSP3: 0.54
AlogP: 0.52 Num_rotatable_bonds: 3
MolWt: 268.26 Num_heavy_atoms: 19
TPSA: 82.06 NumAromaticRings: 0

Sugarmoiety
SD00013

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