Glycoside
...
GD147075

Name:
[3,4-bis(acetyloxy)-5-{[3-(acetyloxy)-5-{[3,4,5-tris(acetyloxy)oxan-2-yl]oxy}-2-{[4,5,6-tris(acetyloxy)oxan-3-yl]oxy}oxan-4-yl]oxy}oxolan-2-yl]methyl acetate

Formula:
C40H54O27

Smiles:
CC(=O)OCC1OC(OC2C(OC3OCC(OC(C)=O)C(OC(C)=O)C3OC(C)=O)COC(OC3COC(OC(C)=O)C(OC(C)=O)C3OC(C)=O)C2OC(C)=O)C(OC(C)=O)C1OC(C)=O

Aglycone:
COC(C)=O

Sugarmoiety:
CC(=O)OC1COC(OC2COC(OC3COC(OC(C)=O)C(OC(C)=O)C3OC(C)=O)C(OC(C)=O)C2OC2OC(O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 27 RingCount: 4
HBD: 0 FractionCSP3: 0.75
AlogP: -1.48 Num_rotatable_bonds: 17
MolWt: 966.85 Num_heavy_atoms: 67
TPSA: 327.61 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

Sugarmoiety
SD09405

CC(=O)OC1COC(OC2COC(OC3COC(OC(C)=O)C(OC(C)=O)C3OC(C)=O)C(OC(C)=O)C2OC2OC(O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C1OC(C)=O