Glycoside
...
GD141134

Name:
None

Formula:
C42H44O22

Smiles:
CC(=O)Oc1ccc(-c2coc3cc(OC4OC(COC5OCC(OC(C)=O)C(OC(C)=O)C5OC(C)=O)C(OC(C)=O)C(OC(C)=O)C4OC(C)=O)cc(OC(C)=O)c3c2=O)cc1

Aglycone:
CC(=O)Oc1ccc(-c2coc3cc(O)cc(OC(C)=O)c3c2=O)cc1

Sugarmoiety:
CC(=O)OC1COC(OCC2OC(O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 22 RingCount: 5
HBD: 0 FractionCSP3: 0.45
AlogP: 2.38 Num_rotatable_bonds: 14
MolWt: 900.79 Num_heavy_atoms: 64
TPSA: 277.53 NumAromaticRings: 3

Unique Aglycone
AD56882
Formula: C19H14O7

Smiles:
CC(=O)Oc1ccc(-c2coc3cc(O)cc(OC(C)=O)c3c2=O)cc1
HBA: 7 RingCount: 3
HBD: 1 FractionCSP3: 0.11
AlogP: 3.02 Num_rotatable_bonds: 3
MolWt: 354.31 Num_heavy_atoms: 26
TPSA: 103.04 NumAromaticRings: 3

Sugarmoiety
SD01447

CC(=O)OC1COC(OCC2OC(O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C1OC(C)=O