Glycoside
...
GD025697

Name:
None

Formula:
C42H58O28

Smiles:
CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)OC(C)=O

Aglycone:
COC(C)=O

Sugarmoiety:
CC(=O)OCC1OC(OCC2OC(OCC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(O)OC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 28 RingCount: 2
HBD: 0 FractionCSP3: 0.71
AlogP: -1.09 Num_rotatable_bonds: 23
MolWt: 1010.9 Num_heavy_atoms: 70
TPSA: 352.52 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
SD02670

CC(=O)OCC1OC(OCC2OC(OCC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(O)OC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O