Glycoside
...
GD009183

Name:
None

Formula:
C28H38O18S

Smiles:
CC(=O)OCC1OC(SC2OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Aglycone:
COC(C)=O.COC(C)=O

Sugarmoiety:
CC(=O)OC1C(O)OC(SC2OC(O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 18 RingCount: 2
HBD: 0 FractionCSP3: 0.71
AlogP: -0.11 Num_rotatable_bonds: 12
MolWt: 694.66 Num_heavy_atoms: 47
TPSA: 228.86 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
SD01435

CC(=O)OC1C(O)OC(SC2OC(O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(OC(C)=O)C1OC(C)=O