Glycoside
...
GD003039

Name:
None

Formula:
C15H20O9N2

Smiles:
CC(=O)OCC1OC(OC(C)=O)C(NC#N)C(OC(C)=O)C1OC(C)=O

Aglycone:
COC(C)=O

Sugarmoiety:
CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1NC#N

Other Identifiers

Properties
HBA: 11 RingCount: 1
HBD: 1 FractionCSP3: 0.67
AlogP: -0.86 Num_rotatable_bonds: 6
MolWt: 372.33 Num_heavy_atoms: 26
TPSA: 150.25 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
SD00666

CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1NC#N