Glycoside
...
GD005362

Name:
None

Formula:
C19H30O9N4S

Smiles:
CCCCN(Cc1cn([C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)nn1)S(C)(=O)=O

Aglycone:
CCCCN(CC1=C[N]N=N1)S(C)(=O)=O.COC(C)=O

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

Other Identifiers

Properties
HBA: 13 RingCount: 2
HBD: 0 FractionCSP3: 0.74
AlogP: 0.16 Num_rotatable_bonds: 11
MolWt: 490.54 Num_heavy_atoms: 33
TPSA: 156.22 NumAromaticRings: 1

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
AD04568
Formula: C8H15O2N4S

Smiles:
CCCCN(CC1=C[N]N=N1)S(C)(=O)=O
HBA: 6 RingCount: 1
HBD: 0 FractionCSP3: 0.75
AlogP: 0.87 Num_rotatable_bonds: 6
MolWt: 231.3 Num_heavy_atoms: 15
TPSA: 76.2 NumAromaticRings: 0

Sugarmoiety
SD00105

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