Glycoside
...
GD017927

Name:
None

Formula:
C24H26O8N4

Smiles:
CCOc1ccc(-c2ncnc3c2ncn3[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)cc1

Aglycone:
CCOc1ccc(-c2ncnc3c2N=C[N]3)cc1.COC(C)=O

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

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 0 FractionCSP3: 0.42
AlogP: 2.22 Num_rotatable_bonds: 8
MolWt: 498.49 Num_heavy_atoms: 36
TPSA: 140.96 NumAromaticRings: 3

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
AD12734
Formula: C13H11ON4

Smiles:
CCOc1ccc(-c2ncnc3c2N=C[N]3)cc1
HBA: 5 RingCount: 3
HBD: 0 FractionCSP3: 0.15
AlogP: 2.45 Num_rotatable_bonds: 3
MolWt: 239.26 Num_heavy_atoms: 18
TPSA: 61.47 NumAromaticRings: 2

Sugarmoiety
SD00105

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