Glycoside
...
GD017817

Name:
None

Formula:
C17H16O7N4Cl2

Smiles:
CC(=O)O[C@@H]1[C@@H](n2cnc3c(Cl)nc(Cl)nc32)O[C@@H]([C@H](O)CO)[C@H]1OC(C)=O

Aglycone:
Clc1nc(Cl)c2c(n1)[N]C=N2

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

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 2 FractionCSP3: 0.53
AlogP: 0.25 Num_rotatable_bonds: 5
MolWt: 435.22 Num_heavy_atoms: 28
TPSA: 145.89 NumAromaticRings: 2

Unique Aglycone
AD05729
Formula: C7HN4Cl2

Smiles:
Clc1nc(Cl)c2c(n1)[N]C=N2
HBA: 4 RingCount: 2
HBD: 0 FractionCSP3: 0.0
AlogP: 1.69 Num_rotatable_bonds: 0
MolWt: 188.0 Num_heavy_atoms: 11
TPSA: 52.24 NumAromaticRings: 1

Sugarmoiety
SD02168

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