Glycoside
...
GD054303

Name:
None

Formula:
C13H19O5N4Cl

Smiles:
CN(C)c1nc(Cl)cc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)n1

Aglycone:
CN(C)c1nc(N)cc(Cl)n1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 2
HBD: 5 FractionCSP3: 0.67
AlogP: -1.59 Num_rotatable_bonds: 4
MolWt: 334.76 Num_heavy_atoms: 22
TPSA: 131.2 NumAromaticRings: 1

Unique Aglycone
AD27682
Formula: C7H9N4Cl

Smiles:
CN(C)c1nc(N)cc(Cl)n1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.33
AlogP: 0.78 Num_rotatable_bonds: 1
MolWt: 172.62 Num_heavy_atoms: 11
TPSA: 55.04 NumAromaticRings: 1

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O