Glycoside
...
GD033036

Name:
None

Formula:
C16H20O5N3Cl

Smiles:
CC(C)COc1ncnc2c1c(Cl)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O

Aglycone:
CC(C)COc1ncnc2c1C(Cl)=C[N]2

Sugarmoiety:
OCC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 8 RingCount: 3
HBD: 3 FractionCSP3: 0.6
AlogP: 0.73 Num_rotatable_bonds: 5
MolWt: 357.79 Num_heavy_atoms: 24
TPSA: 109.86 NumAromaticRings: 2

Unique Aglycone
AD21115
Formula: C11H11ON3Cl

Smiles:
CC(C)COc1ncnc2c1C(Cl)=C[N]2
HBA: 4 RingCount: 2
HBD: 0 FractionCSP3: 0.4
AlogP: 2.3 Num_rotatable_bonds: 3
MolWt: 224.67 Num_heavy_atoms: 15
TPSA: 49.11 NumAromaticRings: 1

Sugarmoiety
SD00015

OCC1OC(O)C(O)C1O