Glycoside
...
GD013509

Name:
None

Formula:
C16H17O4N5S

Smiles:
OC[C@@H]1O[C@H](n2cnc3c(CSc4ccccn4)ncnc32)[C@H](O)[C@H]1O

Aglycone:
C1=Nc2c(CSc3ccccn3)ncnc2[N]1

Sugarmoiety:
OCC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 4
HBD: 3 FractionCSP3: 0.38
AlogP: 0.13 Num_rotatable_bonds: 5
MolWt: 375.41 Num_heavy_atoms: 26
TPSA: 126.41 NumAromaticRings: 3

Unique Aglycone
AD10070
Formula: C11H8N5S

Smiles:
C1=Nc2c(CSc3ccccn3)ncnc2[N]1
HBA: 5 RingCount: 3
HBD: 0 FractionCSP3: 0.09
AlogP: 2.07 Num_rotatable_bonds: 3
MolWt: 242.29 Num_heavy_atoms: 17
TPSA: 65.13 NumAromaticRings: 2

Sugarmoiety
SD00015

OCC1OC(O)C(O)C1O