Glycoside
...
GD031973

Name:
None

Formula:
C13H18O5N4

Smiles:
CNc1ccnc2c1ncn2[C@@H]1O[C@H](CO)[C@](O)(CO)[C@H]1O

Aglycone:
CNc1ccnc2c1N=C[N]2

Sugarmoiety:
OCC1OC(O)C(O)C1(O)CO

Other Identifiers

Properties
HBA: 9 RingCount: 3
HBD: 5 FractionCSP3: 0.54
AlogP: -1.55 Num_rotatable_bonds: 4
MolWt: 310.31 Num_heavy_atoms: 22
TPSA: 132.89 NumAromaticRings: 2

Unique Aglycone
AD12158
Formula: C7H7N4

Smiles:
CNc1ccnc2c1N=C[N]2
HBA: 4 RingCount: 2
HBD: 1 FractionCSP3: 0.14
AlogP: 1.03 Num_rotatable_bonds: 1
MolWt: 147.16 Num_heavy_atoms: 11
TPSA: 51.38 NumAromaticRings: 1

Sugarmoiety
SD00936

OCC1OC(O)C(O)C1(O)CO