Glycoside
...
GD101945

Name:
None

Formula:
C18H25O5N6Br

Smiles:
C[C@H]1CC[C@H](NC(=O)Nc2ncnc3c2nc(Br)n3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CC1

Aglycone:
CC1CCC(NC(=O)Nc2ncnc3c2N=C(Br)[N]3)CC1

Sugarmoiety:
OCC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 4
HBD: 5 FractionCSP3: 0.67
AlogP: 0.9 Num_rotatable_bonds: 4
MolWt: 485.34 Num_heavy_atoms: 30
TPSA: 154.65 NumAromaticRings: 2

Unique Aglycone
AD43160
Formula: C13H16ON6Br

Smiles:
CC1CCC(NC(=O)Nc2ncnc3c2N=C(Br)[N]3)CC1
HBA: 7 RingCount: 3
HBD: 2 FractionCSP3: 0.54
AlogP: 2.81 Num_rotatable_bonds: 2
MolWt: 352.22 Num_heavy_atoms: 21
TPSA: 93.37 NumAromaticRings: 1

Sugarmoiety
SD00015

OCC1OC(O)C(O)C1O