Glycoside
...
GD096997

Name:
None

Formula:
C13H15O7N4S2Br

Smiles:
NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1NS(=O)(=O)c1ccc(Br)s1

Aglycone:
NC(=O)C1=C(NS(=O)(=O)c2ccc(Br)s2)[N]C=N1

Sugarmoiety:
OCC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 6 FractionCSP3: 0.38
AlogP: -0.78 Num_rotatable_bonds: 6
MolWt: 483.32 Num_heavy_atoms: 27
TPSA: 177.0 NumAromaticRings: 2

Unique Aglycone
AD41230
Formula: C8H6O3N4S2Br

Smiles:
NC(=O)C1=C(NS(=O)(=O)c2ccc(Br)s2)[N]C=N1
HBA: 7 RingCount: 2
HBD: 3 FractionCSP3: 0.0
AlogP: 0.09 Num_rotatable_bonds: 4
MolWt: 350.2 Num_heavy_atoms: 18
TPSA: 115.72 NumAromaticRings: 1

Sugarmoiety
SD00015

OCC1OC(O)C(O)C1O