Glycoside
...
GD002981

Name:
None

Formula:
C14H19O10N4PS

Smiles:
NS(=O)(=O)c1ccc(-c2cn([C@@H]3O[C@H](COP(=O)(O)O)[C@H](O)[C@H](O)[C@H]3O)nn2)cc1

Aglycone:
COP(=O)(O)O.NS(=O)(=O)c1ccc(C2=C[N]N=N2)cc1

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 7 FractionCSP3: 0.43
AlogP: -2.32 Num_rotatable_bonds: 6
MolWt: 466.37 Num_heavy_atoms: 30
TPSA: 227.55 NumAromaticRings: 2

Unique Aglycone
AD00079
Formula: CH5O4P

Smiles:
COP(=O)(O)O
HBA: 4 RingCount: 0
HBD: 2 FractionCSP3: 1.0
AlogP: -0.27 Num_rotatable_bonds: 1
MolWt: 112.02 Num_heavy_atoms: 6
TPSA: 66.76 NumAromaticRings: 0
AD01018
Formula: C8H7O2N4S

Smiles:
NS(=O)(=O)c1ccc(C2=C[N]N=N2)cc1
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.0
AlogP: 0.62 Num_rotatable_bonds: 2
MolWt: 223.24 Num_heavy_atoms: 15
TPSA: 98.98 NumAromaticRings: 1

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O