Glycoside
...
GD047651

Name:
None

Formula:
C10H17O7N3S

Smiles:
Cn1ccnc1S(=O)(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O

Aglycone:
Cn1ccnc1S(N)(=O)=O

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 2
HBD: 5 FractionCSP3: 0.7
AlogP: -3.5 Num_rotatable_bonds: 4
MolWt: 323.33 Num_heavy_atoms: 21
TPSA: 154.14 NumAromaticRings: 1

Unique Aglycone
AD25589
Formula: C4H7O2N3S

Smiles:
Cn1ccnc1S(N)(=O)=O
HBA: 5 RingCount: 1
HBD: 2 FractionCSP3: 0.25
AlogP: -0.93 Num_rotatable_bonds: 1
MolWt: 161.19 Num_heavy_atoms: 10
TPSA: 77.98 NumAromaticRings: 1

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O