Glycoside
...
GD056826

Name:
None

Formula:
C13H20O7N2S

Smiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2ccncc2)[C@@H](O)[C@H](O)[C@@H]1O

Aglycone:
O=S(=O)(NCCO)c1ccncc1

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 2
HBD: 4 FractionCSP3: 0.62
AlogP: -1.8 Num_rotatable_bonds: 6
MolWt: 348.38 Num_heavy_atoms: 23
TPSA: 138.21 NumAromaticRings: 1

Unique Aglycone
AD28554
Formula: C7H10O3N2S

Smiles:
O=S(=O)(NCCO)c1ccncc1
HBA: 5 RingCount: 1
HBD: 2 FractionCSP3: 0.29
AlogP: -0.65 Num_rotatable_bonds: 4
MolWt: 202.24 Num_heavy_atoms: 13
TPSA: 79.29 NumAromaticRings: 1

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O