Glycoside
...
GD096127

Name:
None

Formula:
C20H21O8N3S

Smiles:
O=S(=O)(Nc1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1)c1ccc2nccnc2c1

Aglycone:
O=S(=O)(Nc1ccc(O)cc1)c1ccc2nccnc2c1

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

Other Identifiers

Properties
HBA: 11 RingCount: 4
HBD: 5 FractionCSP3: 0.3
AlogP: -0.39 Num_rotatable_bonds: 6
MolWt: 463.47 Num_heavy_atoms: 32
TPSA: 171.33 NumAromaticRings: 3

Unique Aglycone
AD40884
Formula: C14H11O3N3S

Smiles:
O=S(=O)(Nc1ccc(O)cc1)c1ccc2nccnc2c1
HBA: 6 RingCount: 3
HBD: 2 FractionCSP3: 0.0
AlogP: 2.14 Num_rotatable_bonds: 3
MolWt: 301.33 Num_heavy_atoms: 21
TPSA: 92.18 NumAromaticRings: 3

Sugarmoiety
SD00003

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