Glycoside
...
GD070701

Name:
None

Formula:
C19H20O4N2S

Smiles:
OC[C@@H]1O[C@H](n2c(SCc3ccccc3)nc3ccccc32)[C@H](O)[C@@H]1O

Aglycone:
c1ccc(CSC2=Nc3ccccc3[N]2)cc1

Sugarmoiety:
OCC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 6 RingCount: 4
HBD: 3 FractionCSP3: 0.32
AlogP: 1.94 Num_rotatable_bonds: 5
MolWt: 372.45 Num_heavy_atoms: 26
TPSA: 87.74 NumAromaticRings: 3

Unique Aglycone
AD33475
Formula: C14H11N2S

Smiles:
c1ccc(CSC2=Nc3ccccc3[N]2)cc1
HBA: 2 RingCount: 3
HBD: 0 FractionCSP3: 0.07
AlogP: 3.86 Num_rotatable_bonds: 2
MolWt: 239.32 Num_heavy_atoms: 17
TPSA: 26.46 NumAromaticRings: 2

Sugarmoiety
SD00015

OCC1OC(O)C(O)C1O