Glycoside
...
GD070724

Name:
None

Formula:
C14H16O5N4S

Smiles:
CC(=O)O[C@H]1[C@H](C)O[C@@H](n2cnc3c(=S)[nH]cnc32)[C@H]1OC(C)=O

Aglycone:
S=c1[nH]cnc2c1N=C[N]2

Sugarmoiety:
CC(=O)OC1C(C)OC(O)C1OC(C)=O

Other Identifiers

Properties
HBA: 9 RingCount: 3
HBD: 1 FractionCSP3: 0.5
AlogP: 1.27 Num_rotatable_bonds: 3
MolWt: 352.37 Num_heavy_atoms: 24
TPSA: 108.33 NumAromaticRings: 2

Unique Aglycone
AD25255
Formula: C5H3N4S

Smiles:
S=c1[nH]cnc2c1N=C[N]2
HBA: 4 RingCount: 2
HBD: 1 FractionCSP3: 0.0
AlogP: 1.05 Num_rotatable_bonds: 0
MolWt: 151.17 Num_heavy_atoms: 10
TPSA: 55.14 NumAromaticRings: 1

Sugarmoiety
SD01746

CC(=O)OC1C(C)OC(O)C1OC(C)=O