Glycoside
...
GD091503

Name:
None

Formula:
C16H24O5N6S2

Smiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NC(=S)NCCC[S@](C)=O)ncnc21

Aglycone:
CS(=O)CCCNC(=S)Nc1ncnc2c1N=C[N]2

Sugarmoiety:
COC1C(O)OC(CO)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 4 FractionCSP3: 0.62
AlogP: -0.85 Num_rotatable_bonds: 8
MolWt: 444.54 Num_heavy_atoms: 29
TPSA: 143.65 NumAromaticRings: 2

Unique Aglycone
AD38798
Formula: C10H13ON6S2

Smiles:
CS(=O)CCCNC(=S)Nc1ncnc2c1N=C[N]2
HBA: 7 RingCount: 2
HBD: 2 FractionCSP3: 0.4
AlogP: 0.44 Num_rotatable_bonds: 5
MolWt: 297.39 Num_heavy_atoms: 19
TPSA: 93.37 NumAromaticRings: 1

Sugarmoiety
SD00119

COC1C(O)OC(CO)C1O