Glycoside
...
GD026824

Name:
None

Formula:
C20H25O8N5S

Smiles:
CC(=O)O[C@@H]1[C@@H](NC(=S)NNC(=O)Cn2cnc3ccccc32)O[C@@H](CO)[C@@H](O)[C@H]1OC(C)=O

Aglycone:
NC(=S)NNC(=O)Cn1cnc2ccccc21

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

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 5 FractionCSP3: 0.45
AlogP: -1.53 Num_rotatable_bonds: 6
MolWt: 495.51 Num_heavy_atoms: 34
TPSA: 173.27 NumAromaticRings: 2

Unique Aglycone
AD16083
Formula: C10H11ON5S

Smiles:
NC(=S)NNC(=O)Cn1cnc2ccccc21
HBA: 6 RingCount: 2
HBD: 4 FractionCSP3: 0.1
AlogP: -0.1 Num_rotatable_bonds: 2
MolWt: 249.3 Num_heavy_atoms: 17
TPSA: 84.97 NumAromaticRings: 2

Sugarmoiety
SD00614

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