Glycoside
...
GD108418

Name:
None

Formula:
C23H30O10N4S2

Smiles:
CSc1ncnc2c1ncn2[C@@H](SC)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](COC(C)=O)OC(C)=O

Aglycone:
CSCn1cnc2c(SC)ncnc21

Sugarmoiety:
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(O)OC(C)=O

Other Identifiers

Properties
HBA: 14 RingCount: 2
HBD: 0 FractionCSP3: 0.57
AlogP: 1.7 Num_rotatable_bonds: 13
MolWt: 586.65 Num_heavy_atoms: 39
TPSA: 175.1 NumAromaticRings: 2

Unique Aglycone
AD44431
Formula: C8H10N4S2

Smiles:
CSCn1cnc2c(SC)ncnc21
HBA: 4 RingCount: 2
HBD: 0 FractionCSP3: 0.38
AlogP: 1.87 Num_rotatable_bonds: 3
MolWt: 226.33 Num_heavy_atoms: 14
TPSA: 43.6 NumAromaticRings: 2

Sugarmoiety
SD00291

CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(O)OC(C)=O