Glycoside
...
GD089798

Name:
None

Formula:
C15H21O8N3S2

Smiles:
O[C@@H]1[C@@H](COS(O)(O)O)O[C@H](O)[C@H](Nc2ncnc3sc4c(c23)CCC4)[C@H]1O

Aglycone:
COS(O)(O)O.Nc1ncnc2sc3c(c12)CCC3

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 4
HBD: 7 FractionCSP3: 0.6
AlogP: 0.55 Num_rotatable_bonds: 5
MolWt: 435.48 Num_heavy_atoms: 28
TPSA: 177.65 NumAromaticRings: 2

Unique Aglycone
AD12993
Formula: CH6O4S

Smiles:
COS(O)(O)O
HBA: 4 RingCount: 0
HBD: 3 FractionCSP3: 1.0
AlogP: 0.77 Num_rotatable_bonds: 1
MolWt: 114.12 Num_heavy_atoms: 6
TPSA: 69.92 NumAromaticRings: 0
AD32887
Formula: C9H9N3S

Smiles:
Nc1ncnc2sc3c(c12)CCC3
HBA: 3 RingCount: 3
HBD: 2 FractionCSP3: 0.33
AlogP: 1.76 Num_rotatable_bonds: 0
MolWt: 191.26 Num_heavy_atoms: 13
TPSA: 51.8 NumAromaticRings: 2

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O