Glycoside
...
GD089823

Name:
None

Formula:
C16H30O8N4S

Smiles:
CCCN(CCC)c1cncc(N[C@H]2[C@H](O)O[C@H](COS(O)(O)O)[C@@H](O)[C@@H]2O)n1

Aglycone:
CCCN(CCC)c1cncc(N)n1.COS(O)(O)O

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

Other Identifiers

Properties
HBA: 12 RingCount: 2
HBD: 7 FractionCSP3: 0.75
AlogP: 0.48 Num_rotatable_bonds: 10
MolWt: 438.5 Num_heavy_atoms: 29
TPSA: 180.89 NumAromaticRings: 1

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
AD32893
Formula: C10H18N4

Smiles:
CCCN(CCC)c1cncc(N)n1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.6
AlogP: 1.69 Num_rotatable_bonds: 5
MolWt: 194.28 Num_heavy_atoms: 14
TPSA: 55.04 NumAromaticRings: 1

Sugarmoiety
SD00017

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