Glycoside
...
GD057384

Name:
None

Formula:
C12H28O8NS

Smiles:
CCCC[C@@H](C)[NH2+][C@H]1[C@H](O)O[C@H](COS(O)(O)O)[C@@H](O)[C@@H]1O

Aglycone:
CCCCC(C)[NH3+].COS(O)(O)O

Sugarmoiety:
OC1OC(O)C([OH2+])C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 1
HBD: 8 FractionCSP3: 1.0
AlogP: -0.91 Num_rotatable_bonds: 8
MolWt: 346.42 Num_heavy_atoms: 22
TPSA: 156.45 NumAromaticRings: 0

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
AD28775
Formula: C6H16N

Smiles:
CCCCC(C)[NH3+]
HBA: 1 RingCount: 0
HBD: 3 FractionCSP3: 1.0
AlogP: 0.81 Num_rotatable_bonds: 3
MolWt: 102.2 Num_heavy_atoms: 7
TPSA: 27.64 NumAromaticRings: 0

Sugarmoiety
SD03900

OC1OC(O)C([OH2+])C(O)C1O