Glycoside
...
GD063579

Name:
None

Formula:
C12H25O9NS

Smiles:
CC(C)[C@@H](C)C(=O)N[C@H]1[C@@H](O)O[C@H](COS(O)(O)O)[C@@H](O)[C@@H]1O

Aglycone:
CC(C)C(C)C(N)=O.COS(O)(O)O

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

Other Identifiers

Properties
HBA: 10 RingCount: 1
HBD: 7 FractionCSP3: 0.92
AlogP: -0.64 Num_rotatable_bonds: 6
MolWt: 359.4 Num_heavy_atoms: 23
TPSA: 168.94 NumAromaticRings: 0

Unique Aglycone
AD02890
Formula: C6H13ON

Smiles:
CC(C)C(C)C(N)=O
HBA: 2 RingCount: 0
HBD: 2 FractionCSP3: 0.83
AlogP: 0.76 Num_rotatable_bonds: 2
MolWt: 115.18 Num_heavy_atoms: 8
TPSA: 43.09 NumAromaticRings: 0
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

Sugarmoiety
SD00017

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