Glycoside
...
GD063699

Name:
None

Formula:
C11H20O9NFS

Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](COS(O)(O)O)[C@@H](O)[C@@H]1O)[C@H]1C[C@@H](F)C1

Aglycone:
COS(O)(O)O.NC(=O)C1CC(F)C1

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

Other Identifiers

Properties
HBA: 10 RingCount: 2
HBD: 7 FractionCSP3: 0.91
AlogP: -1.19 Num_rotatable_bonds: 5
MolWt: 361.34 Num_heavy_atoms: 23
TPSA: 168.94 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
AD30647
Formula: C5H8ONF

Smiles:
NC(=O)C1CC(F)C1
HBA: 2 RingCount: 1
HBD: 2 FractionCSP3: 0.8
AlogP: 0.22 Num_rotatable_bonds: 1
MolWt: 117.12 Num_heavy_atoms: 8
TPSA: 43.09 NumAromaticRings: 0

Sugarmoiety
SD00017

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