Glycoside
...
GD094338

Name:
None

Formula:
C17H27O12NS2

Smiles:
CC(C)(C)C(=O)Oc1ccc(S(=O)(=O)N[C@H]2[C@@H](O)O[C@H](COS(O)(O)O)[C@@H](O)[C@@H]2O)cc1

Aglycone:
CC(C)(C)C(=O)Oc1ccc(S(N)(=O)=O)cc1.COS(O)(O)O

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

Other Identifiers

Properties
HBA: 13 RingCount: 2
HBD: 7 FractionCSP3: 0.59
AlogP: -0.12 Num_rotatable_bonds: 7
MolWt: 501.53 Num_heavy_atoms: 32
TPSA: 212.31 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
AD36924
Formula: C11H15O4NS

Smiles:
CC(C)(C)C(=O)Oc1ccc(S(N)(=O)=O)cc1
HBA: 5 RingCount: 1
HBD: 2 FractionCSP3: 0.36
AlogP: 1.29 Num_rotatable_bonds: 2
MolWt: 257.31 Num_heavy_atoms: 17
TPSA: 86.46 NumAromaticRings: 1

Sugarmoiety
SD00017

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