Glycoside
...
GD097003

Name:
None

Formula:
C18H23O10NS2

Smiles:
O=S(=O)(N[C@H]1[C@@H](O)O[C@H](COS(O)(O)O)[C@@H](O)[C@@H]1O)c1cccc(-c2ccccc2)c1

Aglycone:
COS(O)(O)O.NS(=O)(=O)c1cccc(-c2ccccc2)c1

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

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 7 FractionCSP3: 0.33
AlogP: 0.59 Num_rotatable_bonds: 7
MolWt: 477.51 Num_heavy_atoms: 31
TPSA: 186.01 NumAromaticRings: 2

Unique Aglycone
AD05139
Formula: C12H11O2NS

Smiles:
NS(=O)(=O)c1cccc(-c2ccccc2)c1
HBA: 3 RingCount: 2
HBD: 2 FractionCSP3: 0.0
AlogP: 2.0 Num_rotatable_bonds: 2
MolWt: 233.29 Num_heavy_atoms: 16
TPSA: 60.16 NumAromaticRings: 2
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