Glycoside
...
GD014703

Name:
None

Formula:
C20H21O11S

Smiles:
O=S(=O)([O-])O[C@@H]1[C@H](Oc2cc(O)cc(C=Cc3ccc(O)cc3)c2)O[C@H](CO)[C@H](O)[C@H]1O

Aglycone:
O=S(=O)([O-])O.Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 5 FractionCSP3: 0.3
AlogP: -0.07 Num_rotatable_bonds: 7
MolWt: 469.44 Num_heavy_atoms: 32
TPSA: 186.04 NumAromaticRings: 2

Unique Aglycone
AD00426
Formula: HO4S

Smiles:
O=S(=O)([O-])O
HBA: 4 RingCount: 0
HBD: 1 FractionCSP3: 0.0
AlogP: -1.0 Num_rotatable_bonds: 0
MolWt: 97.07 Num_heavy_atoms: 5
TPSA: 77.43 NumAromaticRings: 0
AD01773
Formula: C14H12O3

Smiles:
Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1
HBA: 3 RingCount: 2
HBD: 3 FractionCSP3: 0.0
AlogP: 2.97 Num_rotatable_bonds: 2
MolWt: 228.25 Num_heavy_atoms: 17
TPSA: 60.69 NumAromaticRings: 2

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O