Glycoside
...
GD101912

Name:
None

Formula:
C22H27O9NS

Smiles:
COc1ccc(OC)c(C(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)cc2)c1OC

Aglycone:
COc1ccc(OC)c(C(=O)Nc2ccc(S)cc2)c1OC

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

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 5 FractionCSP3: 0.41
AlogP: 0.86 Num_rotatable_bonds: 8
MolWt: 481.52 Num_heavy_atoms: 33
TPSA: 146.94 NumAromaticRings: 2

Unique Aglycone
AD43148
Formula: C16H17O4NS

Smiles:
COc1ccc(OC)c(C(=O)Nc2ccc(S)cc2)c1OC
HBA: 5 RingCount: 2
HBD: 1 FractionCSP3: 0.19
AlogP: 3.25 Num_rotatable_bonds: 5
MolWt: 319.38 Num_heavy_atoms: 22
TPSA: 56.79 NumAromaticRings: 2

Sugarmoiety
SD00003

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