Glycoside
...
GD084095

Name:
None

Formula:
C20H23O7NS

Smiles:
C[C@H](C(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccc(C(=O)c2cccs2)cc1

Aglycone:
CC(C(N)=O)c1ccc(C(=O)c2cccs2)cc1

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

Other Identifiers

Properties
HBA: 8 RingCount: 3
HBD: 5 FractionCSP3: 0.4
AlogP: 0.0 Num_rotatable_bonds: 6
MolWt: 421.47 Num_heavy_atoms: 29
TPSA: 136.32 NumAromaticRings: 2

Unique Aglycone
AD37529
Formula: C14H13O2NS

Smiles:
CC(C(N)=O)c1ccc(C(=O)c2cccs2)cc1
HBA: 3 RingCount: 2
HBD: 2 FractionCSP3: 0.14
AlogP: 2.57 Num_rotatable_bonds: 4
MolWt: 259.33 Num_heavy_atoms: 18
TPSA: 60.16 NumAromaticRings: 2

Sugarmoiety
SD00003

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