Glycoside
...
GD079039

Name:
None

Formula:
C18H19O7NS

Smiles:
CC(=O)O[C@@H]1[C@@H](c2nc3ccccc3s2)OC[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
c1ccc2scnc2c1

Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 8 RingCount: 3
HBD: 0 FractionCSP3: 0.44
AlogP: 2.16 Num_rotatable_bonds: 4
MolWt: 393.42 Num_heavy_atoms: 27
TPSA: 101.02 NumAromaticRings: 2

Unique Aglycone
AD02122
Formula: C7H5NS

Smiles:
c1ccc2scnc2c1
HBA: 1 RingCount: 2
HBD: 0 FractionCSP3: 0.0
AlogP: 2.3 Num_rotatable_bonds: 0
MolWt: 135.19 Num_heavy_atoms: 9
TPSA: 12.89 NumAromaticRings: 2

Sugarmoiety
SD00194

CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=O