Glycoside
...
GD085968

Name:
None

Formula:
C18H21O8NS

Smiles:
CC(=O)O[C@@H]1[C@@H](NC(=S)Oc2ccccc2)OC[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
NC(=S)Oc1ccccc1

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

Other Identifiers

Properties
HBA: 9 RingCount: 2
HBD: 1 FractionCSP3: 0.44
AlogP: 1.09 Num_rotatable_bonds: 5
MolWt: 411.43 Num_heavy_atoms: 28
TPSA: 109.39 NumAromaticRings: 1

Unique Aglycone
AD38246
Formula: C7H7ONS

Smiles:
NC(=S)Oc1ccccc1
HBA: 2 RingCount: 1
HBD: 2 FractionCSP3: 0.0
AlogP: 1.31 Num_rotatable_bonds: 1
MolWt: 153.21 Num_heavy_atoms: 10
TPSA: 35.25 NumAromaticRings: 1

Sugarmoiety
SD00194

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