Glycoside
...
GD073571

Name:
None

Formula:
C14H22O9N2S

Smiles:
CC1(C)[C@H](C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)N2C(=O)C[C@H]2S1(=O)=O

Aglycone:
CC1(C)C(C(N)=O)N2C(=O)CC2S1(=O)=O

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

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 5 FractionCSP3: 0.86
AlogP: -3.96 Num_rotatable_bonds: 3
MolWt: 394.4 Num_heavy_atoms: 26
TPSA: 173.7 NumAromaticRings: 0

Unique Aglycone
AD34083
Formula: C8H12O4N2S

Smiles:
CC1(C)C(C(N)=O)N2C(=O)CC2S1(=O)=O
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.75
AlogP: -1.39 Num_rotatable_bonds: 1
MolWt: 232.26 Num_heavy_atoms: 15
TPSA: 97.54 NumAromaticRings: 0

Sugarmoiety
SD00003

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