Glycoside
...
GD078993

Name:
None

Formula:
C17H20O9N2

Smiles:
CC(=O)O[C@H]1CO[C@@H](Nc2ccc([N+](=O)[O-])cc2)[C@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
Nc1ccc([N+](=O)[O-])cc1

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

Other Identifiers

Properties
HBA: 11 RingCount: 2
HBD: 1 FractionCSP3: 0.47
AlogP: 1.16 Num_rotatable_bonds: 6
MolWt: 396.35 Num_heavy_atoms: 28
TPSA: 143.3 NumAromaticRings: 1

Unique Aglycone
AD16727
Formula: C6H6O2N2

Smiles:
Nc1ccc([N+](=O)[O-])cc1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.0
AlogP: 1.18 Num_rotatable_bonds: 1
MolWt: 138.13 Num_heavy_atoms: 10
TPSA: 69.16 NumAromaticRings: 1

Sugarmoiety
SD00194

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