Glycoside
...
GD105169

Name:
None

Formula:
C24H18O9N2

Smiles:
O=C(O[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H](OC(=O)c1ccccc1)C(=O)O)c1ccccc1

Aglycone:
Nc1cccc([N+](=O)[O-])c1.O=Cc1ccccc1.O=Cc1ccccc1

Sugarmoiety:
O=C(O)C(OO)C(OO)C(=O)O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 2 FractionCSP3: 0.08
AlogP: 3.07 Num_rotatable_bonds: 9
MolWt: 478.41 Num_heavy_atoms: 35
TPSA: 162.14 NumAromaticRings: 3

Unique Aglycone
AD01696
Formula: C7H6O

Smiles:
O=Cc1ccccc1
HBA: 1 RingCount: 1
HBD: 0 FractionCSP3: 0.0
AlogP: 1.5 Num_rotatable_bonds: 1
MolWt: 106.12 Num_heavy_atoms: 8
TPSA: 17.07 NumAromaticRings: 1
AD25353
Formula: C6H6O2N2

Smiles:
Nc1cccc([N+](=O)[O-])c1
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
SD00296

O=C(O)C(OO)C(OO)C(=O)O