Glycoside
...
GD103531

Name:
None

Formula:
C18H20O12N2

Smiles:
COC(=O)[C@]1(Oc2cccnc2[N+](=O)[O-])OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
O=[N+]([O-])c1ncccc1O

Sugarmoiety:
COC(=O)C1(O)OCC(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 14 RingCount: 2
HBD: 0 FractionCSP3: 0.5
AlogP: 0.06 Num_rotatable_bonds: 7
MolWt: 456.36 Num_heavy_atoms: 32
TPSA: 179.69 NumAromaticRings: 1

Unique Aglycone
AD43824
Formula: C5H4O3N2

Smiles:
O=[N+]([O-])c1ncccc1O
HBA: 5 RingCount: 1
HBD: 1 FractionCSP3: 0.0
AlogP: 0.7 Num_rotatable_bonds: 1
MolWt: 140.1 Num_heavy_atoms: 10
TPSA: 76.26 NumAromaticRings: 1

Sugarmoiety
SD04085

COC(=O)C1(O)OCC(OC(C)=O)C(OC(C)=O)C1OC(C)=O