Glycoside
...
GD035640

Name:
None

Formula:
C20H27O12N

Smiles:
COC(=O)c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](OCC(=O)OC(C)(C)C)[C@H]2O)c([N+](=O)[O-])c1

Aglycone:
CC(C)(C)OC(=O)CO.COC(=O)c1ccc(O)c([N+](=O)[O-])c1

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

Other Identifiers

Properties
HBA: 13 RingCount: 2
HBD: 3 FractionCSP3: 0.6
AlogP: -0.07 Num_rotatable_bonds: 8
MolWt: 473.43 Num_heavy_atoms: 33
TPSA: 184.12 NumAromaticRings: 1

Unique Aglycone
AD06804
Formula: C6H12O3

Smiles:
CC(C)(C)OC(=O)CO
HBA: 3 RingCount: 0
HBD: 1 FractionCSP3: 0.83
AlogP: 0.32 Num_rotatable_bonds: 1
MolWt: 132.16 Num_heavy_atoms: 9
TPSA: 46.53 NumAromaticRings: 0
AD06805
Formula: C8H7O5N

Smiles:
COC(=O)c1ccc(O)c([N+](=O)[O-])c1
HBA: 6 RingCount: 1
HBD: 1 FractionCSP3: 0.12
AlogP: 1.09 Num_rotatable_bonds: 2
MolWt: 197.15 Num_heavy_atoms: 14
TPSA: 89.67 NumAromaticRings: 1

Sugarmoiety
SD00003

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