Glycoside

GD019233
Name:
NoneFormula:
C36H55O28NSmiles:
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O[C@@H]4O[C@H](CO)[C@H](O[C@@H]5O[C@H](CO)[C@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1Aglycone:
O=[N+]([O-])c1ccc(O)cc1Sugarmoiety:
OCC1OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 29 | RingCount: | 6 |
HBD: | 16 | FractionCSP3: | 0.83 |
AlogP: | -9.93 | Num_rotatable_bonds: | 16 |
MolWt: | 949.82 | Num_heavy_atoms: | 65 |
TPSA: | 459.12 | NumAromaticRings: | 1 |
Unique Aglycone
AD00091
Formula: C6H5O3N
Smiles:
O=[N+]([O-])c1ccc(O)cc1HBA: | 4 | RingCount: | 1 |
HBD: | 1 | FractionCSP3: | 0.0 |
AlogP: | 1.3 | Num_rotatable_bonds: | 1 |
MolWt: | 139.11 | Num_heavy_atoms: | 10 |
TPSA: | 63.37 | NumAromaticRings: | 1 |
Sugarmoiety

SD01945
OCC1OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O