Glycoside
GD058137
Name:
NoneFormula:
C15H22O7N2Smiles:
C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CC(N)Cc1ccccc1[N+](=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 6 |
| MolWt: | 342.35 | Num_heavy_atoms: | 24 |
| TPSA: | 145.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD29108
Formula: C9H12O2N2
Smiles:
CC(N)Cc1ccccc1[N+](=O)[O-]| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 3 |
| MolWt: | 180.21 | Num_heavy_atoms: | 13 |
| TPSA: | 69.16 | NumAromaticRings: | 1 |
