Glycoside
GD076097
Name:
NoneFormula:
C17H25O7N3Smiles:
O=C[C@H](NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -1.2 | Num_rotatable_bonds: | 9 |
| MolWt: | 383.4 | Num_heavy_atoms: | 27 |
| TPSA: | 156.4 | NumAromaticRings: | 1 |
Unique Aglycone
AD35172
Formula: C11H15O2N3
Smiles:
NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 1.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 221.26 | Num_heavy_atoms: | 16 |
| TPSA: | 72.4 | NumAromaticRings: | 1 |
