Glycoside
GD075685
Name:
NoneFormula:
C18H27O7N2Smiles:
O=C(Nc1ccc(OCC[NH+]2CCCC2)cc1)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
Nc1ccc(OCC[NH+]2CCCC2)cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -2.67 | Num_rotatable_bonds: | 10 |
| MolWt: | 383.42 | Num_heavy_atoms: | 27 |
| TPSA: | 140.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD35057
Formula: C12H19ON2
Smiles:
Nc1ccc(OCC[NH+]2CCCC2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.33 | Num_rotatable_bonds: | 4 |
| MolWt: | 207.3 | Num_heavy_atoms: | 15 |
| TPSA: | 39.69 | NumAromaticRings: | 1 |
