Glycoside
GD072605
Name:
NoneFormula:
C19H24O7N2Smiles:
O=C(C(=O)N1CC[C@@H]2[C@H]1CCC(=O)N2c1ccccc1)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
O=C1CCC2NCCC2N1c1ccccc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 6 |
| MolWt: | 392.41 | Num_heavy_atoms: | 28 |
| TPSA: | 138.61 | NumAromaticRings: | 1 |
Unique Aglycone
AD33833
Formula: C13H16ON2
Smiles:
O=C1CCC2NCCC2N1c1ccccc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.46 |
| AlogP: | 1.54 | Num_rotatable_bonds: | 1 |
| MolWt: | 216.28 | Num_heavy_atoms: | 16 |
| TPSA: | 32.34 | NumAromaticRings: | 1 |
