Glycoside
GD090329
Name:
NoneFormula:
C22H30O7N2Smiles:
CCN1C(=O)[C@H](c2ccccc2)CC12CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)CC2Aglycone:
CCN1C(=O)C(c2ccccc2)CC12CCNCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | -0.97 | Num_rotatable_bonds: | 7 |
| MolWt: | 434.49 | Num_heavy_atoms: | 31 |
| TPSA: | 138.61 | NumAromaticRings: | 1 |
Unique Aglycone
AD39320
Formula: C16H22ON2
Smiles:
CCN1C(=O)C(c2ccccc2)CC12CCNCC2| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.56 |
| AlogP: | 2.14 | Num_rotatable_bonds: | 2 |
| MolWt: | 258.36 | Num_heavy_atoms: | 19 |
| TPSA: | 32.34 | NumAromaticRings: | 1 |
