Glycoside
GD072587
Name:
NoneFormula:
C19H26O6N2Smiles:
O=C(C(=O)N1CCN(C/C=C/c2ccccc2)CC1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
C(=Cc1ccccc1)CN1CCNCC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.51 | Num_rotatable_bonds: | 8 |
| MolWt: | 378.43 | Num_heavy_atoms: | 27 |
| TPSA: | 121.54 | NumAromaticRings: | 1 |
Unique Aglycone
AD33826
Formula: C13H18N2
Smiles:
C(=Cc1ccccc1)CN1CCNCC1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.38 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 3 |
| MolWt: | 202.3 | Num_heavy_atoms: | 15 |
| TPSA: | 15.27 | NumAromaticRings: | 1 |
