Glycoside
GD061716
Name:
NoneFormula:
C18H27O5NSmiles:
O=C[C@H](N[C@@H]1CCC[C@@H](c2ccccc2)C1)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
NC1CCCC(c2ccccc2)C1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 8 |
| MolWt: | 337.42 | Num_heavy_atoms: | 24 |
| TPSA: | 110.02 | NumAromaticRings: | 1 |
Unique Aglycone
AD30201
Formula: C12H17N
Smiles:
NC1CCCC(c2ccccc2)C1| HBA: | 1 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 2.67 | Num_rotatable_bonds: | 1 |
| MolWt: | 175.27 | Num_heavy_atoms: | 13 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
