Glycoside
GD069881
Name:
NoneFormula:
C18H27O6NSmiles:
O=C[C@H](N[C@H]1CC[C@@H](Oc2ccccc2)CC1)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
NC1CCC(Oc2ccccc2)CC1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -0.39 | Num_rotatable_bonds: | 9 |
| MolWt: | 353.42 | Num_heavy_atoms: | 25 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD33097
Formula: C12H17ON
Smiles:
NC1CCC(Oc2ccccc2)CC1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 2.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 191.27 | Num_heavy_atoms: | 14 |
| TPSA: | 35.25 | NumAromaticRings: | 1 |
