Glycoside
GD136284
Name:
2-{2-[6-(2-hydroxy-2-phenylethyl)-1-methylpiperidin-2-yl]-1-phenylethoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C28H39O7NSmiles:
CN1C(CC(O)c2ccccc2)CCCC1CC(OC1OC(CO)C(O)C(O)C1O)c1ccccc1Aglycone:
CN1C(CC(O)c2ccccc2)CCCC1CC(O)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 9 |
| MolWt: | 501.62 | Num_heavy_atoms: | 36 |
| TPSA: | 122.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD55084
Formula: C22H29O2N
Smiles:
CN1C(CC(O)c2ccccc2)CCCC1CC(O)c1ccccc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 4.09 | Num_rotatable_bonds: | 6 |
| MolWt: | 339.48 | Num_heavy_atoms: | 25 |
| TPSA: | 43.7 | NumAromaticRings: | 2 |
