HIT ID: HIT212717034
Cas No: 246018-80-4
分子式: C22H27NO2
分子量: 337.463
常用名: Lobeline, (+)-
氢键受体数 (HBA): 3
氢键供体数 (HBD): 1
LogP: 3.7834027
IUPAC: 2-[(2S,6R)-6-[(2R)-2-hydroxy-2-phenylethyl]-1-methylpiperidin-2-yl]-1-phenylethan-1-one
IUPAC: 2-[(2S,6R)-6-[(2R)-2-hydroxy-2-phenylethyl]-1-methylpiperidin-2-yl]-1-phenylethan-1-one
SMILES: CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1CC(=O)c1ccccc1
SMILES: CN1[C@@H](C[C@@H](O)c2ccccc2)CCC[C@H]1CC(=O)c1ccccc1
InChI key: MXYUKLILVYORSK-QHAWAJNXSA-N