Lotusine
HIT212658933
sdf文件结构编辑类似物检索
HIT ID: HIT212658933
Cas No: 6871-67-6
分子式: C19H24NO3
分子量: 314.404
常用名: Lotusine
氢键受体数 (HBA): 3
氢键供体数 (HBD): 2
LogP: -0.89970607
IUPAC: (1R)-6-hydroxy-1-[(4-hydroxyphenyl)methyl]-7-methoxy-2,2-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium
IUPAC: (1R)-6-hydroxy-1-[(4-hydroxyphenyl)methyl]-7-methoxy-2,2-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium
SMILES: COc1cc2[C@@H](Cc3ccc(O)cc3)[N+](C)(C)CCc2cc1O
SMILES: COc1cc2[C@@H](Cc3ccc(O)cc3)[N+](C)(C)CCc2cc1O
InChI key: ZKTMLINFIQCERN-QGZVFWFLSA-O
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