Name: Capnoidine
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212710331
Cas No:485-50-7
常用名:Capnoidine
别名:l-Capnoidine, l-Adlumidine, (-)-Adlumidine
别名:l-Capnoidine, l-Adlumidine, (-)-Adlumidine
IUPAC:(10R)-10-[(5R)-6-methyl-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3,5,11-trioxatricyclo[7.3.0.0^{2,6}]dodeca-1,6,8-trien-12-one
IUPAC:(10R)-10-[(5R)-6-methyl-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3,5,11-trioxatricyclo[7.3.0.0^{2,6}]dodeca-1,6,8-trien-12-one
InChI key:IYGYMKDQCDOMRE-QZTJIDSGSA-N

分子式:C20H17NO6
分子量:367.357
氢键供体数 (HBD):0
氢键受体数 (HBA):6
LogP:2.6769574
SMILES:CN1CCc2cc3OCOc3cc2[C@@H]1[C@@H]1OC(=O)c2c1ccc1OCOc21
SMILES:CN1CCc2cc3OCOc3cc2[C@@H]1[C@@H]1OC(=O)c2c1ccc1OCOc21

Capnoidine is a potential new anti-inflammatory drug lead candidate for diseases where current standard-of-care often fails and is associated with major side effects.

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