Name: (-)-Bicuculline methobromide
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT212666061
Cas No:73604-30-5
常用名:(-)-Bicuculline methobromide
别名:l-Bicuculline methobromide
IUPAC:(5R)-6,6-dimethyl-5-[(10S)-12-oxo-3,5,11-trioxatricyclo[7.3.0.0^{2,6}]dodeca-1,6,8-trien-10-yl]-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide
IUPAC:(5R)-6,6-dimethyl-5-[(10S)-12-oxo-3,5,11-trioxatricyclo[7.3.0.0^{2,6}]dodeca-1,6,8-trien-10-yl]-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide
InChI key:BWXCECYGGMGBHD-VOMIJIAVSA-M

分子式:C21H20BrNO6
分子量:462.296
氢键供体数 (HBD):0
氢键受体数 (HBA):5
LogP:-1.4853793
SMILES:[Br-].C[N+]1(C)CCc2cc3OCOc3cc2[C@@H]1[C@H]1OC(=O)c2c1ccc1OCOc21
SMILES:[Br-].C[N+]1(C)CCc2cc3OCOc3cc2[C@@H]1[C@H]1OC(=O)c2c1ccc1OCOc21

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