Name: Bicuculline methochloride
Rating: 5 (10 reviews)

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HIT ID:HIT218840607
Cas No:53552-05-9;38641-83-7
常用名:Bicuculline methochloride
别名:甲氯化荷包牡丹碱, (-)-Bicuculline methochloride
IUPAC:(5S)-6,6-dimethyl-5-[(10R)-12-oxo-3,5,11-trioxatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),7-trien-10-yl]-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
IUPAC:(5S)-6,6-dimethyl-5-[(10R)-12-oxo-3,5,11-trioxatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),7-trien-10-yl]-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
InChI key:RLJKFAMYSYWMND-GRTNUQQKSA-M

分子式:C21H20ClNO6
分子量:417.84
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[Cl-].[H][C@]1(OC(=O)c2c3OCOc3ccc12)[C@]1([H])c2cc3OCOc3cc2CC[N+]1(C)C
SMILES:[Cl-].[H][C@]1(OC(=O)c2c3OCOc3ccc12)[C@]1([H])c2cc3OCOc3cc2CC[N+]1(C)C

Bicuculline methochloride is a competitive GABAA receptor antagonist and allosteric inhibitor with an IC50 of 1.7 μM. It blocks Ca²⁺-dependent activation of potassium channels, exhibits convulsant activity, and is suitable for epilepsy research.

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