Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L4P2VO
|
|||
| Ligand Name |
(5s)-6,6-Dimethyl-5-[(6r)-8-Oxo-6,8-Dihydrofuro[3,4-E][1,3]benzodioxol-6-Yl]-5,6,7,8-Tetrahydro[1,3]dioxolo[4,5-G]isoquinolin-6-Ium
|
|||
| Synonyms |
(5s)-6,6-Dimethyl-5-[(6r)-8-Oxo-6,8-Dihydrofuro[3,4-E][1,3]benzodioxol-6-Yl]-5,6,7,8-Tetrahydro[1,3]dioxolo[4,5-G]isoquinolin-6-Ium; MLS001148459; CHEMBL558625; J94; Lopac0_000176; bicuculline-methochloride-(-); CHEMBL515679; cid_104871; (1S,9R)- N-Methylbicuculline; BDBM83106; ZINC629244; BDBM50377980; CCG-204271; NCGC00023413-03; NCGC00023413-04; Q27461657; (6R)-6-[(5S)-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxol[4,5-g]isoquinolin-6-ium-5-yl]-6H-furo[3,4-g][1,3]benzodioxol-8-one;iodide
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C21H20NO6+
|
|||
| Canonical SMILES |
C[N+]1(CCC2=CC3=C(C=C2C1C4C5=C(C6=C(C=C5)OCO6)C(=O)O4)OCO3)C
|
|||
| InChI |
1S/C21H20NO6/c1-22(2)6-5-11-7-15-16(26-9-25-15)8-13(11)18(22)19-12-3-4-14-20(27-10-24-14)17(12)21(23)28-19/h3-4,7-8,18-19H,5-6,9-10H2,1-2H3/q+1/t18-,19+/m0/s1
|
|||
| InChIKey |
WDIQXKYUSINZME-RBUKOAKNSA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.