8AM2-N0C
General
Type : Trimethylammonium,Pyridine
Chemical_Nomenclature : trimethyl-[2-oxo-2-[2-[[2-phenyl-6-[(E)-[[2-(trimethylazaniumyl)acetyl]hydrazinylidene]methyl]pyrimidin-4-yl]methyl]hydrazinyl]ethyl]azanium
Canonical SMILES : C[N+](C)(C)CC(=O)NNCC1=CC(=NC(=N1)C2=CC=CC=C2)C=NNC(=O)C[N+](C)(C)C
InChI : InChI=1S\/C22H32N8O2\/c1-29(2,3)15-20(31)27-23-13-18-12-19(14-24-28-21(32)16-30(4,5)6)26-22(25-18)17-10-8-7-9-11-17\/h7-13H,14-16H2,1-6H3,(H-2,23,24,25,26,27,28,31,32)\/p+2
InChIKey : HKNVHNBOLZPBQX-UHFFFAOYSA-P
Other name(s) : N0C
MW : 442.6
Formula : C22H34N8O2+2
CAS_number :
PubChem : 168451667
UniChem : HKNVHNBOLZPBQX-UHFFFAOYSA-P
IUPHAR :
Wikipedia :
Target
Families : 8AM2-N0C ligand of proteins in family: BCHE
Stucture : 8AM2 Human butyrylcholinesterase in complex with 2,2'-(((1E,1'E)-(2-phenylpyrimidine-4,6-diyl)bis(methaneylylidene))bis(hydrazin-1-yl-2-ylidene))bis(N,N,N-trimethyl-2-oxoethan-1-aminium)
Protein : human-BCHE
References (1)
| Title : Grid-type Quaternary Metallosupramolecular Compounds Inhibit Human Cholinesterases through Dynamic Multivalent Interactions - Nachon_2022_Chembiochem_23_e202200456 |
| Author(s) : Nachon F , Brazzolotto X , Dias J , Courageux C , Drozdz W , Cao XY , Stefankiewicz AR , Lehn JM |
| Ref : Chembiochem , 23 :e202200456 , 2022 |
| Abstract : Nachon_2022_Chembiochem_23_e202200456 |
| ESTHER : Nachon_2022_Chembiochem_23_e202200456 |
| PubMedSearch : Nachon_2022_Chembiochem_23_e202200456 |
| PubMedID: 36193860 |
| Gene_locus related to this paper: human-BCHE |