Tetracyclic-carbamate-melatonine-3c
hBChE IC50 0.102 microM; hAChE 6.5% at 10mM
General
Type : Carbamate,Natural_modified,Derivative of Evodiamine,Isoquinoline,Quinazoline,Derivative of Tryptamine,Indole,Alkyl linked bis-ligand
Chemical_Nomenclature : (13-methyl-5,6,8,13a-tetrahydroisoquinolino[1,2-b]quinazolin-10-yl) N-[7-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-7-oxoheptyl]carbamate
Canonical SMILES : CN1C2C3=CC=CC=C3CCN2CC4=C1C=CC(=C4)OC(=O)NCCCCCCC(=O)NCCC5=CNC6=C5C=C(C=C6)OC
InChI : InChI=1S\/C36H43N5O4\/c1-40-33-15-13-29(21-27(33)24-41-20-17-25-9-6-7-10-30(25)35(40)41)45-36(43)38-18-8-4-3-5-11-34(42)37-19-16-26-23-39-32-14-12-28(44-2)22-31(26)32\/h6-7,9-10,12-15,21-23,35,39H,3-5,8,11,16-20,24H2,1-2H3,(H,37,42)(H,38,43)
InChIKey : MVMQNBRFWZONNJ-UHFFFAOYSA-N
Other name(s) : CHEMBL5078611,BDBM50580652
MW : 609.8
Formula : C36H43N5O4
CAS_number :
PubChem : 166627824
UniChem : MVMQNBRFWZONNJ-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families :
Stucture :
Protein :
References (1)
| Title : Selective Pseudo-irreversible Butyrylcholinesterase Inhibitors Transferring Antioxidant Moieties to the Enzyme Show Pronounced Neuroprotective Efficacy In Vitro and In Vivo in an Alzheimer's Disease Mouse Model - Scheiner_2021_J.Med.Chem_64_9302 |
| Author(s) : Scheiner M , Hoffmann M , He F , Poeta E , Chatonnet A , Monti B , Maurice T , Decker M |
| Ref : Journal of Medicinal Chemistry , 64(13): :9302 , 2021 |
| Abstract : Scheiner_2021_J.Med.Chem_64_9302 |
| ESTHER : Scheiner_2021_J.Med.Chem_64_9302 |
| PubMedSearch : Scheiner_2021_J.Med.Chem_64_9302 |
| PubMedID: 34152756 |