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CHEBI:233297 - hAChE-IN-8

ChEBI IDCHEBI:233297
ChEBI NamehAChE-IN-8
Stars
SubmitterFlyBase
DownloadsMolfile
FormulaC25H22N4O4
Net Charge0
Average Mass442.475
Monoisotopic Mass442.16411
SMILESCOc1cc(/N=C(\O)Cn2nc(-c3ccccc3)c(-c3ccccc3)nc2=O)cc(OC)c1
InChIInChI=1S/C25H22N4O4/c1-32-20-13-19(14-21(15-20)33-2)26-22(30)16-29-25(31)27-23(17-9-5-3-6-10-17)24(28-29)18-11-7-4-8-12-18/h3-15H,16H2,1-2H3,(H,26,30)
InChIKeyCWGFQVMBODQAPR-UHFFFAOYSA-N
Roles Classification
Biological Role:
EC 3.1.1.7 (acetylcholinesterase) inhibitor  An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of enzyme acetylcholinesterase (EC 3.1.1.7), which helps breaking down of acetylcholine into choline and acetic acid.
ChEBI Ontology
Outgoing Relation(s)
hAChE-IN-8 (CHEBI:233297) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
hAChE-IN-8 (CHEBI:233297) is a organic molecular entity (CHEBI:50860)
Citations