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CHEBI:45980 - tacrine
| Formula | C13H14N2 |
| Net Charge | 0 |
| Average Mass | 198.269 |
| Monoisotopic Mass | 198.11570 |
| SMILES | Nc1c2c(nc3ccccc13)CCCC2 |
| InChI | InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) |
| InChIKey | YLJREFDVOIBQDA-UHFFFAOYSA-N |
| Wikipedia |
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| Roles Classification |
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| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| 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) |
| tacrine (CHEBI:45980) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462) |
| tacrine (CHEBI:45980) is a acridines (CHEBI:22213) |
| tacrine (CHEBI:45980) is a aromatic amine (CHEBI:33860) |
| tacrine (CHEBI:45980) is conjugate base of tacrine(1+) (CHEBI:187896) |
| Incoming Relation(s) |
| bis(7)-tacrine (CHEBI:138435) has functional parent tacrine (CHEBI:45980) |
| tacrine(1+) (CHEBI:187896) is conjugate acid of tacrine (CHEBI:45980) |
| IUPAC Name |
|---|
| 1,2,3,4-tetrahydroacridin-9-amine |
| Synonyms | Source |
|---|---|
| 1,2,3,4-tetrahydro-9-acridinamine | NIST Chemistry WebBook |
| 1,2,3,4-tetrahydro-9-aminoacridine | NIST Chemistry WebBook |
| 5-amino-6,7,8,9-tetrahydroacridine | NIST Chemistry WebBook |
| 9-amino-1,2,3,4-tetrahydroacridine | NIST Chemistry WebBook |
| Tacrine | KEGG COMPOUND |
| TACRINE | PDBeChem |
| Citations |
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