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CHEBI:31182 - Alacepril
| Formula | C20H26N2O5S |
| Net Charge | 0 |
| Average Mass | 406.504 |
| Monoisotopic Mass | 406.15624 |
| SMILES | CC(=O)SC[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O |
| InChI | InChI=1S/C20H26N2O5S/c1-13(12-28-14(2)23)19(25)22-10-6-9-17(22)18(24)21-16(20(26)27)11-15-7-4-3-5-8-15/h3-5,7-8,13,16-17H,6,9-12H2,1-2H3,(H,21,24)(H,26,27)/t13-,16+,17+/m1/s1 |
| InChIKey | FHHHOYXPRDYHEZ-COXVUDFISA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| Biological Role: | EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor An EC 3.4.15.* (peptidyl-dipeptidase) inhibitor that interferes with the action of peptidyl-dipeptidase A (EC 3.4.15.1). |
| Application: | EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor An EC 3.4.15.* (peptidyl-dipeptidase) inhibitor that interferes with the action of peptidyl-dipeptidase A (EC 3.4.15.1). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Alacepril (CHEBI:31182) has role EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor (CHEBI:35457) |
| Alacepril (CHEBI:31182) is a dipeptide (CHEBI:46761) |
| Alacepril (CHEBI:31182) is a thioacetate ester (CHEBI:52477) |
| Synonyms | Source |
|---|---|
| Alacepril | KEGG COMPOUND |
| cetapril | DrugCentral |
| cenapride | DrugCentral |
| DU-1219 | DrugCentral |