EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H27ClN4O3 |
| Net Charge | 0 |
| Average Mass | 430.936 |
| Monoisotopic Mass | 430.17717 |
| SMILES | CN(C(=O)CNC(=O)[C@@H](N)CCCCN)c1ccc(Cl)cc1C(=O)c1ccccc1 |
| InChI | InChI=1S/C22H27ClN4O3/c1-27(20(28)14-26-22(30)18(25)9-5-6-12-24)19-11-10-16(23)13-17(19)21(29)15-7-3-2-4-8-15/h2-4,7-8,10-11,13,18H,5-6,9,12,14,24-25H2,1H3,(H,26,30)/t18-/m0/s1 |
| InChIKey | LTKOVYBBGBGKTA-SFHVURJKSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Avizafone (CHEBI:2940) is a peptide (CHEBI:16670) |
| Synonyms | Source |
|---|---|
| Avizafone | KEGG COMPOUND |
| LDZ | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C11725 | KEGG COMPOUND |
| Registry Numbers | Sources |
|---|---|
| CAS:65617-86-9 | KEGG COMPOUND |