EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H30N4O3 |
| Net Charge | 0 |
| Average Mass | 398.507 |
| Monoisotopic Mass | 398.23179 |
| SMILES | CNC(C)C(=O)NC(C(=O)NC(C)C(=O)Nc1cccc2ccccc12)C(C)C |
| InChI | InChI=1S/C22H30N4O3/c1-13(2)19(26-20(27)14(3)23-5)22(29)24-15(4)21(28)25-18-12-8-10-16-9-6-7-11-17(16)18/h6-15,19,23H,1-5H3,(H,24,29)(H,25,28)(H,26,27) |
| InChIKey | JSZPIOJRNMIRQD-UHFFFAOYSA-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) |
| 3-methyl-2-[[2-(methylamino)-1-oxopropyl]amino]-N-[1-(1-naphthalenylamino)-1-oxopropan-2-yl]butanamide (CHEBI:91968) is a peptide (CHEBI:16670) |
| Manual Xrefs | Databases |
|---|---|
| LSM-1922 | LINCS |