EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H24N4O4 |
| Net Charge | 0 |
| Average Mass | 408.458 |
| Monoisotopic Mass | 408.17976 |
| SMILES | N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)NCC(=O)O |
| InChI | InChI=1S/C22H24N4O4/c23-17(10-14-6-2-1-3-7-14)21(29)26-19(22(30)25-13-20(27)28)11-15-12-24-18-9-5-4-8-16(15)18/h1-9,12,17,19,24H,10-11,13,23H2,(H,25,30)(H,26,29)(H,27,28)/t17-,19-/m0/s1 |
| InChIKey | ZVJGAXNBBKPYOE-HKUYNNGSSA-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) |
| Phe-Trp-Gly (CHEBI:161918) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| 2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]acetic acid |