EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H28N6O6 |
| Net Charge | 0 |
| Average Mass | 436.469 |
| Monoisotopic Mass | 436.20703 |
| SMILES | NC(N)=NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)O |
| InChI | InChI=1S/C19H28N6O6/c20-12(10-15(26)27)16(28)25-14(9-11-5-2-1-3-6-11)17(29)24-13(18(30)31)7-4-8-23-19(21)22/h1-3,5-6,12-14H,4,7-10,20H2,(H,24,29)(H,25,28)(H,26,27)(H,30,31)(H4,21,22,23)/t12-,13-,14-/m0/s1 |
| InChIKey | LIJXJYGRSRWLCJ-IHRRRGAJSA-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) |
| Asp-Phe-Arg (CHEBI:160789) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 16569820 | ChemSpider |