EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H28N4O4 |
| Net Charge | 0 |
| Average Mass | 388.468 |
| Monoisotopic Mass | 388.21106 |
| SMILES | CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O |
| InChI | InChI=1S/C20H28N4O4/c1-11(2)8-16(23-18(25)12(3)21)19(26)24-17(20(27)28)9-13-10-22-15-7-5-4-6-14(13)15/h4-7,10-12,16-17,22H,8-9,21H2,1-3H3,(H,23,25)(H,24,26)(H,27,28)/t12-,16-,17-/m0/s1 |
| InChIKey | UWIQWPWWZUHBAO-ZLIFDBKOSA-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) |
| Ala-Leu-Trp (CHEBI:158317) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-4-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 8375787 | ChemSpider |