EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H30N4O6 |
| Net Charge | 0 |
| Average Mass | 422.482 |
| Monoisotopic Mass | 422.21653 |
| SMILES | CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O |
| InChI | InChI=1S/C20H30N4O6/c1-11(2)9-16(20(29)30)24-19(28)15(7-8-17(22)26)23-18(27)14(21)10-12-3-5-13(25)6-4-12/h3-6,11,14-16,25H,7-10,21H2,1-2H3,(H2,22,26)(H,23,27)(H,24,28)(H,29,30)/t14-,15-,16-/m0/s1 |
| InChIKey | TWAVEIJGFCBWCG-JYJNAYRXSA-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) |
| Tyr-Gln-Leu (CHEBI:165042) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoic acid |