EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H27N3O6S |
| Net Charge | 0 |
| Average Mass | 425.507 |
| Monoisotopic Mass | 425.16206 |
| SMILES | CSCC[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O |
| InChI | InChI=1S/C19H27N3O6S/c1-29-10-9-13(20)17(25)22-15(11-12-5-3-2-4-6-12)18(26)21-14(19(27)28)7-8-16(23)24/h2-6,13-15H,7-11,20H2,1H3,(H,21,26)(H,22,25)(H,23,24)(H,27,28)/t13-,14-,15-/m0/s1 |
| InChIKey | FBLBCGLSRXBANI-KKUMJFAQSA-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) |
| Met-Phe-Glu (CHEBI:160977) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-phenylpropanoyl]amino]pentanedioic acid |