EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H23N3O5S |
| Net Charge | 0 |
| Average Mass | 369.443 |
| Monoisotopic Mass | 369.13584 |
| SMILES | CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)O |
| InChI | InChI=1S/C16H23N3O5S/c1-25-7-6-12(16(23)24)19-15(22)13(18-14(21)9-17)8-10-2-4-11(20)5-3-10/h2-5,12-13,20H,6-9,17H2,1H3,(H,18,21)(H,19,22)(H,23,24)/t12-,13-/m0/s1 |
| InChIKey | IHDKKJVBLGXLEL-STQMWFEESA-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) |
| Gly-Tyr-Met (CHEBI:164131) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-2-[(2-aminoacetyl)amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylsulanylbutanoic acid |