EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H18N2O4S |
| Net Charge | 0 |
| Average Mass | 250.320 |
| Monoisotopic Mass | 250.09873 |
| SMILES | CSCCC(N)C(=O)NC(C(=O)O)C(C)O |
| InChI | InChI=1S/C9H18N2O4S/c1-5(12)7(9(14)15)11-8(13)6(10)3-4-16-2/h5-7,12H,3-4,10H2,1-2H3,(H,11,13)(H,14,15) |
| InChIKey | KAKJTZWHIUWTTD-UHFFFAOYSA-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) |
| Methionyl-Threonine (CHEBI:174294) is a dipeptide (CHEBI:46761) |
| IUPAC Name |
|---|
| 2-[(2-amino-4-methylsulanylbutanoyl)amino]-3-hydroxybutanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 16568353 | ChemSpider |
| HMDB0028983 | HMDB |