EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H18N2O5S |
| Net Charge | 0 |
| Average Mass | 290.341 |
| Monoisotopic Mass | 290.09364 |
| SMILES | C/C=C/SC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O |
| InChI | InChI=1S/C11H18N2O5S/c1-2-5-19-6-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h2,5,7-8H,3-4,6,12H2,1H3,(H,13,14)(H,15,16)(H,17,18)/b5-2+/t7-,8-/m0/s1 |
| InChIKey | MUFSTXJBHAEIBT-ZASJQLQOSA-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) |
| N-gamma-Glutamyl-S-trans-(1-propenyl)cysteine (CHEBI:174078) is a dipeptide (CHEBI:46761) |
| IUPAC Name |
|---|
| (2S)-2-amino-5-[[(1R)-1-carboxy-2-[(E)-prop-1-enyl]sulanylethyl]amino]-5-oxopentanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 30777493 | ChemSpider |
| HMDB0040557 | HMDB |