EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H24N4O6S2 |
| Net Charge | 0 |
| Average Mass | 396.491 |
| Monoisotopic Mass | 396.11373 |
| SMILES | CC(N)C(=O)NC(C(=O)NC(CS)C(=O)NC(CS)C(=O)O)C(C)O |
| InChI | InChI=1S/C13H24N4O6S2/c1-5(14)10(19)17-9(6(2)18)12(21)15-7(3-24)11(20)16-8(4-25)13(22)23/h5-9,18,24-25H,3-4,14H2,1-2H3,(H,15,21)(H,16,20)(H,17,19)(H,22,23) |
| InChIKey | YMIYZAOBQDRCPP-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Trypanosoma brucei (ncbitaxon:5691) | cell culture (BTO:0000214) | MetaboLights (MTBLS2559) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Ala-Thr-Cys-Cys (CHEBI:183141) is a tetrapeptide (CHEBI:48030) |
| IUPAC Name |
|---|
| 2-[[2-[[2-(2-aminopropanoylamino)-3-hydroxybutanoyl]amino]-3-sulanylpropanoyl]amino]-3-sulanylpropanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 16582559 | ChemSpider |