EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H18ClN3O7S |
| Net Charge | 0 |
| Average Mass | 383.810 |
| Monoisotopic Mass | 383.05540 |
| SMILES | N[C@@H](CCC(=O)N[C@@H](CSCC(=O)Cl)C(=O)NCC(=O)O)C(=O)O |
| InChI | InChI=1S/C12H18ClN3O7S/c13-8(17)5-24-4-7(11(21)15-3-10(19)20)16-9(18)2-1-6(14)12(22)23/h6-7H,1-5,14H2,(H,15,21)(H,16,18)(H,19,20)(H,22,23)/t6-,7-/m0/s1 |
| InChIKey | QUWRSBQWJGCKIV-BQBZGAKWSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | - | PubMed (19425150) | Source: BioModels - MODEL1507180067 |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(S-Glutathionyl)acetyl chloride (CHEBI:34253) is a peptide (CHEBI:16670) |
| Synonym | Source |
|---|---|
| 2-(S-Glutathionyl)acetyl chloride | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C14865 | KEGG COMPOUND |
| HMDB0060342 | HMDB |