EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H19N3O3 |
| Net Charge | 0 |
| Average Mass | 253.302 |
| Monoisotopic Mass | 253.14264 |
| SMILES | CCCCCC(=O)N[C@@H](Cc1cncn1)C(=O)O |
| InChI | InChI=1S/C12H19N3O3/c1-2-3-4-5-11(16)15-10(12(17)18)6-9-7-13-8-14-9/h7-8,10H,2-6H2,1H3,(H,13,14)(H,15,16)(H,17,18)/t10-/m0/s1 |
| InChIKey | ORIZVAWRQXIOEB-JTQLQIEISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | feces (BTO:0000440) | MetaboLights (MTBLS9087) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| n-hexanoyl histidine (CHEBI:230552) is a organic molecular entity (CHEBI:50860) |
| IUPAC Name |
|---|
| (2S)-2-(hexanoylamino)-3-(1H-imidazol-5-yl)propanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 113371156 | ChemSpider |