EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H17NO3 |
| Net Charge | 0 |
| Average Mass | 199.250 |
| Monoisotopic Mass | 199.12084 |
| SMILES | CCC/C=C/CCC(=O)NCC(=O)O |
| InChI | InChI=1S/C10H17NO3/c1-2-3-4-5-6-7-9(12)11-8-10(13)14/h4-5H,2-3,6-8H2,1H3,(H,11,12)(H,13,14)/b5-4+ |
| InChIKey | MCGXHOZUYMVMBX-SNAWJCMRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | feces (BTO:0000440) | MetaboLights (MTBLS5335) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-octenoylglycine (CHEBI:193388) is a N-acyl-amino acid (CHEBI:51569) |
| IUPAC Name |
|---|
| 2-[[(E)-oct-4-enoyl]amino]acetic acid |
| Manual Xrefs | Databases |
|---|---|
| 74849712 | ChemSpider |