EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C9H18O2 |
| Net Charge | 0 |
| Average Mass | 158.241 |
| Monoisotopic Mass | 158.13068 |
| SMILES | CCCCOC(=O)CCCC |
| InChI | InChI=1S/C9H18O2/c1-3-5-7-9(10)11-8-6-4-2/h3-8H2,1-2H3 |
| InChIKey | OKJADYKTJJGKDX-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | faeces (UBERON:0001988) | PubMed (17314143) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Butyl pentanoate (CHEBI:89761) is a fatty acid ester (CHEBI:35748) |
| Synonyms | Source |
|---|---|
| butyl pentanoate | HMDB |
| Butyl valerate | HMDB |
| Butyl valerianate | HMDB |
| FEMA 2217 | HMDB |
| N-Butyl pentanoate | HMDB |
| N-Butyl valerate | HMDB |
| Manual Xrefs | Databases |
|---|---|
| HMDB0040295 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:591-68-4 | KEGG COMPOUND |
| Citations |
|---|