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CHEBI:87422 - isoamyl butyrate
| Formula | C9H18O2 |
| Net Charge | 0 |
| Average Mass | 158.241 |
| Monoisotopic Mass | 158.13068 |
| SMILES | CCCC(=O)OCCC(C)C |
| InChI | InChI=1S/C9H18O2/c1-4-5-9(10)11-7-6-8(2)3/h8H,4-7H2,1-3H3 |
| InChIKey | PQLMXFQTAMDXIZ-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| isoamyl butyrate (CHEBI:87422) has functional parent isoamylol (CHEBI:15837) |
| isoamyl butyrate (CHEBI:87422) has role metabolite (CHEBI:25212) |
| isoamyl butyrate (CHEBI:87422) is a butyrate ester (CHEBI:50477) |
| IUPAC Name |
|---|
| 3-methylbutyl butanoate |
| Synonyms | Source |
|---|---|
| butyric acid isopentyl ester | ChEBI |
| isopentyl butyrate | ChEBI |
| Isopentyl butanoate | ChemIDplus |
| Isoamyl butanoate | ChemIDplus |
| Manual Xrefs | Databases |
|---|---|
| HMDB0040221 | HMDB |
| Citations |
|---|