EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:183063 - allyl cyanide
| Formula | C4H5N |
| Net Charge | 0 |
| Average Mass | 67.091 |
| Monoisotopic Mass | 67.04220 |
| SMILES | C=CCC#N |
| InChI | InChI=1S/C4H5N/c1-2-3-4-5/h2H,1,3H2 |
| InChIKey | SJNALLRHIVGIBI-UHFFFAOYSA-N |
| Wikipedia |
|---|
| Roles Classification |
|---|
| Biological Roles: | neurotoxin A poison that interferes with the functions of the nervous system. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. |
| Application: | antifeedant A substance that prevents pests from feeding. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| allyl cyanide (CHEBI:183063) has role antifeedant (CHEBI:22583) |
| allyl cyanide (CHEBI:183063) has role neurotoxin (CHEBI:50910) |
| allyl cyanide (CHEBI:183063) has role plant metabolite (CHEBI:76924) |
| allyl cyanide (CHEBI:183063) is a aliphatic nitrile (CHEBI:80291) |
| allyl cyanide (CHEBI:183063) is a olefinic compound (CHEBI:78840) |
| IUPAC Name |
|---|
| but-3-enenitrile |
| Synonyms | Source |
|---|---|
| 1-butene-4-nitrile | ChemIDplus |
| 1-propene-3-nitrile | ChEBI |
| 3-butenenitrile | ChemIDplus |
| 3-Butenonitrile | ChemIDplus |
| 3-butenylnitrile | ChemIDplus |
| 3-cyano-1-propene | ChemIDplus |
| UniProt Name | Source |
|---|---|
| but-3-enenitrile | UniProt |
| Manual Xrefs | Databases |
|---|---|
| 13876176 | ChemSpider |
| Allyl_cyanide | Wikipedia |
| CPD-19505 | MetaCyc |
| FDB003384 | FooDB |
| HMDB0031323 | HMDB |
| Citations |
|---|