EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C15H13NO2 |
| Net Charge | 0 |
| Average Mass | 239.274 |
| Monoisotopic Mass | 239.09463 |
| SMILES | COc1ccc(-c2ccc(OC)cc2C#N)cc1 |
| InChI | InChI=1S/C15H13NO2/c1-17-13-5-3-11(4-6-13)15-8-7-14(18-2)9-12(15)10-16/h3-9H,1-2H3 |
| InChIKey | YTFJXLBVBXNSDD-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Bombus terrestris (ncbitaxon:30195) | |||
| hemolymph (BTO:0000572) | MetaboLights (MTBLS3637) | ||
| brain (BTO:0000142) | MetaboLights (MTBLS3637) | ||
| hindgut (BTO:0000510) | MetaboLights (MTBLS3637) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4,4'-dimethoxy[1,1'-biphenyl]-2-carbonitrile (CHEBI:183677) is a biphenyls (CHEBI:22888) |
| 4,4'-dimethoxy[1,1'-biphenyl]-2-carbonitrile (CHEBI:183677) is a nitrile (CHEBI:18379) |
| IUPAC Name |
|---|
| 5-methoxy-2-(4-methoxyphenyl)benzonitrile |
| Manual Xrefs | Databases |
|---|---|
| 2010833 | ChemSpider |