EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H12N2O2 |
| Net Charge | 0 |
| Average Mass | 288.306 |
| Monoisotopic Mass | 288.08988 |
| SMILES | N#CC(=C\c1ccc(O)cc1)/C(C#N)=C/c1ccc(O)cc1 |
| InChI | InChI=1S/C18H12N2O2/c19-11-15(9-13-1-5-17(21)6-2-13)16(12-20)10-14-3-7-18(22)8-4-14/h1-10,21-22H/b15-9+,16-10+ |
| InChIKey | OKFZCZSKKKVBDG-KAVGSWPWSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus (ncbitaxon:5052) | - | DOI (10.1248/cpb.44.2227) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Epurpurin C (CHEBI:202273) is a phenylpropanoid (CHEBI:26004) |
| IUPAC Name |
|---|
| (2Z,3Z)-2,3-bis[(4-hydroxyphenyl)methylidene]butanedinitrile |
| Manual Xrefs | Databases |
|---|---|
| 5006498 | ChemSpider |