EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H6O2 |
| Net Charge | 0 |
| Average Mass | 110.112 |
| Monoisotopic Mass | 110.03678 |
| SMILES | O=C/C=C\C=C\C=O |
| InChI | InChI=1S/C6H6O2/c7-5-3-1-2-4-6-8/h1-6H/b3-1-,4-2+ |
| InChIKey | NDCAAPXLWRAESY-HSFFGMMNSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| synthetic microbial community (ncbitaxon:3229850) | Whole Organism (NCIT:C13413) | MetaboLights (MTBLS3129) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (E,E)-2,4-Hexadienedial (CHEBI:193609) is a polyunsaturated fatty aldehyde (CHEBI:72692) |
| IUPAC Name |
|---|
| (2Z,4E)-hexa-2,4-dienedial |
| Manual Xrefs | Databases |
|---|---|
| HMDB0031180 | HMDB |
| 9587244 | ChemSpider |
| LMFA06000011 | LIPID MAPS |