EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C7H12O |
| Net Charge | 0 |
| Average Mass | 112.172 |
| Monoisotopic Mass | 112.08882 |
| SMILES | CC/C=C\C=C\CO |
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h3-6,8H,2,7H2,1H3/b4-3-,6-5+ |
| InChIKey | MDRZSADXFOPYOC-DNVGVPOPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood plasma (BTO:0000131) | MetaboLights (MTBLS2224) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2E,4Z-Heptadien-1-ol (CHEBI:188201) is a aliphatic alcohol (CHEBI:2571) |
| IUPAC Name |
|---|
| (2E,4Z)-hepta-2,4-dien-1-ol |
| Manual Xrefs | Databases |
|---|---|
| 9530387 | ChemSpider |
| LMFA05000119 | LIPID MAPS |