EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H24O6 |
| Net Charge | 0 |
| Average Mass | 312.362 |
| Monoisotopic Mass | 312.15729 |
| SMILES | C/C=C/C=C/C(=O)OC(CC(O)C(=O)OC)C(C)C(=O)CC |
| InChI | InChI=1S/C16H24O6/c1-5-7-8-9-15(19)22-14(11(3)12(17)6-2)10-13(18)16(20)21-4/h5,7-9,11,13-14,18H,6,10H2,1-4H3/b7-5+,9-8+ |
| InChIKey | QUCPTPCJTBEPMN-ZIRGRKGMSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Acremonium (ncbitaxon:159075) | - | PubMed (33130231) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Triacremoniate (CHEBI:214251) is a aliphatic alcohol (CHEBI:2571) |
| IUPAC Name |
|---|
| methyl 4-[(2E,4E)-hexa-2,4-dienoyl]oxy-2-hydroxy-5-methyl-6-oxooctanoate |
| Manual Xrefs | Databases |
|---|---|
| 103704638 | ChemSpider |