EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H22O3 |
| Net Charge | 0 |
| Average Mass | 226.316 |
| Monoisotopic Mass | 226.15689 |
| SMILES | C=C/C=C/CC[C@H](O)[C@@H](O)CC/C=C/CO |
| InChI | InChI=1S/C13H22O3/c1-2-3-4-6-9-12(15)13(16)10-7-5-8-11-14/h2-5,8,12-16H,1,6-7,9-11H2/b4-3+,8-5+/t12-,13-/m0/s1 |
| InChIKey | MNXADTNACOINFR-LOYOYPRNSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Trichoderma (ncbitaxon:5543) | - | PubMed (26031203) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Harzianumol H (CHEBI:213544) is a long-chain fatty alcohol (CHEBI:17135) |
| IUPAC Name |
|---|
| (2E,6S,7S,10E)-trideca-2,10,12-triene-1,6,7-triol |
| Manual Xrefs | Databases |
|---|---|
| 44210779 | ChemSpider |