EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:200522 - methyl-2,3,5-trihydroxytetradecanoate
| Formula | C15H30O5 |
| Net Charge | 0 |
| Average Mass | 290.400 |
| Monoisotopic Mass | 290.20932 |
| SMILES | CCCCCCCCC[C@H](O)C[C@@H](O)[C@H](O)C(=O)OC |
| InChI | InChI=1S/C15H30O5/c1-3-4-5-6-7-8-9-10-12(16)11-13(17)14(18)15(19)20-2/h12-14,16-18H,3-11H2,1-2H3/t12-,13+,14-/m0/s1 |
| InChIKey | RMZHRCHXTBTPGS-MJBXVCDLSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Phomopsis (ncbitaxon:34399) | - | PubMed (23578961) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| methyl-2,3,5-trihydroxytetradecanoate (CHEBI:200522) is a long-chain fatty alcohol (CHEBI:17135) |
| IUPAC Name |
|---|
| methyl (2S,3R,5S)-2,3,5-trihydroxytetradecanoate |
| Manual Xrefs | Databases |
|---|---|
| 78443377 | ChemSpider |