EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H28O4 |
| Net Charge | 0 |
| Average Mass | 284.396 |
| Monoisotopic Mass | 284.19876 |
| SMILES | CC(=O)[C@@H]1O[C@H]1CCCCCCCCCCCC(=O)O |
| InChI | InChI=1S/C16H28O4/c1-13(17)16-14(20-16)11-9-7-5-3-2-4-6-8-10-12-15(18)19/h14,16H,2-12H2,1H3,(H,18,19)/t14-,16-/m0/s1 |
| InChIKey | PWBGRXOGZIZZSS-HOCLYGCPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Micromonospora echinospora (ncbitaxon:1877) | - | PubMed (9592568) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| YM-47515 degradation product (CHEBI:199507) is a long-chain fatty acid (CHEBI:15904) |
| IUPAC Name |
|---|
| 12-[(2S,3R)-3-acetyloxiran-2-yl]dodecanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 8883542 | ChemSpider |