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CHEBI:169251 - 3-iodo-octadecanoic acid
| Formula | C18H35IO2 |
| Net Charge | 0 |
| Average Mass | 410.380 |
| Monoisotopic Mass | 410.16818 |
| SMILES | CCCCCCCCCCCCCCCC(I)CC(=O)O |
| InChI | InChI=1S/C18H35IO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(19)16-18(20)21/h17H,2-16H2,1H3,(H,20,21) |
| InChIKey | DJFRHANNURBCFM-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Malus domestica (ncbitaxon:3750) | exocarp (BTO:0000733) | MetaboLights (MTBLS2384) | Strain: Malus x domestica Borkh. cv. Ruixue |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-iodo-octadecanoic acid (CHEBI:169251) is a long-chain fatty acid (CHEBI:15904) |
| IUPAC Name |
|---|
| 3-iodooctadecanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 4472384 | ChemSpider |
| LMFA01090040 | LIPID MAPS |