EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H20O2 |
| Net Charge | 0 |
| Average Mass | 172.268 |
| Monoisotopic Mass | 172.14633 |
| SMILES | CCC(C)CCCCCC(=O)O |
| InChI | InChI=1S/C10H20O2/c1-3-9(2)7-5-4-6-8-10(11)12/h9H,3-8H2,1-2H3,(H,11,12) |
| InChIKey | TUIJQPRMECGEKA-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7-methyl-nonanoic acid (CHEBI:179563) is a medium-chain fatty acid (CHEBI:59554) |
| IUPAC Name |
|---|
| 7-methylnonanoic acid |
| Manual Xrefs | Databases |
|---|---|
| LMFA01020246 | LIPID MAPS |
| 4471754 | ChemSpider |