EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H18O3 |
| Net Charge | 0 |
| Average Mass | 186.251 |
| Monoisotopic Mass | 186.12559 |
| SMILES | C=C(C)[C@H](CCC(C)O)CC(=O)O |
| InChI | InChI=1S/C10H18O3/c1-7(2)9(6-10(12)13)5-4-8(3)11/h8-9,11H,1,4-6H2,2-3H3,(H,12,13)/t8?,9-/m1/s1 |
| InChIKey | NQYDFAGFKCSWGI-YGPZHTELSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (3R)-6-Hydroxy-3-isopropenyl-heptanoate (CHEBI:204) is a carbonyl compound (CHEBI:36586) |
| Synonym | Source |
|---|---|
| (3R)-6-Hydroxy-3-isopropenyl-heptanoate | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C11404 | KEGG COMPOUND |