EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H12O3 |
| Net Charge | 0 |
| Average Mass | 132.159 |
| Monoisotopic Mass | 132.07864 |
| SMILES | O=C(O)CCCCCO |
| InChI | InChI=1S/C6H12O3/c7-5-3-1-2-4-6(8)9/h7H,1-5H2,(H,8,9) |
| InChIKey | IWHLYPDWHHPVAA-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Role: | bacterial xenobiotic metabolite Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-hydroxyhexanoic acid (CHEBI:17869) has functional parent hexanoic acid (CHEBI:30776) |
| 6-hydroxyhexanoic acid (CHEBI:17869) has role bacterial xenobiotic metabolite (CHEBI:76976) |
| 6-hydroxyhexanoic acid (CHEBI:17869) is a 6-hydroxy monocarboxylic acid (CHEBI:35971) |
| 6-hydroxyhexanoic acid (CHEBI:17869) is a straight-chain fatty acid (CHEBI:59202) |
| 6-hydroxyhexanoic acid (CHEBI:17869) is a ω-hydroxy-medium-chain fatty acid (CHEBI:194303) |
| 6-hydroxyhexanoic acid (CHEBI:17869) is conjugate acid of 6-hydroxyhexanoate (CHEBI:32383) |
| Incoming Relation(s) |
| oscr#12 (CHEBI:79135) has functional parent 6-hydroxyhexanoic acid (CHEBI:17869) |
| 6-hydroxyhexanoate (CHEBI:32383) is conjugate base of 6-hydroxyhexanoic acid (CHEBI:17869) |
| IUPAC Name |
|---|
| 6-hydroxyhexanoic acid |
| Synonyms | Source |
|---|---|
| 6-Hydroxyhexanoic acid | KEGG COMPOUND |
| ε-hydroxycaproic acid | ChemIDplus |
| 6-hydroxycaproic acid | NIST Chemistry WebBook |
| 6-hydroxy caproic acid | LIPID MAPS |
| 5-carboxypentanol | ChEBI |
| 5-hydroxypentanecarboxylic acid | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| C06103 | KEGG COMPOUND |
| LMFA01050015 | LIPID MAPS |
| HMDB0012843 | HMDB |
| Citations |
|---|