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CHEBI:28194 - petroselinic acid
| Formula | C18H34O2 |
| Net Charge | 0 |
| Average Mass | 282.468 |
| Monoisotopic Mass | 282.25588 |
| SMILES | CCCCCCCCCCC/C=C\CCCCC(=O)O |
| InChI | InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h12-13H,2-11,14-17H2,1H3,(H,19,20)/b13-12- |
| InChIKey | CNVZJPUDSLNTQU-SEYXRHQNSA-N |
| Wikipedia |
|---|
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Carum carvi (ncbitaxon:48032) | seed (BTO:0001226) | DOI (10.1016/j.indcrop.2012.04.060) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Role: | plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| petroselinic acid (CHEBI:28194) has role plant metabolite (CHEBI:76924) |
| petroselinic acid (CHEBI:28194) is a octadec-6-enoic acid (CHEBI:36022) |
| petroselinic acid (CHEBI:28194) is conjugate acid of petroselinate (CHEBI:32375) |
| Incoming Relation(s) |
| (6Z)-octadecenoyl-CoA (CHEBI:75360) has functional parent petroselinic acid (CHEBI:28194) |
| 1-oleoyl-2-(6Z)-octadecenoyl-sn-glycero-3-phosphate (CHEBI:75363) has functional parent petroselinic acid (CHEBI:28194) |
| 1,2-di-[(6Z)-octadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:86330) has functional parent petroselinic acid (CHEBI:28194) |
| 1,2-di-[(6Z)-octadecenoyl]-sn-glycero-3-phosphoethanolamine (CHEBI:84845) has functional parent petroselinic acid (CHEBI:28194) |
| petroselinamide (CHEBI:146168) has functional parent petroselinic acid (CHEBI:28194) |
| petroselinate (CHEBI:32375) is conjugate base of petroselinic acid (CHEBI:28194) |
| petroselinoyl group (CHEBI:32376) is substituent group from petroselinic acid (CHEBI:28194) |
| IUPAC Name |
|---|
| (6Z)-octadec-6-enoic acid |
| Synonyms | Source |
|---|---|
| Petroselinic acid | KEGG COMPOUND |
| cis-6-Octadecenoic acid | KEGG COMPOUND |
| (Z)-6-octadecenoic acid | NIST Chemistry WebBook |
| cis-Δ6-octadecenoic acid | ChEBI |
| (6Z)-Octadecenoic acid | KEGG COMPOUND |
| cis-ω-12-octadecenoic acid | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| C08363 | KEGG COMPOUND |
| C08363 | KEGG COMPOUND |
| LMFA01030066 | LIPID MAPS |
| C00001235 | KNApSAcK |
| Petroselinic_acid | Wikipedia |
| HMDB0002080 | HMDB |
| Citations |
|---|