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CHEBI:45296 - hexadecane
| Formula | C16H34 |
| Net Charge | 0 |
| Average Mass | 226.448 |
| Monoisotopic Mass | 226.26605 |
| SMILES | CCCCCCCCCCCCCCCC |
| InChI | InChI=1S/C16H34/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3-16H2,1-2H3 |
| InChIKey | DCAYPVUWAIABOU-UHFFFAOYSA-N |
| Wikipedia |
|---|
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Gallus gallus (ncbitaxon:9031) | - | PubMed (27439360) |
| Roles Classification |
|---|
| Chemical Role: | |
| Biological Roles: | plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. volatile oil component Any plant metabolite that is found naturally as a component of a volatile oil. |
| Application: |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| hexadecane (CHEBI:45296) has role non-polar solvent (CHEBI:48355) |
| hexadecane (CHEBI:45296) has role plant metabolite (CHEBI:76924) |
| hexadecane (CHEBI:45296) has role volatile oil component (CHEBI:27311) |
| hexadecane (CHEBI:45296) is a long-chain alkane (CHEBI:83563) |
| Incoming Relation(s) |
| 1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluorohexadecane (CHEBI:39042) has parent hydride hexadecane (CHEBI:45296) |
| 1,16-hexadecanediol (CHEBI:195244) has parent hydride hexadecane (CHEBI:45296) |
| 1,2-hexadecanediol (CHEBI:75586) has parent hydride hexadecane (CHEBI:45296) |
| hexadecanol (CHEBI:197387) has parent hydride hexadecane (CHEBI:45296) |
| palmityl group (CHEBI:25842) is substituent group from hexadecane (CHEBI:45296) |
| IUPAC Name |
|---|
| hexadecane |
| Synonyms | Source |
|---|---|
| n-hexadecane | ChemIDplus |
| n-cetane | NIST Chemistry WebBook |
| cetane | NIST Chemistry WebBook |
| Hexadekan | ChEBI |
| Zetan | ChEBI |
| Cetan | ChEBI |
| UniProt Name | Source |
|---|---|
| hexadecane | UniProt |
| Manual Xrefs | Databases |
|---|---|
| R16 | PDBeChem |
| HMDB0033792 | HMDB |
| Hexadecane | Wikipedia |
| Citations |
|---|