CHEBI:17302 - pentadecanal

ChEBI IDCHEBI:17302
ChEBI Namepentadecanal
Stars
DefinitionA long-chain fatty aldehyde that is pentadecane carrying an oxo substituent at position 1. It is a component of essential oils from plants like Solanum erianthum and Cassia siamea.
Secondary ChEBI IDsCHEBI:7972, CHEBI:14746, CHEBI:25873
Last Modified10 October 2017
DownloadsMolfile
FormulaC15H30O
Net Charge0
Average Mass226.404
Monoisotopic Mass226.22967
SMILES[H]C(=O)CCCCCCCCCCCCCC
InChIInChI=1S/C15H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h15H,2-14H2,1H3
InChIKeyXGQJZNCFDLXSIJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Senna siamea (ncbitaxon:346999) - PubMed (23513740)
Solanum erianthum (ncbitaxon:374041) - PubMed (22136358)
Roles Classification
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.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
pentadecanal (CHEBI:17302) has role antimicrobial agent (CHEBI:33281)
pentadecanal (CHEBI:17302) has role plant metabolite (CHEBI:76924)
pentadecanal (CHEBI:17302) has role volatile oil component (CHEBI:27311)
pentadecanal (CHEBI:17302) is a 2,3-saturated fatty aldehyde (CHEBI:84587)
pentadecanal (CHEBI:17302) is a long-chain fatty aldehyde (CHEBI:17176)
Incoming Relation(s)
2-methylpentadecanal (CHEBI:49190) has functional parent pentadecanal (CHEBI:17302)
IUPAC Name 
pentadecanal
Synonyms  Source
PentadecanalKEGG COMPOUND
n-pentadecanalNIST Chemistry WebBook
1-pentadecanalNIST Chemistry WebBook
UniProt Name  Source
pentadecanalUniProt
Manual XrefsDatabases
C01948KEGG COMPOUND
LMFA06000083LIPID MAPS
HMDB0031078HMDB
Registry NumbersSources
Reaxys:1706171Reaxys
CAS:2765-11-9KEGG COMPOUND
CAS:2765-11-9ChemIDplus
CAS:2765-11-9NIST Chemistry WebBook
Citations