CHEBI:17302 - pentadecanal

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name pentadecanal
ChEBI ID CHEBI:17302
Definition A 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.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:14746, CHEBI:7972, CHEBI:25873
Supplier Information
Download Molfile XML SDF
Formula C15H30O
Net Charge 0
Average Mass 226.39810
Monoisotopic Mass 226.22967
InChI InChI=1S/C15H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h15H,2-14H2,1H3
InChIKey XGQJZNCFDLXSIJ-UHFFFAOYSA-N
SMILES [H]C(=O)CCCCCCCCCCCCCC
Metabolite of Species Details
Senna siamea (NCBI:txid346999) See: PubMed
Solanum erianthum (NCBI:txid374041) See: PubMed
Roles Classification
Biological Role(s): antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
volatile oil component
Any plant metabolite that is found naturally as a component of a volatile oil.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 2-methylpentadecanal (CHEBI:49190) has functional parent pentadecanal (CHEBI:17302)
IUPAC Name
pentadecanal
Synonyms Sources
1-pentadecanal NIST Chemistry WebBook
n-pentadecanal NIST Chemistry WebBook
Pentadecanal KEGG COMPOUND
pentadecanal UniProt
Manual Xrefs Databases
C01948 KEGG COMPOUND
HMDB0031078 HMDB
LMFA06000083 LIPID MAPS
View more database links
Registry Numbers Types Sources
1706171 Reaxys Registry Number Reaxys
2765-11-9 CAS Registry Number ChemIDplus
2765-11-9 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
22136358 PubMed citation Europe PMC
23513740 PubMed citation Europe PMC
Last Modified
10 October 2017