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CHEBI:84946 - triacontanal

ChEBI IDCHEBI:84946
ChEBI Nametriacontanal
Stars
DefinitionA long-chain fatty aldehyde resulting from the formal oxidation of the hydroxy group of triacontan-1-ol.
Last Modified20 February 2015
SubmitterSteve
DownloadsMolfile
FormulaC30H60O
Net Charge0
Average Mass436.809
Monoisotopic Mass436.46442
SMILES[H]C(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C30H60O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31/h30H,2-29H2,1H3
InChIKeyCGNVIRPGBUXJES-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Illicium dunnianum (ncbitaxon:124773)
leaf (BTO:0000713) PubMed (2504190)
stem (BTO:0001300) PubMed (2504190)
Phyllanthus niruri (ncbitaxon:296034) - PubMed (4087921) Hexane extract
Nepenthes alata (ncbitaxon:4376) - PubMed (12883887)
Nepenthes albomarginata (ncbitaxon:150948) - PubMed (17109149)
Nepenthes khasiana (ncbitaxon:122310) - PubMed (17109149)
Roles Classification
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)
triacontanal (CHEBI:84946) has parent hydride triacontane (CHEBI:31006)
triacontanal (CHEBI:84946) has role plant metabolite (CHEBI:76924)
triacontanal (CHEBI:84946) is a 2,3-saturated fatty aldehyde (CHEBI:84587)
triacontanal (CHEBI:84946) is a long-chain fatty aldehyde (CHEBI:17176)
IUPAC Name 
triacontanal
Manual XrefsDatabases
HMDB0032868HMDB
CPD-7888MetaCyc
Registry NumbersSources
Reaxys:1885709Reaxys
CAS:22725-63-9ChemIDplus
CAS:22725-63-9NIST Chemistry WebBook
Citations