CHEBI:144356 - methyl henicosanoate

ChEBI IDCHEBI:144356
ChEBI Namemethyl henicosanoate
Stars
DefinitionA fatty acid methyl ester resulting from the formal condensation of the carboxy group of henicosanoic acid with methanol.
Last Modified24 September 2019
Submittermwilliams
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FormulaC22H44O2
Net Charge0
Average Mass340.592
Monoisotopic Mass340.33413
SMILESCCCCCCCCCCCCCCCCCCCCC(=O)OC
InChIInChI=1S/C22H44O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-2/h3-21H2,1-2H3
InChIKeyAJRICDSAJQHDSD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ranunculus ternatus (ncbitaxon:376254) root (BTO:0001188) PubMed (20873554)
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)
methyl henicosanoate (CHEBI:144356) has functional parent henicosanoic acid (CHEBI:39248)
methyl henicosanoate (CHEBI:144356) has role plant metabolite (CHEBI:76924)
methyl henicosanoate (CHEBI:144356) is a fatty acid methyl ester (CHEBI:4986)
IUPAC Name 
methyl henicosanoate
Synonyms  Source
henicosanoic acid methyl esterChEBI
methyl heneicosanoateChEBI
heneicosanoic acid methyl esterChEBI
methyl henicosaneateChemIDplus
Manual XrefsDatabases
21054ChemSpider
Registry NumbersSources
Reaxys:1792879Reaxys
CAS:6064-90-0ChemIDplus
CAS:6064-90-0NIST Chemistry WebBook
Citations