EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:28941 - docosanoic acid

ChEBI IDCHEBI:28941
ChEBI Namedocosanoic acid
Stars
DefinitionA straight-chain, C22, long-chain saturated fatty acid.
Secondary ChEBI IDsCHEBI:3003, CHEBI:25463
Last Modified28 May 2021
DownloadsMolfile

FormulaC22H44O2
Net Charge0
Average Mass340.592
Monoisotopic Mass340.33413
SMILESCCCCCCCCCCCCCCCCCCCCCC(=O)O
InChIInChI=1S/C22H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h2-21H2,1H3,(H,23,24)
InChIKeyUKMSUNONTOPOIO-UHFFFAOYSA-N

Wikipedia
Species of MetaboliteComponentSourceComments
Neolitsea daibuensis (IPNI:466954-1) root (BTO:0001188) PubMed (22148193) Cold MeOH extract of dried root, obtained as a mixture of stearic acid and docosanoic acid
Roles Classification

ChEBI Ontology
IUPAC Name 
docosanoic acid
Synonyms  Source
Behenic acidKEGG COMPOUND
Docosanoic acidKEGG COMPOUND
n-docosanoic acidNIST Chemistry WebBook
CH3‒[CH2]20‒COOHIUPAC
Behensäure  deChEBI
Docosansäure  deChEBI
Manual XrefsDatabases
C08281KEGG COMPOUND
LMFA01010022LIPID MAPS
C00001211KNApSAcK
HMDB0000944HMDB
Behenic acidWikipedia
3855DrugCentral
EO3PDBeChem
7923ChemSpider
FDB005830FooDB
Registry NumbersSources
Gmelin:232293Gmelin
Reaxys:1792887Reaxys
CAS:112-85-6KEGG COMPOUND
CAS:112-85-6ChemIDplus
CAS:112-85-6NIST Chemistry WebBook
Citations