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CHEBI:84856 - ethyl stearidonate

ChEBI IDCHEBI:84856
ChEBI Nameethyl stearidonate
Stars
DefinitionA long-chain fatty acid ethyl ester resulting from the formal condensation of the carboxy group of stearidonic acid with the hydroxy group of ethanol.
Last Modified18 February 2015
SubmitterSteve
DownloadsMolfile
FormulaC20H32O2
Net Charge0
Average Mass304.474
Monoisotopic Mass304.24023
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OCC
InChIInChI=1S/C20H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h5-6,8-9,11-12,14-15H,3-4,7,10,13,16-19H2,1-2H3/b6-5-,9-8-,12-11-,15-14-
InChIKeyRIDOSNBWMUADGT-AFSLFLIVSA-N
ChEBI Ontology
Outgoing Relation(s)
ethyl stearidonate (CHEBI:84856) has functional parent all-cis-octadeca-6,9,12,15-tetraenoic acid (CHEBI:32389)
ethyl stearidonate (CHEBI:84856) is a long-chain fatty acid ethyl ester (CHEBI:13209)
IUPAC Name 
ethyl (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate
Synonyms  Source
all-cis-ethyl octadeca-6,9,12,15-tetraenoateChEBI
ethyl (6Z,9Z,12Z,15Z)-octadecatetraenoateChEBI
Registry NumbersSources
Reaxys:11339959Reaxys
CAS:119798-44-6ChemIDplus