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CHEBI:90719 - 12,20-DiHETE(1−)

ChEBI IDCHEBI:90719
ChEBI Name12,20-DiHETE(1−)
Stars
ASCII Name12,20-DiHETE(1-)
DefinitionAn icosanoid anion that is the conjugate base of 12,20-DiHETE arising from deprotonation of the carboxylic acid function; major species at pH 7.3.
Last Modified23 January 2023
Submitternhn
DownloadsMolfile
FormulaC20H31O4
Net Charge-1
Average Mass335.464
Monoisotopic Mass335.22278
SMILESO=C([O-])CCC/C=C\C/C=C\C=C\C(O)C/C=C\CCCCCO
InChIInChI=1S/C20H32O4/c21-18-14-10-6-5-8-12-16-19(22)15-11-7-3-1-2-4-9-13-17-20(23)24/h2-4,7-8,11-12,15,19,21-22H,1,5-6,9-10,13-14,16-18H2,(H,23,24)/p-1/b4-2-,7-3-,12-8-,15-11+
InChIKeyNUPDGIJXOAHJRW-LNESKJDXSA-M
ChEBI Ontology
Outgoing Relation(s)
12,20-DiHETE(1−) (CHEBI:90719) has functional parent 12-HETE(1−) (CHEBI:90718)
12,20-DiHETE(1−) (CHEBI:90719) is a dihydroxyicosatetraenoate (CHEBI:131877)
12,20-DiHETE(1−) (CHEBI:90719) is a icosanoid anion (CHEBI:62937)
12,20-DiHETE(1−) (CHEBI:90719) is a polyunsaturated fatty acid anion (CHEBI:76567)
12,20-DiHETE(1−) (CHEBI:90719) is a ω-hydroxy-long-chain fatty acid anion (CHEBI:140992)
12,20-DiHETE(1−) (CHEBI:90719) is conjugate base of 12,20-DiHETE (CHEBI:90990)
Incoming Relation(s)
12,20-DiHETE (CHEBI:90990) is conjugate acid of 12,20-DiHETE(1−) (CHEBI:90719)
IUPAC Name 
(5Z,8Z,10E,14Z)-12,20-dihydroxyicosa-5,8,10,14-tetraenoate
Synonyms  Source
12,20-dihydroxy-(5Z,8Z,10E,14Z)-eicosatetraenoateSUBMITTER
12,20-dihydroxy-(5Z,8Z,10E,14Z)-icosatetraenoateChEBI
(5Z,8Z,10E,14Z)-12,20-dihydroxyicosatetraenoateChEBI
UniProt Name  Source
12,20-dihydroxy-(5Z,8Z,10E,14Z)-eicosatetraenoateUniProt
Citations