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CHEBI:133303 - 12-HEPE(1−)

ChEBI IDCHEBI:133303
ChEBI Name12-HEPE(1−)
Stars
ASCII Name12-HEPE(1-)
DefinitionA HEPE(1−) that is the conjugate base of 12-HEPE, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified6 February 2017
Submitterlaimo
DownloadsMolfile
FormulaC20H29O3
Net Charge-1
Average Mass317.449
Monoisotopic Mass317.21222
SMILESCC/C=C\C/C=C\CC(O)/C=C/C=C\C/C=C\CCCC(=O)[O-]
InChIInChI=1S/C20H30O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h3-4,7-11,13-14,17,19,21H,2,5-6,12,15-16,18H2,1H3,(H,22,23)/p-1/b4-3-,9-7-,11-8-,13-10-,17-14+
InChIKeyMCRJLMXYVFDXLS-QGQBRVLBSA-M
ChEBI Ontology
Outgoing Relation(s)
12-HEPE(1−) (CHEBI:133303) is a HEPE(1−) (CHEBI:131874)
12-HEPE(1−) (CHEBI:133303) is conjugate base of 12-HEPE (CHEBI:72645)
Incoming Relation(s)
12-HEPE (CHEBI:72645) is conjugate acid of 12-HEPE(1−) (CHEBI:133303)
IUPAC Name 
(5Z,8Z,10E,14Z,17Z)-12-hydroxyicosa-5,8,10,14,17-pentaenoate
Synonym  Source
12-hydroxyicosa-5Z,8Z,10E,14Z,17Z-pentaenoate(1−)SUBMITTER
UniProt Name  Source
12-hydroxy-(5Z,8Z,10E,14Z,17Z)-eicosapentaenoateUniProt