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CHEBI:133436 - 12,20-dioxoleukotriene B4(1−)

ChEBI IDCHEBI:133436
ChEBI Name12,20-dioxoleukotriene B4(1−)
Stars
ASCII Name12,20-dioxoleukotriene B4(1-)
DefinitionA leukotriene anion that is the conjugate base of 12,20-dioxoleukotriene B4, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified14 February 2017
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC20H27O5
Net Charge-1
Average Mass347.431
Monoisotopic Mass347.18640
SMILESO=CCCCC/C=C\CC(=O)/C=C/C=C/C=C\[C@@H](O)CCCC(=O)[O-]
InChIInChI=1S/C20H28O5/c21-17-10-6-2-1-3-7-12-18(22)13-8-4-5-9-14-19(23)15-11-16-20(24)25/h3-5,7-9,13-14,17,19,23H,1-2,6,10-12,15-16H2,(H,24,25)/p-1/b5-4+,7-3-,13-8+,14-9-/t19-/m1/s1
InChIKeyCPTWPKCLDUXOKW-RBQYXHKQSA-M
ChEBI Ontology
Outgoing Relation(s)
12,20-dioxoleukotriene B4(1−) (CHEBI:133436) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
12,20-dioxoleukotriene B4(1−) (CHEBI:133436) is a leukotriene anion (CHEBI:62942)
12,20-dioxoleukotriene B4(1−) (CHEBI:133436) is a polyunsaturated fatty acid anion (CHEBI:76567)
12,20-dioxoleukotriene B4(1−) (CHEBI:133436) is a ω-oxo fatty acid anion (CHEBI:76309)
12,20-dioxoleukotriene B4(1−) (CHEBI:133436) is conjugate base of 12,20-dioxoleukotriene B4 (CHEBI:134520)
Incoming Relation(s)
12,20-dioxoleukotriene B4 (CHEBI:134520) is conjugate acid of 12,20-dioxoleukotriene B4(1−) (CHEBI:133436)
IUPAC Name 
(5S,6Z,8E,10E,14Z)-5-hydroxy-12,20-dioxoicosa-6,8,10,14-tetraenoate
Synonyms  Source
12,20-dioxo-LTB4(1−)ChEBI
12,20-dioxo-leukotriene B4(1−)ChEBI