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

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ChEBI Name 12,20-dioxoleukotriene B4(1−)
ChEBI ID CHEBI:133436
ChEBI ASCII Name 12,20-dioxoleukotriene B4(1-)
Definition A 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.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter AnneNiknejad
Supplier Information
Download Molfile XML SDF
Formula C20H27O5
Net Charge -1
Average Mass 347.426
Monoisotopic Mass 347.18640
InChI InChI=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
InChIKey CPTWPKCLDUXOKW-RBQYXHKQSA-M
SMILES C(C(/C=C/C=C/C=C\[C@H](CCCC([O-])=O)O)=O)/C=C\CCCCC=O
ChEBI Ontology
Outgoing 12,20-dioxoleukotriene B4(1−) (CHEBI:133436) is a ω-oxo fatty acid anion (CHEBI:76309)
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 conjugate base of 12,20-dioxoleukotriene B4 (CHEBI:134520)
Incoming 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 Sources
12,20-dioxo-leukotriene B4(1−) ChEBI
12,20-dioxo-LTB4(1−) ChEBI
Last Modified
14 February 2017