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CHEBI:172614 - 12-Oxo-20-trihydroxy-leukotriene B4

ChEBI IDCHEBI:172614
ChEBI Name12-Oxo-20-trihydroxy-leukotriene B4
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O7
Net Charge0
Average Mass382.453
Monoisotopic Mass382.19915
SMILESO=C(O)CCC[C@@H](O)/C=C\C=C\C=C\C(=O)C/C=C\CCCCC(O)(O)O
InChIInChI=1S/C20H30O7/c21-17(11-6-2-1-5-9-16-20(25,26)27)12-7-3-4-8-13-18(22)14-10-15-19(23)24/h2-4,6-8,12-13,18,22,25-27H,1,5,9-11,14-16H2,(H,23,24)/b4-3+,6-2-,12-7+,13-8-/t18-/m0/s1
InChIKeyQVZXILIWUPKGPA-CWJNPFRJSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
12-Oxo-20-trihydroxy-leukotriene B4 (CHEBI:172614) is a leukotriene (CHEBI:25029)
IUPAC Name 
(5R,6Z,8E,10E,14Z)-5,20,20,20-tetrahydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid
Manual XrefsDatabases
HMDB0012553HMDB
30776629ChemSpider
LMFA03020050LIPID MAPS