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CHEBI:186375 - 20-trifluoro-LTB4

ChEBI IDCHEBI:186375
ChEBI Name20-trifluoro-LTB4
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H29F3O4
Net Charge0
Average Mass390.442
Monoisotopic Mass390.20179
SMILESO=C(O)CCC[C@H](O)/C=C\C=C\C=C\[C@H](O)C/C=C\CCCCC(F)(F)F
InChIInChI=1S/C20H29F3O4/c21-20(22,23)16-9-5-1-2-6-11-17(24)12-7-3-4-8-13-18(25)14-10-15-19(26)27/h2-4,6-8,12-13,17-18,24-25H,1,5,9-11,14-16H2,(H,26,27)/b4-3+,6-2-,12-7+,13-8-/t17-,18-/m1/s1
InChIKeyYKIRCSCMMMEEDI-QAASZIRWSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
20-trifluoro-LTB4 (CHEBI:186375) is a leukotriene (CHEBI:25029)
IUPAC Name 
(5S,6Z,8E,10E,12R,14Z)-20,20,20-triluoro-5,12-dihydroxyicosa-6,8,10,14-tetraenoic acid
Manual XrefsDatabases
4446257ChemSpider
LMFA03020019LIPID MAPS
Registry NumbersSources
CAS:115178-97-7ChemIDplus