RefMet Compound Details

RefMet IDRM0150237
MW structure2576 (View MW Metabolite Database details)
RefMet name20-Hydroxy LTB4
Systematic name5S,12R,20-trihydroxy-6Z,8E,10E,14Z-eicosatetraenoic acid
SMILESC(CCCCO)/C=CC[C@H](/C=C/C=C/C=C[C@H](CCCC(=O)O)O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass352.224975 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC20H32O5View other entries in RefMet with this formula
InChIInChI=1S/C20H32O5/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/h3-5,7-9,13-14,18-19,21-23H,1-2,6,10-12,15-17
H2,(H,24,25)/b5-4+,7-3-,13-8+,14-9-/t18-,19-/m1/s1
InChIKeyPTJFJXLGRSTECQ-PSPARDEHSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassFatty Acyls
Main ClassEicosanoids
Sub ClassLeukotrienes
Pubchem CID5280745
ChEBI ID15646
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving 20-Hydroxy LTB4

Rxn IDKEGG ReactionEnzyme
R03866 Leukotriene B4 + [Reduced NADPH---hemoprotein reductase] + Oxygen <=> 20-OH-Leukotriene B4 + [Oxidized NADPH---hemoprotein reductase] + H2O(6Z,8E,10E,14Z)-(5S,12R)-5,12-dihydroxyicosa-6,8,10,14-tetraenoate,[reduced NADPH---hemoprotein reductase]:oxygen oxidoreductase (20-hydroxylating)

Table of KEGG human pathways containing 20-Hydroxy LTB4

Pathway IDHuman Pathway# of reactions
hsa00590 Arachidonic acid metabolism 1
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