KEGG   COMPOUND: C05949Help
Entry
C05949                      Compound                               

Name
12-Keto-leukotriene B4;
12-Keto-LTB4;
5-Hydroxy-12-oxo-delta5,8,11,14-eicosapolyenoic acid
Formula
C20H30O4
Exact mass
334.2144
Mol weight
334.4498
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Arachidonic acid metabolism
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0302 Leukotrienes
    C05949  12-Keto-leukotriene B4
BRITE hierarchy
Other DBs
PubChem: 
ChEBI: 
LIPIDMAPS: 
LipidBank: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   C2b C    26.3861  -15.8082
            2   C2b C    24.9906  -15.8433
            3   C1c C    27.5890  -15.1017
            4   C2b C    23.7818  -15.1485
            5   C1b C    28.8037  -15.7908
            6   O1a O    27.5890  -13.6886
            7   C2b C    22.5731  -15.8492
            8   C1b C    30.0065  -15.0783
            9   C2b C    21.3584  -15.1601
            10  C1b C    31.2212  -15.7674
            11  C2b C    20.1496  -15.8609
            12  C6a C    32.4183  -15.0607
            13  C5a C    18.9292  -15.1601
            14  O6a O    33.6328  -15.7498
            15  O6a O    32.4183  -13.6535
            16  C1b C    17.7206  -15.8609
            17  O5a O    18.9175  -13.7527
            18  C2b C    17.7206  -17.2681
            19  C2b C    18.9292  -17.9746
            20  C1b C    20.1496  -17.2681
            21  C1b C    21.3584  -17.9746
            22  C1b C    22.5731  -17.2739
            23  C1b C    23.7818  -17.9805
            24  C1a C    24.9906  -17.2855
BOND        23
            1     1   2 2
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     3   6 1 #Up
            6     4   7 2
            7     5   8 1
            8     7   9 1
            9     8  10 1
            10    9  11 2
            11   10  12 1
            12   11  13 1
            13   12  14 1
            14   12  15 2
            15   13  16 1
            16   13  17 2
            17   16  18 1
            18   18  19 2
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   23  24 1

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