KEGG   COMPOUND: C14774
Entry
C14774                      Compound                               
Name
11,12-DHET;
(5Z,8Z,14Z)-11,12-Dihydroxyeicosa-5,8,14-trienoic acid;
(5Z,8Z,14Z)-11,12-Dihydroxyicosa-5,8,14-trienoic acid
Formula
C20H34O4
Exact mass
338.2457
Mol weight
338.4816
Structure
Reaction
R07109
Pathway
map00590  Arachidonic acid metabolism
map01100  Metabolic pathways
map04726  Serotonergic synapse
Enzyme
3.3.2.10
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0305 Hydroxy/hydroperoxyeicosatrienoic acids
    C14774  11,12-DHET
Other DBs
PubChem: 17395772
ChEBI: 63969
LIPIDMAPS: LMFA03050008
NIKKAJI: J1.455.638I
LinkDB
KCF data

ATOM        24
            1   C2b C    22.3006  -14.1805
            2   C2b C    21.0013  -14.1864
            3   C1b C    23.4146  -14.8332
            4   C1b C    19.8754  -14.8513
            5   C1b C    24.5345  -14.1805
            6   C2b C    18.7437  -14.1985
            7   C1b C    25.6543  -14.8332
            8   C2b C    17.4561  -14.2045
            9   C6a C    26.7742  -14.1805
            10  C1b C    16.3421  -16.0317
            11  O6a O    27.9000  -14.8274
            12  O6a O    26.7742  -12.8871
            13  C1c C    17.3723  -17.9007
            14  C1c C    18.6718  -17.8948
            15  C1b C    19.7857  -17.2359
            16  C2b C    20.9113  -17.8769
            17  C2b C    22.1930  -17.8708
            18  C1b C    23.3008  -17.2181
            19  C1b C    24.4085  -17.8588
            20  C1b C    25.5166  -17.2120
            21  C1b C    26.6303  -17.8528
            22  C1a C    27.7383  -17.2000
            23  O1a O    16.6516  -19.3375
            24  O1a O    19.0518  -19.4824
BOND        23
            1     1   2 2
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     4   6 1
            6     5   7 1
            7     6   8 2
            8     7   9 1
            9     8  10 1
            10    9  11 1
            11    9  12 2
            12   10  13 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 2
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   13  23 1
            23   14  24 1

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