KEGG   COMPOUND: C14773
Entry
C14773                      Compound                               
Name
8,9-DHET;
(5Z,11Z,14Z)-8,9-Dihydroxyeicosa-5,11,14-trienoic acid;
(5Z,11Z,14Z)-8,9-Dihydroxyicosa-5,11,14-trienoic acid
Formula
C20H34O4
Exact mass
338.2457
Mol weight
338.4816
Structure
Reaction
Pathway
map00590  Arachidonic acid metabolism
map01100  Metabolic pathways
map04726  Serotonergic synapse
Enzyme
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0305 Hydroxy/hydroperoxyeicosatrienoic acids
    C14773  8,9-DHET
Other DBs
PubChem: 17395771
ChEBI: 63970
LIPIDMAPS: LMFA03050006
NIKKAJI: J472.252C
LinkDB
KCF data

ATOM        24
            1   C2b C    22.3536  -14.9876
            2   C2b C    21.0262  -14.9937
            3   C1b C    23.4917  -15.6544
            4   C1b C    19.8760  -15.6729
            5   C1b C    24.6358  -14.9876
            6   C1c C    18.7198  -15.0060
            7   C1b C    25.7798  -15.6544
            8   C1c C    17.4044  -15.0122
            9   C6a C    26.9239  -14.9876
            10  C1b C    16.2663  -16.8788
            11  O6a O    28.0740  -15.6485
            12  O6a O    26.9239  -13.6663
            13  C2b C    17.3188  -18.7883
            14  C2b C    18.6463  -18.7822
            15  C1b C    19.7843  -18.1091
            16  C2b C    20.9343  -18.7639
            17  C2b C    22.2437  -18.7577
            18  C1b C    23.3754  -18.0909
            19  C1b C    24.5071  -18.7454
            20  C1b C    25.6391  -18.0847
            21  C1b C    26.7769  -18.7393
            22  C1a C    27.9088  -18.0724
            23  O1a O    16.7084  -13.7803
            24  O1a O    19.0835  -13.6364
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 1
            8     7   9 1
            9     8  10 1
            10    9  11 1
            11    9  12 2
            12   10  13 1
            13   13  14 2
            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    8  23 1
            23    6  24 1

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