KEGG   COMPOUND: C14781
Entry
C14781                      Compound                               
Name
15H-11,12-EETA;
15-Hydroxy-11,12-epoxyeicosatrienoic acid;
(5Z,8Z,13E)-(15S)-11,12-Epoxy-15-hydroxyeicosa-5,8,13-trienoic acid;
(5Z,8Z,13E)-(15S)-11,12-Epoxy-15-hydroxyicosa-5,8,13-trienoic acid
Formula
C20H32O4
Exact mass
336.2301
Mol weight
336.4657
Structure
Reaction
R07042 R07044
Pathway
map00590  Arachidonic acid metabolism
map01100  Metabolic pathways
Enzyme
1.14.14.1
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0308 Epoxyeicosatrienoic acids
    C14781  15-Hydroxy-11,12-EETA
Other DBs
PubChem: 17395779
ChEBI: 34160
LIPIDMAPS: LMFA03080007
NIKKAJI: J2.789.311B
LinkDB
KCF data

ATOM        24
            1   C1c C    28.5887  -16.6780
            2   C2b C    27.1821  -16.6780
            3   C1b C    29.8126  -17.3812
            4   O1a O    28.9545  -15.3344
            5   C2b C    25.9724  -17.3812
            6   C1b C    31.0154  -16.6780
            7   C1y C    24.7555  -16.6780
            8   C1b C    32.2321  -17.3812
            9   C1y C    23.3558  -16.6780
            10  C1b C    33.4491  -16.6780
            11  C1b C    22.1389  -17.3812
            12  C1a C    34.6588  -17.3812
            13  C2b C    20.9292  -16.6780
            14  C2b C    19.5226  -16.6780
            15  C1b C    18.3056  -17.3812
            16  C2b C    17.0959  -16.6780
            17  C2b C    15.6893  -16.6780
            18  C1b C    14.4936  -17.3812
            19  C1b C    13.2626  -16.6780
            20  C1b C    12.0459  -17.3812
            21  C6a C    10.8362  -16.6780
            22  O6a O     9.6192  -17.3812
            23  O6a O    10.8362  -15.2784
            24  O2x O    24.0464  -15.4934
BOND        24
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 2
            5     3   6 1
            6     5   7 1
            7     6   8 1
            8     7   9 1
            9     8  10 1
            10    9  11 1
            11   10  12 1
            12   11  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   21  23 2
            23    9  24 1
            24   24   7 1

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