KEGG   COMPOUND: C05966
Entry
C05966                      Compound                               
Name
15(S)-HPETE;
(5Z,8Z,11Z,13E)-(15S)-15-Hydroperoxyicosa-5,8,11,13-tetraenoic acid;
15-Hydroperoxyeicosatetraenoate;
15-Hydroperoxyicosatetraenoate;
15-Hydroperoxyeicosatetraenoic acid;
15-Hydroperoxyicosatetraenoic acid;
(5Z,8Z,11Z,13E)-(15S)-15-Hydroperoxyicosa-5,8,11,13-tetraenoate
Formula
C20H32O4
Exact mass
336.2301
Mol weight
336.4657
Structure
Reaction
Pathway
map00590  Arachidonic acid metabolism
map01100  Metabolic pathways
map04726  Serotonergic synapse
map04750  Inflammatory mediator regulation of TRP channels
map04913  Ovarian steroidogenesis
Enzyme
1.11.1.12       1.13.11.33      1.14.14.1
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0104 Hydroperoxy fatty acids
    C05966  (5Z,8Z,11Z,13E)-(15S)-15-Hydroperoxyicosa-5,8,11,13-tetraenoic acid
  FA03 Eicosanoids
   FA0306 Hydroxy/hydroperoxyeicosatetraenoic acids
    C05966  15(S)-HPETE
Other DBs
PubChem: 8250
ChEBI: 15628
LIPIDMAPS: LMFA03060014
KNApSAcK: C00000400
3DMET: B01940
NIKKAJI: J461.011C
LinkDB
KCF data

ATOM        24
            1   C1c C    33.1655  -18.1928
            2   C2b C    31.7610  -18.1928
            3   C1b C    34.3875  -18.8950
            4   O2a O    33.5307  -16.8513
            5   C2b C    30.5531  -18.8950
            6   C1b C    35.5885  -18.1928
            7   O1a O    34.8720  -16.4861
            8   C2b C    29.3380  -18.1928
            9   C1b C    36.8034  -18.8950
            10  C2b C    27.9405  -18.1928
            11  C1b C    38.0185  -18.1928
            12  C1b C    26.7254  -18.8950
            13  C1a C    39.2264  -18.8950
            14  C2b C    25.5175  -18.1928
            15  C2b C    24.1130  -18.1928
            16  C1b C    22.8979  -18.8950
            17  C2b C    21.6900  -18.1928
            18  C2b C    20.2855  -18.1928
            19  C1b C    19.0916  -18.8950
            20  C1b C    17.8625  -18.1928
            21  C1b C    16.6476  -18.8950
            22  C6a C    15.4397  -18.1928
            23  O6a O    14.2246  -18.8950
            24  O6a O    15.4397  -16.7953
BOND        23
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 2
            5     3   6 1
            6     4   7 1
            7     5   8 1
            8     6   9 1
            9     8  10 2
            10    9  11 1
            11   10  12 1
            12   11  13 1
            13   12  14 1
            14   14  15 2
            15   15  16 1
            16   16  17 1
            17   17  18 2
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   22  24 2

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