KEGG   COMPOUND: C05965Help
Entry
C05965                      Compound                               

Name
12(S)-HPETE;
(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyicosa-5,8,10,14-tetraenoic acid;
(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyicosa-5,8,10,14-tetraenoate;
12-Hydroperoxyeicosatetraenoate;
12-Hydroperoxyicosatetraenoate;
12-Hydroperoxyeicosatetraenoic acid;
12-Hydroperoxyicosatetraenoic acid
Formula
C20H32O4
Exact mass
336.2301
Mol weight
336.4657
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00590  Arachidonic acid metabolism
map01100  Metabolic pathways
map04726  Serotonergic synapse
map04750  Inflammatory mediator regulation of TRP channels
Enzyme
1.13.11.31      5.4.4.-
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0104 Hydroperoxy fatty acids
    C05965  (5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyicosa-5,8,10,14-tetraenoic acid
  FA03 Eicosanoids
   FA0306 Hydroxy/hydroperoxyeicosatetraenoic acids
    C05965  12(S)-HPETE
BRITE hierarchy
Other DBs
PubChem: 8249
ChEBI: 15626
ChEMBL: CHEMBL1447811
LIPIDMAPS: LMFA03060013
LipidBank: XPR6002
3DMET: B01939
NIKKAJI: J341.562G
KCF data Show

ATOM        24
            1   C2b C    22.1668  -16.1934
            2   C2b C    20.9995  -15.4929
            3   C2b C    19.5520  -15.4929
            4   C1b C    18.3379  -16.1934
            5   C2b C    17.1706  -15.4929
            6   C2b C    15.7698  -15.4929
            7   C1b C    14.5558  -16.1934
            8   C1b C    13.3417  -15.4929
            9   C1b C    12.1277  -16.1934
            10  C6a C    10.9136  -15.4929
            11  O6a O     9.6995  -16.1934
            12  O6a O    10.9136  -14.0921
            13  C2b C    23.4275  -15.4929
            14  C1c C    24.6416  -16.1934
            15  C1b C    25.8089  -15.4929
            16  C2b C    27.0230  -16.1934
            17  C2b C    28.4238  -16.1934
            18  C1b C    29.6378  -15.4929
            19  C1b C    30.8518  -16.1934
            20  C1b C    32.0659  -15.4929
            21  O2a O    24.5949  -17.5942
            22  O1a O    23.3809  -18.2946
            23  C1b C    33.2799  -16.1934
            24  C1a C    34.4939  -15.4929
BOND        23
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     5   6 2
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   10  12 2
            12    1  13 2
            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   14  21 1 #Down
            21   21  22 1
            22   20  23 1
            23   23  24 1

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