KEGG   COMPOUND: C14814
Entry
C14814                      Compound                               
Name
11,14,15-THETA;
11,14,15-Trihydroxyicosatrienoic acid;
(5Z,8Z,12E)-11,14,15-Trihydroxyeicosa-5,8,12-trienoic acid;
(5Z,8Z,12E)-11,14,15-Trihydroxyicosa-5,8,12-trienoic acid
Formula
C20H34O5
Exact mass
354.2406
Mol weight
354.48
Structure
Reaction
R07045
Pathway
map00590  Arachidonic acid metabolism
map01100  Metabolic pathways
Enzyme
1.14.14.1
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0305 Hydroxy/hydroperoxyeicosatrienoic acids
    C14814  11,14,15-THETA
Other DBs
PubChem: 17395812
ChEBI: 34131
LIPIDMAPS: LMFA03050018
NIKKAJI: J1.034.922B
LinkDB
KCF data

ATOM        25
            1   C1c C    28.9362  -22.8343
            2   C1b C    27.7595  -23.5265
            3   C2b C    26.5829  -22.8343
            4   C2b C    25.1294  -22.8343
            5   C1b C    23.9528  -23.5265
            6   C2b C    22.7761  -22.8343
            7   C2b C    21.3918  -22.8343
            8   C1b C    20.2152  -23.5265
            9   C1b C    18.9694  -22.8343
            10  C1b C    17.7927  -23.5265
            11  C6a C    16.6161  -22.8343
            12  O6a O    15.3702  -23.5265
            13  O6a O    16.6161  -21.4501
            14  C2b C    31.3587  -22.8343
            15  C2b C    30.1128  -23.5265
            16  C1c C    32.5353  -23.5265
            17  C1c C    33.9196  -23.5265
            18  C1b C    35.0962  -22.8343
            19  C1b C    36.2729  -23.5265
            20  C1b C    37.4495  -22.8343
            21  C1b C    38.6261  -23.5265
            22  C1a C    39.8028  -22.8343
            23  O1a O    28.9362  -21.4501
            24  O1a O    32.1702  -25.1475
            25  O1a O    34.2878  -25.1586
BOND        24
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     6   7 2
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12   11  13 2
            13   14  15 2
            14   15   1 1
            15   16  14 1
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22    1  23 1
            23   16  24 1
            24   17  25 1

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