KEGG   COMPOUND: C05958Help
Entry
C05958                      Compound                               

Name
delta-12-Prostaglandin J2;
delta-12-PGJ2
Formula
C20H30O4
Exact mass
334.2144
Mol weight
334.4498
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Arachidonic acid metabolism
Metabolic pathways
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0301 Prostaglandins
    C05958  delta-12-Prostaglandin J2
BRITE hierarchy
Other DBs
CAS: 
87893-54-7
PubChem: 
ChEBI: 
LIPIDMAPS: 
LipidBank: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   C2y C    20.8537  -26.0071
            2   C1y C    20.8410  -24.6064
            3   C5x C    19.4322  -26.3758
            4   C2b C    21.9958  -26.6950
            5   C2x C    19.5222  -24.1233
            6   C1b C    22.0450  -23.8857
            7   C2x C    18.6540  -25.2126
            8   O5x O    18.7032  -27.5962
            9   C1b C    23.2080  -25.9907
            10  C2b C    23.2571  -24.5900
            11  C1c C    24.4203  -26.6869
            12  C2b C    24.4695  -23.8774
            13  C1b C    25.6160  -25.9824
            14  O1a O    24.4120  -28.0874
            15  C1b C    24.4695  -22.4769
            16  C1b C    26.8365  -26.6786
            17  C1b C    25.6652  -21.7888
            18  C1b C    28.0405  -25.9744
            19  C1b C    25.6652  -20.3883
            20  C1b C    29.2529  -26.6622
            21  C6a C    26.8776  -19.6757
            22  C1a C    30.4650  -25.9660
            23  O6a O    26.8693  -18.2750
            24  O6a O    28.0897  -20.3883
BOND        24
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     6  10 1
            10    9  11 1
            11   10  12 2
            12   11  13 1
            13   11  14 1 #Down
            14   12  15 1
            15   13  16 1
            16   15  17 1
            17   16  18 1
            18   17  19 1
            19   18  20 1
            20   19  21 1
            21   20  22 1
            22   21  23 1
            23   21  24 2
            24    5   7 2

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