KEGG   COMPOUND: C13808Help
Entry
C13808                      Compound                               

Name
Levuglandin D2;
LGD2;
9,10-Seco-9,11-dioxo-15S-hydroxy-5Z,13E-prostadienoic acid;
9,10-Seco-9,11-dioxo-15S-hydroxy-5Z,13E-prostadienoate
Formula
C20H32O5
Exact mass
352.225
Mol weight
352.4651
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA03 Eicosanoids
   FA0310 Levuglandins
    C13808  Levuglandin D2
BRITE hierarchy
Other DBs
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KCF data Show

ATOM        25
            1   C1c C    20.0749  -17.3350
            2   C2b C    21.2960  -18.0400
            3   C2b C    22.5171  -17.3350
            4   C1c C    23.7382  -18.0400
            5   C1b C    24.9593  -17.3350
            6   C1b C    26.1803  -18.0400
            7   C1b C    27.4014  -17.3350
            8   C1b C    28.6225  -18.0400
            9   C1a C    29.8436  -17.3350
            10  O1a O    23.7382  -19.4500
            11  C1c C    20.0749  -15.9250
            12  C5a C    18.8529  -18.0400
            13  C4a C    18.8529  -15.2199
            14  O4a O    18.8529  -13.8100
            15  C1b C    21.2981  -15.2212
            16  C2b C    22.5202  -15.9264
            17  C2b C    23.9303  -15.9264
            18  C1a C    17.6339  -17.3357
            19  C1b C    25.1532  -15.2220
            20  C1b C    26.3755  -15.9272
            21  C1b C    27.5977  -15.2220
            22  C6a C    28.8199  -15.9272
            23  O6a O    30.0422  -15.2220
            24  O6a O    28.8199  -17.1024
            25  O5a O    18.8525  -19.4377
BOND        24
            1     1   2 1 #Up
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     4  10 1 #Down
            10    1  11 1
            11    1  12 1
            12   11  13 1
            13   13  14 2
            14   11  15 1 #Down
            15   15  16 1
            16   16  17 2
            17   12  18 1
            18   17  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   22  24 2
            24   12  25 2

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