KEGG   COMPOUND: C12362
Entry
C12362                      Compound                               
Name
9-Hydroxy-3,5,7,11,13,15,17-octaoxo-eicosanoyl-[acp]
Formula
C20H25O9SR
Structure
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA07 Fatty esters
   FA0706 Fatty acyl ACPs
    C12362  9-Hydroxy-3,5,7,11,13,15,17-octaoxo-eicosanoyl-[acp]
Other DBs
PubChem: 582752
ChEBI: 31150
KCF data

ATOM        31
            1   S2a S    35.3481  -17.6363
            2   C1b C    32.9280  -17.6459
            3   C1b C    13.5513  -17.6960
            4   C5a C    14.7567  -16.9938
            5   C1b C    15.9714  -17.6864
            6   C5a C    17.1768  -16.9842
            7   O5a O    17.1727  -15.5795
            8   O5a O    14.7526  -15.5891
            9   C1b C    18.3916  -17.6771
            10  C5a C    19.6063  -16.9746
            11  C1b C    20.8213  -17.6771
            12  C5a C    22.0265  -16.9653
            13  C1b C    23.2319  -17.6675
            14  C1c C    24.4373  -16.9653
            15  C1b C    25.6616  -17.6580
            16  O5a O    19.6022  -15.5701
            17  O5a O    22.0224  -15.5701
            18  O1a O    24.4425  -15.5606
            19  C5a C    26.8668  -16.9557
            20  C1b C    28.0817  -17.6580
            21  C5a C    29.2869  -16.9462
            22  C1b C    30.5112  -17.6486
            23  C5a C    31.7166  -16.9462
            24  O5a O    26.8722  -15.5510
            25  O5a O    29.2924  -15.5510
            26  O5a O    31.7125  -15.5417
            27  C5a C    34.1272  -16.9368
            28  O5a O    34.1297  -15.5321
            29  C1b C    12.3402  -17.0033
            30  C1a C    11.1348  -17.7056
            31  R   R    36.7481  -17.6363
BOND        30
            1    12  17 2
            2     9  10 1
            3    14  18 1
            4    15  19 1
            5    10  11 1
            6    19  20 1
            7     6   7 2
            8    20  21 1
            9    11  12 1
            10   21  22 1
            11    4   5 1
            12   22  23 1
            13   23   2 1
            14   12  13 1
            15   19  24 2
            16    4   8 2
            17   21  25 2
            18   13  14 1
            19   23  26 2
            20    3   4 1
            21    2  27 1
            22   27   1 1
            23   14  15 1
            24   27  28 2
            25    6   9 1
            26   10  16 2
            27    3  29 1
            28    5   6 1
            29   29  30 1
            30    1  31 1

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