KEGG   COMPOUND: C12360
Entry
C12360                      Compound                               

Name
9-Hydroxy-3,5,7,11,13,15,17-octaoxo-octadecanoyl-[acp]
Formula
C18H21O9SR
Structure
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA07 Fatty esters
   FA0706 Fatty acyl ACPs
    C12360  9-Hydroxy-3,5,7,11,13,15,17-octaoxo-octadecanoyl-[acp]
Other DBs
PubChem: 582750
ChEBI: 31152
LIPIDMAPS: LMFA07060033
KCF data

ATOM        29
            1   S2a S    34.0783  -17.6334
            2   C1b C    31.6587  -17.6430
            3   C1a C    12.2869  -17.6931
            4   C5a C    13.4920  -16.9910
            5   C1b C    14.7064  -17.6835
            6   C5a C    15.9115  -16.9814
            7   O5a O    15.9074  -15.5771
            8   O5a O    13.4879  -15.5866
            9   C1b C    17.1260  -17.6742
            10  C5a C    18.3404  -16.9719
            11  C1b C    19.5551  -17.6742
            12  C5a C    20.7600  -16.9625
            13  C1b C    21.9651  -17.6646
            14  C1c C    23.1702  -16.9625
            15  C1b C    24.3942  -17.6550
            16  O5a O    18.3363  -15.5677
            17  O5a O    20.7559  -15.5677
            18  O1a O    23.1754  -15.5582
            19  C5a C    25.5990  -16.9530
            20  C1b C    26.8137  -17.6550
            21  C5a C    28.0186  -16.9434
            22  C1b C    29.2426  -17.6457
            23  C5a C    30.4477  -16.9434
            24  O5a O    25.6045  -15.5486
            25  O5a O    28.0241  -15.5486
            26  O5a O    30.4436  -15.5393
            27  C5a C    32.8577  -16.9341
            28  O5a O    32.8602  -15.5297
            29  R   R    35.4783  -17.6334
BOND        28
            1    10  16 2
            2     5   6 1
            3    12  17 2
            4     9  10 1
            5    14  18 1
            6    15  19 1
            7    10  11 1
            8    19  20 1
            9     6   7 2
            10   20  21 1
            11   11  12 1
            12   21  22 1
            13    4   5 1
            14   22  23 1
            15   23   2 1
            16   12  13 1
            17   19  24 2
            18    4   8 2
            19   21  25 2
            20   13  14 1
            21   23  26 2
            22    3   4 1
            23    2  27 1
            24   27   1 1
            25   14  15 1
            26   27  28 2
            27    6   9 1
            28    1  29 1

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