KEGG   COMPOUND: C04792
Entry
C04792                      Compound                               
Name
1-Acyl-2-[(S)-12-hydroxyoleoyl]-sn-glycero-3-phosphocholine
Formula
C27H52NO9PR
Structure
Comment
Generic compound in reaction hierarchy
Reaction
Brite
Lipids [BR:br08002]
 GP  Glycerophospholipids
  GP20 Oxidized glycerophospholipids
   GP2001 Oxidized glycerophosphocholines
    C04792  1-Acyl-2-[(S)-12-hydroxyoleoyl]-sn-glycero-3-phosphocholine
Other DBs
PubChem: 7355
ChEBI: 16999
LinkDB
KCF data

ATOM        39
            1   C1c C    24.1851  -21.6087
            2   C1b C    24.1851  -22.9936
            3   O7a O    25.3770  -20.9134
            4   C1b C    22.9873  -20.9192
            5   O2b O    25.3770  -23.6830
            6   C7a C    25.3713  -19.5285
            7   O7a O    22.9873  -19.5345
            8   P1b P    26.6508  -23.6830
            9   C1b C    26.5691  -18.8450
            10  O6a O    24.1792  -18.8450
            11  C7a C    21.7895  -18.8507
            12  O2b O    28.1409  -23.6771
            13  O1c O    26.7326  -22.3800
            14  O1c O    26.7326  -25.1437
            15  C1b C    27.8603  -19.4175
            16  O6a O    20.5974  -19.5461
            17  R   R    21.7427  -17.6880
            18  C1b C    28.8887  -24.7582
            19  C1b C    28.9588  -18.8333
            20  C1b C    30.2793  -24.7465
            21  C1b C    30.1626  -19.5228
            22  N1d N    31.0449  -25.8976 #+
            23  C1b C    31.3604  -18.8275
            24  C1a C    33.0957  -25.9267
            25  C1a C    30.4254  -27.1362
            26  C1a C    32.0382  -27.3582
            27  C1b C    32.5640  -19.5170
            28  C1b C    33.8143  -18.7865
            29  C2b C    33.7852  -17.4486
            30  C2b C    32.5991  -16.7591
            31  C1b C    31.3895  -17.4309
            32  C1c C    30.2092  -16.7240
            33  C1b C    28.9998  -17.4075
            34  O1a O    30.2209  -15.3508
            35  C1b C    27.8078  -16.7006
            36  C1b C    26.6042  -17.3784
            37  C1b C    25.4180  -16.6772
            38  C1b C    24.2085  -17.3491
            39  C1a C    23.0165  -16.6479
BOND        38
            1     1   2 1
            2     1   3 1 #Up
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     5   8 1
            8     6   9 1
            9     6  10 2
            10    7  11 1
            11    8  12 1
            12    8  13 1
            13    8  14 2
            14    9  15 1
            15   11  16 2
            16   11  17 1
            17   12  18 1
            18   15  19 1
            19   18  20 1
            20   19  21 1
            21   20  22 1
            22   21  23 1
            23   22  24 1
            24   22  25 1
            25   22  26 1
            26   23  27 1
            27   27  28 1
            28   28  29 1
            29   29  30 2
            30   30  31 1
            31   31  32 1
            32   32  33 1
            33   32  34 1 #Down
            34   33  35 1
            35   35  36 1
            36   36  37 1
            37   37  38 1
            38   38  39 1

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