KEGG   COMPOUND: C13918
Entry
C13918                      Compound                               
Name
N-(30-(9Z,12Z-Octadecadienoyloxy)-tricontanoyl)-sphing-4-enine
Formula
C66H125NO5
Exact mass
1011.9558
Mol weight
1012.7024
Structure
Brite
Lipids [BR:br08002]
 SP  Sphingolipids
  SP02 Ceramides
   SP0204 Acylceramides
    C13918  N-(30-(9Z,12Z-octadecadienoyloxy)-tricontanoyl)-sphing-4-enine
Other DBs
PubChem: 854162
ChEBI: 34862
LIPIDMAPS: LMSP02040001
3DMET: B04612
NIKKAJI: J1.573.692E
LinkDB
KCF data

ATOM        72
            1   C1c C    17.3658  -20.3839
            2   C1c C    18.5801  -21.0378
            3   N1b N    17.3658  -18.9360
            4   C1b C    16.1514  -21.0846
            5   C2b C    19.7945  -20.3373
            6   O1a O    18.6269  -22.4390
            7   C5a C    18.5335  -18.2354
            8   O1a O    14.9370  -20.3839
            9   C2b C    21.0088  -21.0378
            10  O5a O    18.5335  -16.8342
            11  C1b C    19.7945  -18.9360
            12  C1b C    22.2231  -20.3373
            13  C1b C    23.4843  -20.9912
            14  C1b C    24.6985  -20.2906
            15  C1b C    25.9130  -20.9912
            16  C1b C    27.1273  -20.2439
            17  C1b C    28.3417  -20.9444
            18  C1b C    29.5562  -20.2439
            19  C1b C    30.7705  -20.9444
            20  C1b C    31.9847  -20.1971
            21  C1b C    33.2459  -20.8977
            22  C1b C    34.4604  -20.1971
            23  C1b C    35.6747  -20.8977
            24  C1a C    36.8891  -20.1505
            25  C1b C    21.0088  -18.2354
            26  C1b C    22.2231  -18.9360
            27  C1b C    23.4376  -18.2354
            28  C1b C    24.6520  -18.9360
            29  C1b C    25.8662  -18.2354
            30  C1b C    27.0806  -18.9360
            31  C1b C    28.2951  -18.2354
            32  C1b C    29.5094  -18.9360
            33  C1b C    30.7238  -18.2354
            34  C1b C    31.9847  -18.9360
            35  C1b C    33.1993  -18.2354
            36  C1b C    34.4136  -18.9360
            37  C1b C    35.6279  -18.2354
            38  C1b C    36.8425  -18.9360
            39  C1b C    38.0567  -18.2354
            40  C1b C    39.2710  -18.9360
            41  C1b C    40.4855  -18.2354
            42  C1b C    41.7467  -18.9360
            43  C1b C    42.9609  -18.2354
            44  C1b C    42.9609  -16.8342
            45  C1b C    41.7467  -16.1337
            46  C1b C    40.5321  -16.8342
            47  C1b C    39.3178  -16.1337
            48  C1b C    38.0567  -16.8342
            49  C1b C    36.8425  -16.1337
            50  C1b C    35.6279  -16.8342
            51  C1b C    34.4136  -16.1337
            52  C1b C    33.1993  -16.8342
            53  O7a O    31.9847  -16.1337
            54  C7a C    30.7705  -16.8342
            55  C1b C    29.5562  -16.1337
            56  C1b C    28.3417  -16.8342
            57  C1b C    27.1273  -16.1337
            58  C1b C    25.8662  -16.8342
            59  C1b C    24.6520  -16.1337
            60  C1b C    23.4376  -16.8342
            61  C1b C    22.2231  -16.1337
            62  C2b C    21.0088  -16.8342
            63  C2b C    19.7945  -16.1337
            64  C1b C    19.7945  -14.7325
            65  C2b C    21.0088  -14.0318
            66  O6a O    30.7545  -17.7683
            67  C2b C    21.0089  -12.6206
            68  C1b C    19.7874  -11.9151
            69  C1b C    18.5704  -12.6175
            70  C1b C    17.3616  -11.9195
            71  C1b C    16.1460  -12.6211
            72  C1a C    14.9343  -11.9213
BOND        71
            1     1   2 1
            2     1   3 1 #Down
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Up
            6     3   7 1
            7     4   8 1
            8     5   9 2
            9     7  10 2
            10    7  11 1
            11    9  12 1
            12   12  13 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   23  24 1
            24   11  25 1
            25   25  26 1
            26   26  27 1
            27   27  28 1
            28   28  29 1
            29   29  30 1
            30   30  31 1
            31   31  32 1
            32   32  33 1
            33   33  34 1
            34   34  35 1
            35   35  36 1
            36   36  37 1
            37   37  38 1
            38   38  39 1
            39   39  40 1
            40   40  41 1
            41   41  42 1
            42   42  43 1
            43   43  44 1
            44   44  45 1
            45   45  46 1
            46   46  47 1
            47   47  48 1
            48   48  49 1
            49   49  50 1
            50   50  51 1
            51   51  52 1
            52   52  53 1
            53   53  54 1
            54   54  55 1
            55   55  56 1
            56   56  57 1
            57   57  58 1
            58   58  59 1
            59   59  60 1
            60   60  61 1
            61   61  62 1
            62   62  63 2
            63   63  64 1
            64   64  65 1
            65   54  66 2
            66   65  67 2
            67   67  68 1
            68   68  69 1
            69   69  70 1
            70   70  71 1
            71   71  72 1

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