KEGG   COMPOUND: C16532Help
Entry
C16532                      Compound                               

Name
Tetracosenoyl-CoA;
Nervonoyl-CoA;
(15Z)-Tetracosenoyl-CoA
Formula
C45H80N7O17P3S
Exact mass
1115.4544
Mol weight
1116.1397
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01040  Biosynthesis of unsaturated fatty acids
map01212  Fatty acid metabolism
Enzyme
3.1.2.-
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA07 Fatty esters
   FA0705 Fatty acyl CoAs
    C16532  (15Z)-Tetracosenoyl-CoA
BRITE hierarchy
Other DBs
PubChem: 51090861
ChEBI: 74142
NIKKAJI: J2.803.678G
KCF data Show

ATOM        73
            1   C1b C    28.0700  -21.0000
            2   C1b C    26.9500  -20.3000
            3   C1b C    25.7600  -21.0000
            4   C1b C    24.5000  -20.3000
            5   C1b C    23.3800  -21.0000
            6   C1b C    22.1900  -20.3000
            7   C1b C    20.9300  -21.0000
            8   C1b C    19.8100  -20.3000
            9   C1b C    18.6200  -21.0000
            10  C1b C    17.3600  -20.3000
            11  C1b C    16.2400  -21.0000
            12  C1b C    15.0500  -20.3000
            13  C1b C    13.8600  -21.0000
            14  C2b C    12.6700  -20.3000
            15  C2b C    11.2700  -20.3000
            16  C1b C    10.0100  -21.0000
            17  C1b C     8.8900  -20.3000
            18  C1b C     7.7000  -21.0000
            19  C1b C     6.5100  -20.3000
            20  C1b C     5.3900  -21.0000
            21  C1b C     4.2000  -20.3000
            22  C1b C     2.9400  -21.0000
            23  C1a C     1.7500  -20.3000
            24  C5a C    29.3300  -20.3000
            25  S2a S    30.5200  -21.0000
            26  C1b C    31.7100  -20.3000
            27  C1b C    32.9700  -21.0000
            28  N1b N    34.1600  -20.3000
            29  C5a C    35.3500  -21.0000
            30  C1b C    36.6100  -20.3000
            31  C1b C    37.8000  -21.0000
            32  N1b N    38.9900  -20.3000
            33  C5a C    40.2500  -21.0000
            34  C1c C    41.4400  -20.3000
            35  C1d C    42.6300  -21.0000
            36  C1b C    43.8200  -20.3000
            37  O2b O    45.0800  -21.0000
            38  O5a O    29.3300  -18.9000
            39  O5a O    35.3500  -22.4000
            40  O5a O    40.2500  -22.4000
            41  O1a O    41.4400  -18.9000
            42  C1a C    42.6300  -19.6000
            43  C1a C    42.6300  -22.4000
            44  P1b P    46.4800  -21.0000
            45  O1c O    47.8800  -21.0000
            46  O1c O    46.4800  -22.4000
            47  C1y C    39.9700  -16.0300
            48  C1y C    41.3700  -16.0300
            49  C1y C    41.7900  -14.7000
            50  O2x O    40.6700  -13.8600
            51  C1y C    39.5500  -14.7000
            52  C1b C    43.1200  -14.2800
            53  O1a O    39.1300  -17.1500
            54  O2b O    42.2100  -17.1500
            55  P1b P    43.6100  -17.1500
            56  O1c O    43.6100  -15.7500
            57  O1c O    45.0100  -17.1500
            58  O1c O    43.6100  -18.5500
            59  C8y C    35.4200  -12.8800
            60  C8y C    35.4200  -14.2800
            61  N4y N    37.8700  -14.2800
            62  C8x C    37.8700  -12.8800
            63  N5x N    36.6100  -12.1800
            64  C8y C    34.2300  -12.1800
            65  N5x N    32.9700  -12.8800
            66  C8x C    32.9700  -14.2800
            67  N5x N    34.2300  -14.9800
            68  N1a N    34.2300  -10.7800
            69  O2b O    45.0800  -14.7000
            70  P1b P    46.4800  -14.7000
            71  O1c O    46.4800  -13.3000
            72  O1c O    47.8800  -14.7000
            73  O2c O    46.4800  -17.9200
BOND        75
            1     1   2 1
            2     2   3 1
            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     9  10 1
            10   10  11 1
            11   11  12 1
            12   12  13 1
            13   13  14 1
            14   14  15 2
            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    1  24 1
            24   24  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   24  38 2
            38   29  39 2
            39   33  40 2
            40   34  41 1 #Down
            41   35  42 1
            42   35  43 1
            43   37  44 1
            44   44  45 2
            45   44  46 1
            46   47  48 1
            47   48  49 1
            48   49  50 1
            49   50  51 1
            50   47  51 1
            51   49  52 1 #Down
            52   47  53 1 #Up
            53   48  54 1 #Up
            54   54  55 1
            55   55  56 1
            56   55  57 1
            57   55  58 2
            58   59  60 2
            59   60  61 1
            60   61  62 1
            61   62  63 2
            62   59  63 1
            63   59  64 1
            64   64  65 2
            65   65  66 1
            66   66  67 2
            67   60  67 1
            68   64  68 1
            69   51  61 1 #Down
            70   52  69 1
            71   69  70 1
            72   70  71 1
            73   70  72 2
            74   70  73 1
            75   44  73 1

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