KEGG   COMPOUND: C16173
Entry
C16173                      Compound                               

Name
(4Z,7Z,10Z,13Z,16Z)-Docosapentaenoyl-CoA
Formula
C43H68N7O17P3S
Exact mass
1079.3605
Mol weight
1080.023
Structure
Reaction
Pathway
map01040  Biosynthesis of unsaturated fatty acids
map01100  Metabolic pathways
map01212  Fatty acid metabolism
Module
M00861  beta-Oxidation, peroxisome, VLCFA
Enzyme
2.3.1.16        2.3.1.176
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA07 Fatty esters
   FA0705 Fatty acyl CoAs
    C16173  (4Z,7Z,10Z,13Z,16Z)-Docosapentaenoyl-CoA
Other DBs
PubChem: 47205483
ChEBI: 76450
LIPIDMAPS: LMFA07050316
NIKKAJI: J2.798.509B
LinkDB
KCF data

ATOM        71
            1   S2a S    30.1000  -25.3400
            2   C1b C    31.2900  -24.6400
            3   C1b C    32.5500  -25.3400
            4   N1b N    33.7400  -24.6400
            5   C5a C    34.9300  -25.3400
            6   C1b C    36.1900  -24.6400
            7   C1b C    37.3800  -25.3400
            8   N1b N    38.5700  -24.6400
            9   C5a C    39.8300  -25.3400
            10  C1c C    41.0200  -24.6400
            11  C1d C    42.2100  -25.3400
            12  C1b C    43.4000  -24.6400
            13  O2b O    44.6600  -25.3400
            14  O5a O    34.9300  -26.7400
            15  O5a O    39.8300  -26.7400
            16  O1a O    41.0200  -23.2400
            17  C1a C    42.2100  -23.9400
            18  C1a C    42.2100  -26.7400
            19  P1b P    46.0600  -25.3400
            20  O1c O    47.4600  -25.3400
            21  O1c O    46.0600  -26.7400
            22  C1y C    39.5500  -20.3700
            23  C1y C    40.9500  -20.3700
            24  C1y C    41.3700  -19.0400
            25  O2x O    40.2500  -18.2000
            26  C1y C    39.1300  -19.0400
            27  C1b C    42.7000  -18.6200
            28  O1a O    38.7100  -21.4900
            29  O2b O    41.7900  -21.4900
            30  P1b P    43.1900  -21.4900
            31  O1c O    43.1900  -20.0900
            32  O1c O    44.5900  -21.4900
            33  O1c O    43.1900  -22.8900
            34  C8y C    35.0000  -17.2200
            35  C8y C    35.0000  -18.6200
            36  N4y N    37.4500  -18.6200
            37  C8x C    37.4500  -17.2200
            38  N5x N    36.1900  -16.5200
            39  C8y C    33.8100  -16.5200
            40  N5x N    32.5500  -17.2200
            41  C8x C    32.5500  -18.6200
            42  N5x N    33.8100  -19.3200
            43  N1a N    33.8100  -15.1200
            44  O2b O    44.6600  -19.0400
            45  P1b P    46.0600  -19.0400
            46  O1c O    46.0600  -17.6400
            47  O1c O    47.4600  -19.0400
            48  O2c O    46.0600  -22.2600
            49  C1b C    27.6500  -25.3400
            50  C5a C    28.9100  -24.6400
            51  O5a O    28.9100  -23.2400
            52  C1b C    26.4600  -24.6400
            53  C2b C    25.2700  -25.3400
            54  C2b C    23.8700  -25.3400
            55  C1b C    22.6800  -24.6400
            56  C2b C    21.4200  -25.3400
            57  C2b C    20.0200  -25.3400
            58  C1b C    18.8300  -24.6400
            59  C2b C    17.5700  -25.3400
            60  C2b C    16.1700  -25.3400
            61  C1b C    14.9100  -24.6400
            62  C2b C    13.7200  -25.3400
            63  C2b C    12.3200  -25.3400
            64  C1b C    11.1300  -24.6400
            65  C2b C     9.8700  -25.3400
            66  C2b C     8.4700  -25.3400
            67  C1b C     7.2800  -24.6400
            68  C1b C     6.0900  -25.3400
            69  C1b C     4.8300  -24.6400
            70  C1b C     3.6400  -25.3400
            71  C1a C     2.4500  -24.6400
BOND        73
            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    5  14 2
            14    9  15 2
            15   10  16 1 #Down
            16   11  17 1
            17   11  18 1
            18   13  19 1
            19   19  20 2
            20   19  21 1
            21   22  23 1
            22   23  24 1
            23   24  25 1
            24   25  26 1
            25   22  26 1
            26   24  27 1 #Down
            27   22  28 1 #Up
            28   23  29 1 #Up
            29   29  30 1
            30   30  31 1
            31   30  32 1
            32   30  33 2
            33   34  35 2
            34   35  36 1
            35   36  37 1
            36   37  38 2
            37   34  38 1
            38   34  39 1
            39   39  40 2
            40   40  41 1
            41   41  42 2
            42   35  42 1
            43   39  43 1
            44   26  36 1 #Down
            45   27  44 1
            46   44  45 1
            47   45  46 1
            48   45  47 2
            49   45  48 1
            50   19  48 1
            51   49  50 1
            52   50   1 1
            53   50  51 2
            54   53  52 1
            55   53  54 2
            56   54  55 1
            57   55  56 1
            58   56  57 2
            59   57  58 1
            60   58  59 1
            61   59  60 2
            62   60  61 1
            63   61  62 1
            64   62  63 2
            65   63  64 1
            66   64  65 1
            67   65  66 2
            68   66  67 1
            69   67  68 1
            70   68  69 1
            71   69  70 1
            72   70  71 1
            73   52  49 1

» Japanese version

DBGET integrated database retrieval system