KEGG   COMPOUND: C15957
Entry
C15957                      Compound                               
Name
Thermozeaxanthin-15
Formula
C61H94O8
Exact mass
954.6949
Mol weight
955.3943
Structure
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0107 C40 isoprenoids (tetraterpenes)
    C15957  Thermozeaxanthin-15
Other DBs
PubChem: 47205270
ChEBI: 80206
LIPIDMAPS: LMPR01070108
NIKKAJI: J1.799.729G
LinkDB
KCF data

ATOM        69
            1   C2y C    26.0317  -19.7176
            2   C1z C    24.7693  -19.0163
            3   C2y C    26.0317  -21.1205
            4   C2b C    27.2242  -19.0163
            5   C1x C    23.5768  -19.7176
            6   C1a C    25.4707  -17.7538
            7   C1a C    24.0679  -17.7538
            8   C1x C    24.7693  -21.8219
            9   C1a C    27.2242  -21.8219
            10  C2b C    28.4166  -19.7176
            11  C1y C    23.5768  -21.1205
            12  C2c C    29.6791  -19.0163
            13  C2b C    30.8714  -19.7176
            14  C1a C    29.6791  -17.6135
            15  C2b C    32.0639  -19.0163
            16  C2b C    33.3264  -19.7176
            17  C2c C    34.5187  -19.0163
            18  C2b C    35.7112  -19.7176
            19  C1a C    34.5187  -17.6135
            20  C2b C    36.9737  -19.0163
            21  C2b C    38.1660  -19.7176
            22  C2b C    39.3585  -19.0163
            23  C2c C    40.5508  -19.7176
            24  C2b C    41.8134  -19.0163
            25  C1a C    40.5508  -21.1205
            26  C2b C    43.0057  -19.7176
            27  C2b C    44.1981  -19.0163
            28  C2c C    45.4605  -19.7176
            29  C2b C    46.6530  -19.0863
            30  C1a C    45.4605  -21.1205
            31  C2b C    47.8454  -19.7877
            32  C2y C    49.1080  -19.0863
            33  C1z C    50.3003  -19.7877
            34  C2y C    49.1080  -17.6835
            35  C1x C    51.4927  -19.0863
            36  C1a C    49.9496  -21.1205
            37  C1a C    51.0016  -20.9801
            38  C1x C    50.3003  -16.9822
            39  C1a C    47.8454  -16.9822
            40  C1y C    51.4927  -17.6835
            41  O2a O    22.3846  -21.8219
            42  C1y C    21.1369  -22.4817
            43  O2x O    19.9710  -21.8211
            44  C1y C    18.7233  -22.4808
            45  C1y C    18.7553  -23.8834
            46  C1y C    19.9782  -24.5850
            47  C1y C    21.1689  -23.8842
            48  C1b C    17.5004  -21.7793
            49  O7a O    16.3098  -22.4801
            50  O1a O    17.5202  -24.6177
            51  O1a O    22.3955  -24.5670
            52  O1a O    19.9860  -25.9979
            53  C7a C    15.0639  -21.7753
            54  O6a O    15.0567  -20.3524
            55  C1b C    13.8452  -22.4900
            56  C1b C    12.6564  -21.8144
            57  C1b C    11.4720  -22.5090
            58  C1b C    10.2670  -21.8240
            59  C1c C     9.0907  -22.5137
            60  C1a C     7.8817  -21.8263
            61  C1a C     9.1002  -23.9080
            62  O1a O    52.6776  -17.0064
            63  C1b C    11.4720  -22.5090
            64  C1b C    11.4720  -22.5090
            65  C1b C    11.4720  -22.5090
            66  C1b C    11.4720  -22.5090
            67  C1b C    11.4720  -22.5090
            68  C1b C    11.4720  -22.5090
            69  C1b C    11.4720  -22.5090
BOND        71
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 2
            10    5  11 1
            11   10  12 1
            12   12  13 2
            13   12  14 1
            14   13  15 1
            15   15  16 2
            16   16  17 1
            17   17  18 2
            18   17  19 1
            19   18  20 1
            20   20  21 2
            21   21  22 1
            22   22  23 2
            23   23  24 1
            24   23  25 1
            25   24  26 2
            26   26  27 1
            27   27  28 2
            28   28  29 1
            29   28  30 1
            30   29  31 2
            31   31  32 1
            32   32  33 1
            33   32  34 2
            34   33  35 1
            35   33  36 1
            36   33  37 1
            37   34  38 1
            38   34  39 1
            39   35  40 1
            40   38  40 1
            41   11   8 1
            42   11  41 1 #Up
            43   42  43 1
            44   43  44 1
            45   44  45 1
            46   45  46 1
            47   46  47 1
            48   42  47 1
            49   41  42 1
            50   48  49 1
            51   44  48 1 #Up
            52   45  50 1 #Down
            53   47  51 1 #Down
            54   46  52 1 #Up
            55   49  53 1
            56   53  54 2
            57   53  55 1
            58   55  56 1
            59   58  59 1
            60   59  60 1
            61   59  61 1
            62   40  62 1 #Up
            63   56  57 1
            64   57  63 1
            65   63  64 1
            66   64  65 1
            67   65  66 1
            68   66  67 1
            69   67  68 1
            70   68  69 1
            71   69  58 1
BRACKET     1    10.8500  -23.3800   10.8500  -21.1400
            1    11.9700  -21.1400   11.9700  -23.3800
            1  8
 ORIGINAL  1   57
 REPEAT    1   63  64  65  66  67  68  69

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