KEGG   COMPOUND: C16282
Entry
C16282                      Compound                               
Name
Caloxanthin
Formula
C40H56O3
Exact mass
584.4229
Mol weight
584.8708
Structure
Reaction
Pathway
map00906  Carotenoid biosynthesis
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0107 C40 isoprenoids (tetraterpenes)
    C16282  Caloxanthin
Other DBs
PubChem: 47205590
ChEBI: 80419
LIPIDMAPS: LMPR01070134
KNApSAcK: C00022906
NIKKAJI: J39.990F
KCF data

ATOM        43
            1   C2y C    48.7931  -21.9088
            2   C1z C    50.0017  -22.5981
            3   C2y C    48.7847  -20.5130
            4   C2b C    47.5676  -22.5981
            5   C1x C    51.2101  -21.9088
            6   C1x C    49.9931  -19.8150
            7   C1a C    47.5590  -19.8064
            8   C2b C    46.3675  -21.9002
            9   C1y C    51.2017  -20.5130
            10  C2c C    45.1506  -22.5981
            11  O1a O    52.4101  -19.7894
            12  C2b C    43.9418  -21.8918
            13  C1a C    45.1419  -24.0023
            14  C2b C    42.7162  -22.5895
            15  C2b C    41.5078  -21.8918
            16  C2c C    40.2908  -22.5812
            17  C2b C    39.0820  -21.8831
            18  C1a C    40.2821  -23.9853
            19  C2b C    37.8650  -22.5725
            20  C2b C    36.6565  -21.8746
            21  C2b C    35.4478  -22.5725
            22  C2c C    34.2394  -21.8831
            23  C2b C    33.0224  -22.5812
            24  C1a C    34.2308  -20.4790
            25  C2b C    31.8137  -21.8918
            26  C2b C    30.6054  -22.5895
            27  C2c C    29.3966  -21.8918
            28  C2b C    28.1880  -22.5981
            29  C1a C    29.3880  -20.4874
            30  C2b C    26.9796  -21.9002
            31  C2y C    25.7709  -22.5981
            32  C1z C    24.5539  -21.9002
            33  C2y C    25.7709  -24.0110
            34  C1y C    23.3368  -22.6065
            35  C1x C    24.5539  -24.7173
            36  C1a C    26.9796  -24.7089
            37  C1y C    23.3368  -24.0110
            38  O1a O    22.1113  -24.7089
            39  C1a C    25.5420  -20.9121
            40  C1a C    23.7007  -20.7911
            41  C1a C    49.3029  -23.8083
            42  C1a C    50.9898  -23.5862
            43  O1a O    22.1052  -21.8970
BOND        44
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     3   7 1
            7     4   8 2
            8     5   9 1
            9     8  10 1
            10    9  11 1 #Up
            11   10  12 2
            12   10  13 1
            13   12  14 1
            14   14  15 2
            15   15  16 1
            16   16  17 2
            17   16  18 1
            18   17  19 1
            19   19  20 2
            20   20  21 1
            21   21  22 2
            22   22  23 1
            23   22  24 1
            24   23  25 2
            25   25  26 1
            26   26  27 2
            27   27  28 1
            28   27  29 1
            29   28  30 2
            30   30  31 1
            31   31  32 1
            32   31  33 2
            33   32  34 1
            34   33  35 1
            35   33  36 1
            36   34  37 1
            37   37  38 1 #Up
            38    6   9 1
            39   35  37 1
            40   32  39 1
            41   32  40 1
            42    2  41 1
            43    2  42 1
            44   34  43 1 #Down

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