KEGG   COMPOUND: C08592Help
Entry
C08592                      Compound                               

Name
Echinenone
Formula
C40H54O
Exact mass
550.4175
Mol weight
550.8562
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Carotenoid biosynthesis
Enzyme
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0107 C40 isoprenoids (tetraterpenes)
    C08592  Echinenone
BRITE hierarchy
Other DBs
CAS: 
432-68-8
PubChem: 
ChEBI: 
LIPIDMAPS: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        41
            1   C2y C    14.9918  -20.2469
            2   C1z C    13.7868  -19.5428
            3   C2y C    14.9918  -21.6473
            4   C2b C    16.2043  -19.5428
            5   C1x C    12.5663  -20.2469
            6   C1a C    13.0671  -18.3221
            7   C1a C    14.4675  -18.3221
            8   C5x C    13.7868  -22.3436
            9   C1a C    16.2123  -22.3436
            10  C2b C    17.4014  -20.2546
            11  C1x C    12.5663  -21.6473
            12  O5x O    13.7868  -23.7443
            13  C2c C    18.6142  -19.5506
            14  C2b C    19.8269  -20.2546
            15  C1a C    18.6221  -18.1502
            16  C2b C    21.0397  -19.5585
            17  C2b C    22.2524  -20.2626
            18  C2c C    23.4650  -19.5662
            19  C2b C    24.6777  -20.2703
            20  C1a C    23.4650  -18.1658
            21  C2b C    25.8828  -19.5739
            22  C2b C    27.0953  -20.2782
            23  C2b C    28.3080  -19.5819
            24  C2c C    29.5131  -20.2859
            25  C2b C    30.7258  -19.5896
            26  C1a C    29.5131  -21.6865
            27  C2b C    31.9384  -20.2939
            28  C2b C    33.1511  -19.5975
            29  C2c C    34.3639  -20.3016
            30  C2b C    35.5687  -19.6052
            31  C1a C    34.3639  -21.7022
            32  C2b C    36.7814  -20.3095
            33  C2y C    37.9942  -19.6132
            34  C1z C    39.2069  -20.3172
            35  C2y C    37.9942  -18.2126
            36  C1x C    40.4197  -19.6132
            37  C1a C    39.8953  -21.5223
            38  C1a C    38.4950  -21.5223
            39  C1x C    39.2069  -17.5162
            40  C1a C    36.7814  -17.5085
            41  C1x C    40.4197  -18.2126
BOND        42
            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    8  12 2
            12   10  13 1
            13   13  14 2
            14   13  15 1
            15   14  16 1
            16   16  17 2
            17   17  18 1
            18   18  19 2
            19   18  20 1
            20   19  21 1
            21   21  22 2
            22   22  23 1
            23   23  24 2
            24   24  25 1
            25   24  26 1
            26   25  27 2
            27   27  28 1
            28   28  29 2
            29   29  30 1
            30   29  31 1
            31   30  32 2
            32   32  33 1
            33   33  34 1
            34   33  35 2
            35   34  36 1
            36   34  37 1
            37   34  38 1
            38   35  39 1
            39   35  40 1
            40   36  41 1
            41    8  11 1
            42   39  41 1

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