KEGG   COMPOUND: C15903
Entry
C15903                      Compound                               

Name
Spheroidenone;
Spheroiden-2-one
Formula
C41H58O2
Exact mass
582.4437
Mol weight
582.898
Structure
Reaction
Pathway
map00906  Carotenoid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.15.9       4.2.1.131
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0107 C40 isoprenoids (tetraterpenes)
    C15903  Spheroidenone
Other DBs
CAS: 13836-70-9
PubChem: 47205222
ChEBI: 62480
KNApSAcK: C00000914
NIKKAJI: J13.216K
KCF data

ATOM        43
            1   C1a C    12.3673  -20.8392
            2   C1d C    13.5811  -20.1390
            3   C5a C    14.7947  -20.8392
            4   C2b C    16.0085  -20.1390
            5   C2b C    17.2221  -20.8392
            6   C2c C    18.4358  -20.1390
            7   C2b C    19.6496  -20.8392
            8   C2b C    20.8632  -20.1390
            9   C2b C    22.0769  -20.8392
            10  C2c C    23.2906  -20.1390
            11  C2b C    24.5043  -20.8392
            12  C2b C    25.7179  -20.1390
            13  C2b C    26.9317  -20.8392
            14  C2c C    28.1454  -20.1390
            15  C2b C    29.3590  -20.8392
            16  C2b C    30.5728  -20.1390
            17  C2b C    31.7864  -20.8392
            18  C2b C    33.0001  -20.1390
            19  C2c C    34.2139  -20.8392
            20  C2b C    35.4275  -20.1390
            21  C2b C    36.6412  -20.8392
            22  C2b C    37.8549  -20.1390
            23  C2c C    39.0686  -20.8392
            24  C1b C    40.2823  -20.1390
            25  C1b C    41.4961  -20.8392
            26  C2b C    42.7098  -20.1390
            27  C2c C    43.9234  -20.8392
            28  C1b C    45.0905  -20.1390
            29  C1b C    46.3041  -20.8392
            30  C2b C    47.5179  -20.1390
            31  C2c C    48.7316  -20.8392
            32  C1a C    49.9452  -20.1390
            33  O2a O    13.5811  -18.7386
            34  C1a C    18.4358  -18.7386
            35  C1a C    23.2906  -18.7386
            36  C1a C    28.1454  -18.7386
            37  C1a C    34.2139  -22.2396
            38  C1a C    39.0686  -22.2396
            39  C1a C    43.9234  -22.2396
            40  C1a C    48.7316  -22.2396
            41  C1a C    12.3685  -19.4390
            42  C1a C    12.3687  -18.0386
            43  O5a O    14.7950  -22.2598
BOND        42
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     6   7 2
            7     7   8 1
            8     8   9 2
            9     9  10 1
            10   10  11 2
            11   11  12 1
            12   12  13 2
            13   13  14 1
            14   14  15 2
            15   15  16 1
            16   16  17 2
            17   17  18 1
            18   18  19 2
            19   19  20 1
            20   20  21 2
            21   21  22 1
            22   22  23 2
            23   23  24 1
            24   24  25 1
            25   25  26 1
            26   26  27 2
            27   27  28 1
            28   28  29 1
            29   29  30 1
            30   30  31 2
            31   31  32 1
            32    2  33 1
            33    6  34 1
            34   10  35 1
            35   14  36 1
            36   19  37 1
            37   23  38 1
            38   27  39 1
            39   31  40 1
            40    2  41 1
            41   33  42 1
            42    3  43 2

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