KEGG   COMPOUND: C05413
Entry
C05413                      Compound                               
Name
all-trans-Phytoene
Formula
C40H64
Exact mass
544.5008
Mol weight
544.9362
Structure
Reaction
Pathway
map00906  Carotenoid biosynthesis
map01060  Biosynthesis of plant secondary metabolites
map01062  Biosynthesis of terpenoids and steroids
map01070  Biosynthesis of plant hormones
Enzyme
1.3.5.5         2.5.1.32
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0107 C40 isoprenoids (tetraterpenes)
    C05413  Phytoene
Phytochemical compounds [BR:br08003]
 Terpenoids
  Carotenoids and apocarotenoids
   Carotenoids
    C05413  Phytoene
Other DBs
CAS: 540-04-5
PubChem: 7779
ChEBI: 8191
LIPIDMAPS: LMPR01070254
KNApSAcK: C00000905
3DMET: B00773
NIKKAJI: J14.118F
LinkDB
KCF data

ATOM        40
            1   C1a C     7.7700  -11.4100
            2   C2c C     8.9824  -10.7100
            3   C2b C    10.1949  -11.4100
            4   C1b C    11.4073  -10.7100
            5   C1b C    12.6197  -11.4100
            6   C2c C    13.8322  -10.7100
            7   C2b C    15.0446  -11.4100
            8   C1b C    16.2570  -10.7100
            9   C1b C    17.4695  -11.4100
            10  C2c C    18.6819  -10.7100
            11  C2b C    19.8944  -11.4100
            12  C1b C    21.1068  -10.7100
            13  C1b C    22.3192  -11.4100
            14  C2c C    23.5317  -10.7100
            15  C2b C    24.7441  -11.4100
            16  C2b C    25.9565  -10.7100
            17  C2b C    27.1690  -11.4100
            18  C2b C    28.3814  -10.7100
            19  C2c C    29.5938  -11.4100
            20  C1b C    30.8063  -10.7100
            21  C1b C    32.0187  -11.4100
            22  C2b C    33.2311  -10.7100
            23  C2c C    34.4436  -11.4100
            24  C1b C    35.6560  -10.7100
            25  C1b C    36.8685  -11.4100
            26  C2b C    38.0809  -10.7100
            27  C2c C    39.2933  -11.4100
            28  C1b C    40.5058  -10.7100
            29  C1b C    41.7182  -11.4100
            30  C2b C    42.9306  -10.7100
            31  C1a C     8.9824   -9.3102
            32  C1a C    13.8322   -9.3103
            33  C1a C    18.6819   -9.3100
            34  C1a C    23.5317   -9.3100
            35  C1a C    29.5938  -12.8099
            36  C1a C    34.4436  -12.8100
            37  C1a C    39.2933  -12.8098
            38  C2c C    44.1275  -11.4012
            39  C1a C    45.3155  -10.7153
            40  C1a C    44.1276  -12.8097
BOND        39
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 2
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 2
            11   11  12 1
            12   12  13 1
            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 1
            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    2  31 1
            31    6  32 1
            32   10  33 1
            33   14  34 1
            34   19  35 1
            35   23  36 1
            36   27  37 1
            37   30  38 2
            38   38  39 1
            39   38  40 1

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