KEGG   COMPOUND: C20484
Entry
C20484                      Compound                               
Name
9-cis-beta-Carotene
Formula
C40H56
Exact mass
536.4382
Mol weight
536.8726
Structure
Reaction
Pathway
map00906  Carotenoid biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
1.13.11.68      5.2.1.14
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0107 C40 isoprenoids (tetraterpenes)
    C20484  9-cis-beta-Carotene
Other DBs
PubChem: 163312221
ChEBI: 67188
LIPIDMAPS: LMPR01070624
KCF data

ATOM        40
            1   C1x C     5.6000   -7.3500
            2   C1x C     5.6000   -8.7500
            3   C1x C     6.8124   -9.4500
            4   C2y C     8.0249   -8.7500
            5   C2y C     8.0249   -7.3500
            6   C1z C     6.8124   -6.6500
            7   C2b C     9.2624   -6.6500
            8   C2b C    10.4749   -7.3500
            9   C2c C    11.6873   -6.6500
            10  C2b C    12.8997   -7.3500
            11  C1a C     9.2560   -9.4610
            12  C1a C     7.5124   -5.4376
            13  C1a C     6.1124   -5.4376
            14  C1a C    11.6873   -5.2500
            15  C2b C    12.8851   -8.7500
            16  C2b C    14.1000   -9.4456
            17  C2c C    14.0351  -10.8456
            18  C2b C    15.3201  -11.5412
            19  C2b C    15.3251  -12.9412
            20  C2b C    16.5401  -13.6368
            21  C2b C    16.5452  -15.0368
            22  C2c C    17.7601  -15.7324
            23  C2b C    17.7652  -17.1324
            24  C2b C    18.9802  -17.8280
            25  C1a C    12.9197  -11.5362
            26  C1a C    18.9769  -15.0238
            27  C2b C    18.9728  -19.2500
            28  C2c C    20.1866  -19.9476
            29  C2b C    20.1894  -21.3476
            30  C1a C    21.3766  -19.2572
            31  C2b C    21.3819  -22.0333
            32  C2y C    21.3848  -23.4496
            33  C2y C    20.1479  -24.1676
            34  C1x C    20.1511  -25.5676
            35  C1x C    21.3652  -26.2647
            36  C1x C    22.6022  -25.5467
            37  C1z C    22.5989  -24.1468
            38  C1a C    18.9355  -23.4713
            39  C1a C    23.2989  -22.9343
            40  C1a C    23.9989  -24.1468
BOND        41
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 1
            7     5   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    4  11 1
            12    6  12 1
            13    6  13 1
            14    9  14 1
            15   10  15 1
            16   15  16 2
            17   16  17 1
            18   17  18 2
            19   18  19 1
            20   19  20 2
            21   20  21 1
            22   21  22 2
            23   22  23 1
            24   23  24 2
            25   17  25 1
            26   22  26 1
            27   24  27 1
            28   27  28 2
            29   28  29 1
            30   28  30 1
            31   29  31 2
            32   31  32 1
            33   32  33 2
            34   33  34 1
            35   34  35 1
            36   35  36 1
            37   36  37 1
            38   32  37 1
            39   33  38 1
            40   37  39 1
            41   37  40 1

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