KEGG   COMPOUND: C15943Help
Entry
C15943                      Compound                               

Name
Isorenieratene
Formula
C40H48
Exact mass
528.3756
Mol weight
528.8091
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00906  Carotenoid biosynthesis
Enzyme
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0107 C40 isoprenoids (tetraterpenes)
    C15943  Isorenieratene
BRITE hierarchy
Other DBs
PubChem: 47205259
ChEBI: 80196
KNApSAcK: C00022816
NIKKAJI: J450.759B
LinkDB All DBs
KCF data Show

ATOM        40
            1   C8y C    17.2245  -20.5487
            2   C8x C    17.2245  -21.9498
            3   C8x C    18.4378  -22.6503
            4   C8y C    19.6512  -21.9498
            5   C8y C    19.6512  -20.5487
            6   C8y C    18.4378  -19.8482
            7   C2b C    20.8664  -19.8482
            8   C2b C    22.0797  -20.5487
            9   C2c C    23.2931  -19.8482
            10  C2b C    24.5064  -20.5487
            11  C2b C    25.7198  -19.8482
            12  C2b C    26.9332  -20.5487
            13  C2c C    28.1465  -19.8482
            14  C2b C    29.3599  -20.5487
            15  C2b C    30.5732  -19.8482
            16  C2b C    31.7866  -20.5487
            17  C2b C    33.0000  -19.8482
            18  C2c C    34.2133  -20.5487
            19  C2b C    35.4266  -19.8482
            20  C2b C    36.6401  -20.5487
            21  C2b C    37.8534  -19.8482
            22  C2c C    39.0667  -20.5487
            23  C2b C    40.2801  -19.8482
            24  C2b C    41.4935  -20.5487
            25  C8y C    42.7068  -19.8482
            26  C8y C    43.9381  -20.5487
            27  C8y C    45.1470  -19.8406
            28  C8x C    45.1381  -18.4395
            29  C8x C    43.9068  -17.7390
            30  C8y C    42.7446  -18.4471
            31  C1a C    41.5170  -17.7356
            32  C1a C    39.0667  -21.9498
            33  C1a C    34.2133  -21.9498
            34  C1a C    28.1465  -18.4471
            35  C1a C    23.2931  -18.4471
            36  C1a C    20.8660  -22.6511
            37  C1a C    18.4378  -18.4482
            38  C1a C    16.0224  -19.8550
            39  C1a C    43.9467  -21.9799
            40  C1a C    46.3528  -20.5263
BOND        41
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     5   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 2
            15   14  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   24  25 1
            26   25  26 1
            27   26  27 2
            28   27  28 1
            29   28  29 2
            30   29  30 1
            31   25  30 2
            32   30  31 1
            33   22  32 1
            34   18  33 1
            35   13  34 1
            36    9  35 1
            37    4  36 1
            38    6  37 1
            39    1  38 1
            40   26  39 1
            41   27  40 1

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