KEGG   COMPOUND: C07667Help
Entry
C07667                      Compound                               

Name
Gossypol
Formula
C30H30O8
Exact mass
518.1941
Mol weight
518.5544
Structure
Mol fileKCF fileDB searchJmolKegDraw
Comment
Source: Gossypium [TAX:3633]
Reaction
Pathway
Sesquiterpenoid and triterpenoid biosynthesis
Biosynthesis of terpenoids and steroids
Biosynthesis of secondary metabolites
Brite
Compounds with biological roles [BR:br08001]
 Phytochemical compounds
  Terpenoids
   C07667  Gossypol
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0103 C15 isoprenoids (sesquiterpenes)
    PR010333 Cadinane sesquiterpenoids
     C07667  Gossypol
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Cadinanes
    C07667  Gossypol
BRITE hierarchy
Other DBs
CAS: 
303-45-7
PubChem: 
LIPIDMAPS: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        38
            1   C8y C    25.8169  -15.1752
            2   C8y C    25.8112  -16.5789
            3   C8y C    24.6112  -14.4703
            4   C8x C    27.0343  -14.4762
            5   C8y C    24.6112  -17.2721
            6   C8y C    27.0227  -17.2778
            7   C8y C    23.3940  -15.1752
            8   C1c C    24.6112  -13.0724
            9   C8y C    28.2459  -15.1868
            10  C8y C    23.3940  -16.5789
            11  C4a C    24.6112  -18.6758
            12  C8y C    28.3100  -16.5905
            13  O1a O    27.0169  -18.6815
            14  O1a O    22.1767  -14.4703
            15  C1a C    25.8286  -12.3793
            16  C1a C    23.3998  -12.3736
            17  C1a C    29.4574  -14.4879
            18  O1a O    22.1767  -17.2778
            19  O4a O    23.3998  -19.3805
            20  C8y C    29.4457  -17.2895
            21  C8y C    30.6573  -16.5964
            22  C8y C    29.5041  -18.6874
            23  C8y C    31.8631  -17.3011
            24  O1a O    30.6573  -15.1985
            25  C8x C    30.6398  -19.3980
            26  C1a C    28.2226  -19.3864
            27  C8y C    31.8571  -18.6932
            28  C8y C    33.0803  -16.6079
            29  C8y C    33.0688  -19.4038
            30  C8y C    34.2860  -17.3069
            31  C4a C    33.0862  -15.2102
            32  C8y C    34.2802  -18.7048
            33  C1c C    33.0629  -20.8017
            34  O1a O    35.5033  -16.6196
            35  O4a O    34.3035  -14.5112
            36  O1a O    35.4917  -19.4154
            37  C1a C    31.8455  -21.4949
            38  C1a C    34.2743  -21.5064
BOND        41
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 2
            9     5  10 2
            10    5  11 1
            11    6  12 2
            12    6  13 1
            13    7  14 1
            14    8  15 1
            15    8  16 1
            16    9  17 1
            17   10  18 1
            18   11  19 2
            19   12  20 1
            20   20  21 2
            21   20  22 1
            22   21  23 1
            23   21  24 1
            24   22  25 2
            25   22  26 1
            26   23  27 2
            27   23  28 1
            28   27  29 1
            29   28  30 2
            30   28  31 1
            31   29  32 2
            32   29  33 1
            33   30  34 1
            34   31  35 2
            35   32  36 1
            36   33  37 1
            37   33  38 1
            38    7  10 1
            39    9  12 1
            40   25  27 1
            41   30  32 1

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